###
### Radius of Kikuchi pattern R = 1.2212 (used for computation of figure of merit)
### Upper bound h of band-widths (on screen) = 0.308593
###
###
### Bravais-type: number of indexing solutions (best figure of merit)
###

(1) Triclinic : 76 (30.3828)
(2) Monoclinic(P) : 71 (12.8025)
(3) Monoclinic(C) : 378 (31.8758)
(4) Orthorhombic(P) : 13 (9.62773)
(5) Orthorhombic(C) : 77 (12.7834)
(6) Orthorhombic(I) : 35 (31.0455)
(7) Orthorhombic(F) : 92 (33.3607)
(8) Tetragonal(P) : 32 (10.1636)
(9) Tetragonal(I) : 91 (33.6588)
(10) Trigonal : 132 (33.6854)
(11) Hexagonal : 0
(12) Cubic(P) : 8 (10.0767)
(13) Cubic(I) : 29 (33.6715)
(14) Cubic(F) : 0

###                                ###
### Candidates for        Cubic(F) ###
###                                ###

###                                ###
### Candidates for        Cubic(I) ###
###                                ###

###            No.1                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2595    1.2601    1.2602   90.0865   89.9508   90.1316      0.4144
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1436   -0.1454    0.7672)
 a2 = (   -0.7569   -0.2152    0.1027)
 a3 = (    0.1879   -0.7501   -0.1781)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
 a2 = (   -0.7569   -0.2159    0.1026) (    0.0014    0.0043    0.0033)
 a3 = (    0.1898   -0.7499   -0.1779) (    0.0042    0.0013    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.3793  102.9510   14.2003    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             75             57
# Figure of merit at the beginning and the end of the refinement
        16.2101        33.6715
# Chi-squares at the beginning and the end of the refinement
    0.0640    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0615    0.0702
    2    0   -1   -3   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0922    0.0995
    3    1    0    3   -0.0264    0.0894   -0.0262    0.0895    0.0002    1    0.0902    0.0967
    4    1   -1   -2   -0.1954   -0.5847   -0.1957   -0.5833    0.0014    1    0.0956    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0595    0.0654
    6    1   -1    2   -0.1071    0.1200   -0.1085    0.1216    0.0021    1    0.0709    0.0778
    7    1    0   -3    0.1187   -0.5946    0.1201   -0.5973    0.0031    1    0.1224    0.1302
    8    0    1   -3    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0955    0.1017
    9    1   -2    1   -0.1955    0.0493   -0.1952    0.0486    0.0007    1    0.0720    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0426    0.0467
   11    1    1   -2    0.5326   -0.6136    0.5303   -0.6130    0.0023    1    0.1150    0.1248
   12    1   -3    0   -0.1823   -0.0378   -0.1829   -0.0381    0.0006    1    0.0925    0.0984
   13    0    3   -1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0929    0.0927
   14    1    3   -2    0.5294   -0.1500    0.5293   -0.1451    0.0049    1    0.1380    0.1473
   15    1   -2   -1   -0.3365   -0.2370   -0.3362   -0.2357    0.0013    1    0.0810    0.0881
   16    0    2    0    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0575    0.0679
   17    1    2   -1    0.7294   -0.0815    0.7293   -0.0807    0.0008    1    0.1066    0.1198
   18    2    2   -2    1.0580   -0.5142    1.0696   -0.4972    0.0206    1    0.2345    0.2483
   19    0    3    1    0.0431    0.0289    0.0442    0.0295    0.0013    1    0.0897    0.0994
   20    1    3    0    0.4441    0.1652    0.4423    0.1634    0.0025    1    0.1096    0.1178
   21    0   -1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0402    0.0568
   22    1    2    1    0.2976    0.3338    0.3053    0.3413    0.0107    1    0.0832    0.0899
   23    1    1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0745    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0   -1   -3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    1    0    3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1   -1   -2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0   -2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1   -1    2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    1    0   -3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0    1   -3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1   -2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    1   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    1   -2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1   -3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0    3   -1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    3   -2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1   -2   -1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1    2   -1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2    2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0    3    1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1    3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0   -1   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    2    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1    1    2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.2                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2572    1.2574    1.2653   90.7433   89.4518   90.0147      0.5849
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7588    0.2152   -0.1031)
 a2 = (   -0.1888    0.7517    0.1786)
 a3 = (    0.1352   -0.1373    0.7666)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7569    0.2159   -0.1026) (    0.0014    0.0043    0.0033)
 a2 = (   -0.1898    0.7499    0.1779) (    0.0042    0.0013    0.0034)
 a3 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -29.9706   14.9936   45.0371    0.9370    0.2563    1.0418
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             91             58
# Figure of merit at the beginning and the end of the refinement
         4.5957        33.4768
# Chi-squares at the beginning and the end of the refinement
    0.4323    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7366   -0.0642   -0.7310   -0.0567    0.0094    1    0.0868    0.0702
    2    1    3    0   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1305    0.0995
    3    0   -3    1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4    1    2    1   -0.1904   -0.5832   -0.1957   -0.5833    0.0053    1    0.1352    0.1078
    5    0    2    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0842    0.0654
    6    1   -2    1   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7    0    3    1    0.1203   -0.5904    0.1201   -0.5973    0.0069    1    0.1734    0.1302
    8   -1    3    0    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1354    0.1017
    9    2   -1    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0603    0.0467
   11   -1    2    1    0.5278   -0.6067    0.5303   -0.6130    0.0067    1    0.1624    0.1248
   12    3    0    1   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13   -3    1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1316    0.0927
   14   -3    2    1    0.5259   -0.1504    0.5293   -0.1451    0.0063    1    0.1958    0.1473
   15    2    1    1   -0.3344   -0.2387   -0.3362   -0.2357    0.0035    1    0.1144    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0814    0.0679
   17   -2    1    1    0.7228   -0.0846    0.7293   -0.0807    0.0076    1    0.1507    0.1198
   18   -2    2    2    1.0393   -0.5107    1.0696   -0.4972    0.0331    1    0.3287    0.2483
   19   -3   -1    0    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1270    0.0994
   20   -3    0    1    0.4432    0.1621    0.4423    0.1634    0.0016    1    0.1553    0.1178
   21    1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -2   -1    1    0.2994    0.3310    0.3053    0.3413    0.0118    1    0.1176    0.0899
   23   -1   -2    1    0.0360    0.2714    0.0347    0.2716    0.0013    1    0.1050    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    1    3    0   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    0   -3    1   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    2    1   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    2    0    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1   -2    1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    0    3    1    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8   -1    3    0    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    2   -1    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10   -1    1    0    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    2    1    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    3    0    1   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -3    1    0    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -3    2    1    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2    1    1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -2    1    1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2    2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19   -3   -1    0    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -3    0    1    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1    1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -2   -1    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23   -1   -2    1    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.3                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2531    1.2622    1.2645   90.1344   90.5161   90.1641      0.5885
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1440    0.1411   -0.7722)
 a2 = (    0.7556    0.2143   -0.1041)
 a3 = (    0.1891   -0.7467   -0.1791)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1453    0.1451   -0.7667) (    0.0036    0.0036    0.0009)
 a2 = (    0.7569    0.2159   -0.1026) (    0.0014    0.0043    0.0033)
 a3 = (    0.1898   -0.7499   -0.1779) (    0.0042    0.0013    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.6207  102.9510   14.2003    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             87             58
# Figure of merit at the beginning and the end of the refinement
         4.5251        33.4768
# Chi-squares at the beginning and the end of the refinement
    0.5060    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7378   -0.0600   -0.7310   -0.0567    0.0076    1    0.0879    0.0702
    2    0    1   -3   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3   -1    0    3   -0.0270    0.0906   -0.0262    0.0895    0.0014    1    0.1276    0.0967
    4   -1    1   -2   -0.1962   -0.5897   -0.1957   -0.5833    0.0064    1    0.1365    0.1078
    5    0    0   -2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1    1    2   -0.1085    0.1206   -0.1085    0.1216    0.0010    1    0.1005    0.0778
    7   -1    0   -3    0.1209   -0.5994    0.1201   -0.5973    0.0022    1    0.1749    0.1302
    8    0   -1   -3    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -1    2    1   -0.1965    0.0489   -0.1952    0.0486    0.0013    1    0.1022    0.0726
   10    0   -1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -1   -1   -2    0.5371   -0.6175    0.5303   -0.6130    0.0081    1    0.1650    0.1248
   12   -1    3    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1313    0.0984
   13    0   -3   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -1   -3   -2    0.5338   -0.1514    0.5293   -0.1451    0.0078    1    0.1974    0.1473
   15   -1    2   -1   -0.3384   -0.2388   -0.3362   -0.2357    0.0038    1    0.1152    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1   -2   -1    0.7355   -0.0836    0.7293   -0.0807    0.0068    1    0.1529    0.1198
   18   -2   -2   -2    1.0639   -0.5199    1.0696   -0.4972    0.0235    1    0.3386    0.2483
   19    0   -3    1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -1   -3    0    0.4495    0.1660    0.4423    0.1634    0.0076    1    0.1564    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1   -2    1    0.3024    0.3380    0.3053    0.3413    0.0044    1    0.1184    0.0899
   23   -1   -1    2    0.0348    0.2758    0.0347    0.2716    0.0042    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0    1   -3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3   -1    0    3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -1    1   -2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0   -2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1    1    2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7   -1    0   -3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0   -1   -3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9   -1    2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -1   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1   -1   -2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12   -1    3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0   -3   -1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1   -3   -2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1    2   -1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -1   -2   -1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2   -2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0   -3    1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -1   -3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0    1   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1   -2    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23   -1   -1    2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.5                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2587    1.2594    1.2617   90.1358   89.9696   89.9476      0.3212
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1464    0.1464   -0.7670)
 a2 = (   -0.7573   -0.2148    0.1043)
 a3 = (   -0.1895    0.7484    0.1795)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1453    0.1451   -0.7667) (    0.0036    0.0036    0.0009)
 a2 = (   -0.7569   -0.2159    0.1026) (    0.0014    0.0043    0.0033)
 a3 = (   -0.1898    0.7499    0.1779) (    0.0042    0.0013    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.3793   77.0490 -165.7997    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             93             59
# Figure of merit at the beginning and the end of the refinement
         4.7664        33.2866
# Chi-squares at the beginning and the end of the refinement
    0.3469    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7292   -0.0552   -0.7310   -0.0567    0.0024    1    0.0475    0.0702
    2    0   -1    3   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0713    0.0995
    3   -1    0   -3   -0.0262    0.0877   -0.0262    0.0895    0.0017    1    0.0698    0.0967
    4   -1   -1    2   -0.1967   -0.5868   -0.1957   -0.5833    0.0036    1    0.0741    0.1078
    5    0    0    2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0461    0.0654
    6   -1   -1   -2   -0.1057    0.1177   -0.1085    0.1216    0.0047    1    0.0550    0.0778
    7   -1    0    3    0.1202   -0.5978    0.1201   -0.5973    0.0005    1    0.0950    0.1302
    8    0    1    3    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0741    0.1017
    9   -1   -2   -1   -0.1926    0.0484   -0.1952    0.0486    0.0026    1    0.0558    0.0726
   10    0    1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0331    0.0467
   11   -1    1    2    0.5366   -0.6156    0.5303   -0.6130    0.0068    1    0.0895    0.1248
   12   -1   -3    0   -0.1801   -0.0371   -0.1829   -0.0381    0.0029    1    0.0716    0.0984
   13    0    3    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0721    0.0927
   14   -1    3    2    0.5323   -0.1500    0.5293   -0.1451    0.0057    1    0.1073    0.1473
   15   -1   -2    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0627    0.0881
   16    0    4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0893    0.0679
   17   -1    2    1    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.0830    0.1198
   18   -2    2    2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1825    0.2483
   19    0    3   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0694    0.0994
   20   -1    3    0    0.4463    0.1661    0.4423    0.1634    0.0048    1    0.0851    0.1178
   21    0   -2    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0621    0.0568
   22   -1    2   -1    0.2985    0.3355    0.3053    0.3413    0.0089    1    0.0645    0.0899
   23   -1    1   -2    0.0339    0.2715    0.0347    0.2716    0.0008    1    0.0576    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0   -1    3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3   -1    0   -3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -1   -1    2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0    2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1   -1   -2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7   -1    0    3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0    1    3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9   -1   -2   -1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    1    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    1    2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12   -1   -3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0    3    1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    3    2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1   -2    1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -1    2    1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2    2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0    3   -1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -1    3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0   -1    1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1    2   -1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23   -1    1   -2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.6                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2539    1.2560    1.2700   89.8246   90.9219   89.8670      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7607   -0.2158    0.1048)
 a2 = (    0.1904   -0.7518   -0.1803)
 a3 = (    0.1332   -0.1465    0.7622)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7569   -0.2159    0.1026) (    0.0014    0.0043    0.0033)
 a2 = (    0.1898   -0.7499   -0.1779) (    0.0042    0.0013    0.0034)
 a3 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  150.0294   14.9936   45.0371    0.9370    0.2563    1.0418
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             95             60
# Figure of merit at the beginning and the end of the refinement
         4.1659        33.1007
# Chi-squares at the beginning and the end of the refinement
    0.4149    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2   -1   -3    0   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3    0    3    1   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4   -2   -4    2   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5    0   -2    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6   -1    2    1   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7    0   -3    1    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8    1   -3    0    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9   -2    1    1   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10    1   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11    1   -2    1    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12   -3    0    1   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13    3   -1    0    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14    3   -2    1    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15   -2   -1    1   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16    4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17    4   -2    2    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18    2   -2    2    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19    3    1    0    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20    3    0    1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21   -2   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22    2    1    1    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23    1    2    1    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2   -1   -3    0   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    0    3    1   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -1   -2    1   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0   -2    0    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1    2    1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    0   -3    1    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    1   -3    0    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9   -2    1    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    1   -1    0    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1   -2    1    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12   -3    0    1   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    3   -1    0    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    3   -2    1    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -2   -1    1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    2   -1    1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2   -2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    3    1    0    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    3    0    1    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1   -1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    2    1    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1    2    1    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.9                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2564    1.2565    1.2669   90.2048   89.9570   89.9926      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8084    2.8084    2.8084
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7593    0.2154   -0.1032)
 a2 = (    0.1890   -0.7522   -0.1787)
 a3 = (   -0.1445    0.1419   -0.7629)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7569    0.2159   -0.1026) (    0.0014    0.0043    0.0033)
 a2 = (    0.1898   -0.7499   -0.1779) (    0.0042    0.0013    0.0034)
 a3 = (   -0.1453    0.1451   -0.7667) (    0.0036    0.0036    0.0009)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -150.0299  165.0064 -134.9633    0.9370    0.2563    1.0418
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             91             61
# Figure of merit at the beginning and the end of the refinement
        11.9806        32.9194
# Chi-squares at the beginning and the end of the refinement
    0.0806    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2    1   -3    0   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    0    3   -1   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4    1   -2   -1   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0   -2    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6    1    2   -1   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    0   -3   -1    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8   -1   -3    0    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9    2    1   -1   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11   -1   -2   -1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12    3    0   -1   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13   -3   -1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14   -3   -2   -1    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15    2   -1   -1   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17   -2   -1   -1    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18   -2   -2   -2    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19   -3    1    0    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20   -3    0   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22   -2    1   -1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23   -1    2   -1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    1   -3    0   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    0    3   -1   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1   -2   -1   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0   -2    0    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    2   -1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    0   -3   -1    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8   -1   -3    0    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    2    1   -1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10   -1   -1    0    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1   -2   -1    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    3    0   -1   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -3   -1    0    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -3   -2   -1    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2   -1   -1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -2   -1   -1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2   -2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19   -3    1    0    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -3    0   -1    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1   -1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -2    1   -1    0.2980    0.3350    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23   -1    2   -1    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.10                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2576    1.2601    1.2622   89.8700   90.3813   89.1239      0.5875
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1345   -0.1450    0.7703)
 a2 = (    0.7569    0.2147   -0.1043)
 a3 = (   -0.1894    0.7481    0.1794)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
 a2 = (    0.7569    0.2159   -0.1026) (    0.0014    0.0043    0.0033)
 a3 = (   -0.1898    0.7499    0.1779) (    0.0042    0.0013    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.6207   77.0490 -165.7997    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
             91             61
# Figure of merit at the beginning and the end of the refinement
         4.5071        32.9189
# Chi-squares at the beginning and the end of the refinement
    0.6409    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7426   -0.0580   -0.7310   -0.0567    0.0117    1    0.0875    0.0702
    2    0    1    3   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    1    0   -3   -0.0263    0.0894   -0.0262    0.0895    0.0001    1    0.1276    0.0967
    4    1    1    2   -0.1935   -0.5912   -0.1957   -0.5833    0.0082    1    0.1361    0.1078
    5    0    0    2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1    1   -2   -0.1070    0.1201   -0.1085    0.1216    0.0021    1    0.1003    0.0778
    7    1    0    3    0.1236   -0.5978    0.1201   -0.5973    0.0034    1    0.1745    0.1302
    8    0   -1    3    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1    2   -1   -0.1956    0.0494   -0.1952    0.0486    0.0008    1    0.1017    0.0726
   10    0   -1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1   -1    2    0.5384   -0.6110    0.5303   -0.6130    0.0083    1    0.1644    0.1248
   12    1    3    0   -0.1824   -0.0378   -0.1829   -0.0381    0.0006    1    0.1307    0.0984
   13    0   -3    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    1   -3    2    0.5313   -0.1493    0.5293   -0.1451    0.0047    1    0.1973    0.1473
   15    1    2    1   -0.3385   -0.2395   -0.3362   -0.2357    0.0045    1    0.1146    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1   -2    1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1524    0.1198
   18    2   -2    2    1.0565   -0.5053    1.0696   -0.4972    0.0154    1    0.3347    0.2483
   19    0   -3   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    1   -3    0    0.4461    0.1648    0.4423    0.1634    0.0040    1    0.1565    0.1178
   21    0    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1   -2   -1    0.3006    0.3340    0.3053    0.3413    0.0087    1    0.1185    0.0899
   23    1   -1   -2    0.0359    0.2732    0.0347    0.2716    0.0019    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0    1    3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    1    0   -3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    1    2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0    2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    1   -2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    1    0    3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0   -1    3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1    2   -1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -1    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1   -1    2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1    3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0   -3    1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -3    2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1    2    1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1   -2    1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2   -2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2532          0.2483
   19    0   -3   -1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1   -3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0    1    1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1   -2   -1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1   -1   -2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.20                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2515    1.2539    1.2752   89.0386   91.2081   91.0908      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1893   -0.7556   -0.1794)
 a2 = (    0.1625   -0.1567    0.7651)
 a3 = (   -0.7445   -0.2270    0.0982)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1898   -0.7499   -0.1779) (    0.0042    0.0013    0.0034)
 a2 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
 a3 = (   -0.7569   -0.2159    0.1026) (    0.0014    0.0043    0.0033)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.0625   82.5743  -74.0821    0.2578    0.2431    0.3301
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            400             69
# Figure of merit at the beginning and the end of the refinement
         8.6014        31.5940
# Chi-squares at the beginning and the end of the refinement
    0.3485    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -3    0   -1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    3    1    0   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -2    1   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    2    1   -1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -3    1    0    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -3    0    1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    1    1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -2    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    0    1   -3   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -1    0    3    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -2    1    3    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1    1   -2   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0    0    2    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1    1    2    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    2    2    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1    0    3    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    0    1    3    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1    0   -1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    1    1    2    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    2    1    1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2   -3    0   -1   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    3    1    0   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -2    1   -1   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5   -2    0    0    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    2    1   -1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7   -3    1    0    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8   -3    0    1    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1    1   -2   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10   -1    0    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -2    1    1    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    0    1   -3   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -1    0    3    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -2    1    3    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1    1   -2   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    0    2    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -1    1    2    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2    2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    1    0    3    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    0    1    3    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1    0   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    1    2    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    2    1    1    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.23                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2381    1.2620    1.2807   90.8403   91.7366   90.0058      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8084    2.8084    2.8084
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1722   -0.1402    0.7769)
 a2 = (    0.1993   -0.7460   -0.1784)
 a3 = (    0.7451    0.2113   -0.1023)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
 a2 = (    0.1898   -0.7499   -0.1779) (    0.0042    0.0013    0.0034)
 a3 = (    0.7569    0.2159   -0.1026) (    0.0014    0.0043    0.0033)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0622   97.4257  105.9178    0.2578    0.2431    0.3301
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            400             73
# Figure of merit at the beginning and the end of the refinement
         7.5123        31.0046
# Chi-squares at the beginning and the end of the refinement
    0.9611    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0   -3    1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    1    3    0   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1   -2    1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    0   -2    0    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    1    2    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    1   -3    0    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    0   -3   -1    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    1    1    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    1    0    3   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    0   -1   -3    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    1   -2   -3    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    1   -1    2   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0    0   -2    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    1   -1   -2    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    2   -2   -2    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    0    1   -3    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    1    0   -3    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0   -1    1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    1    1   -2    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23    1    2   -1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0   -3    1   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    1    3    0   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1   -2    1   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0   -2    0    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    2    1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    1   -3    0    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0   -3   -1    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1    1    2   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -1   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1   -2   -1    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1    0    3   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0   -1   -3    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -2   -3    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1   -1    2   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    0   -2    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1   -1   -2    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2   -2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0    1   -3    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1    0   -3    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0   -1    1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    1   -2    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1    2   -1    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.24                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2366    1.2709    1.2726   89.9364   90.3407   89.6312      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.4486         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0284         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1410   -0.1610    0.7798)
 a2 = (   -0.1860    0.7426    0.1817)
 a3 = (   -0.7503   -0.2125    0.0967)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1453   -0.1451    0.7667) (    0.0036    0.0036    0.0009)
 a2 = (   -0.1898    0.7499    0.1779) (    0.0042    0.0013    0.0034)
 a3 = (   -0.7569   -0.2159    0.1026) (    0.0014    0.0043    0.0033)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   76.9375   82.5743  -74.0821    0.2578    0.2431    0.3301
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            400             77
# Figure of merit at the beginning and the end of the refinement
         6.3733        30.4595
# Chi-squares at the beginning and the end of the refinement
    0.3263    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2    0    3   -1   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    1   -3    0   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    1    2   -1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5    0    2    0    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    1   -2   -1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7    1    3    0    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8    0    3    1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    1   -1   -2   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    2    1    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    1    0   -3   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    0    1    3    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    1    2    3    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15    1    1   -2   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0    0    2    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1    1    2    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    2    2    2    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    0   -1    3    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    1    0    3    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0    1   -1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    1   -1    2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    1   -2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0    3   -1   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    1   -3    0   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    2   -1   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    2    0    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1   -2   -1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    1    3    0    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0    3    1    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1   -1   -2   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    1    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    2    1    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1    0   -3   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0    1    3    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    2    3    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1    1   -2   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    0    2    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1    1    2    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2    2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0   -1    3    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1    0    3    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0    1   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1   -1    2    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1   -2    1    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.28                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2588    1.2600    1.2609   89.9980   90.3272   90.0189      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.2962         1.0000    1.0000    4.2541    4.2541    4.2541
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0196         0.0000    0.0000    0.2810    0.2810    0.2810
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1457   -0.1397    0.7683)
 a2 = (    0.7569    0.2147   -0.1043)
 a3 = (   -0.1884    0.7498    0.1767)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1464   -0.1473    0.7660) (    0.0036    0.0037    0.0009)
 a2 = (    0.7580    0.2111   -0.1043) (    0.0014    0.0043    0.0033)
 a3 = (   -0.1844    0.7508    0.1797) (    0.0042    0.0012    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.7503   76.9172 -166.1981    0.2494    0.2610    0.3215
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0076   -0.0004    0.0002      0.0021    0.0020    0.0106

# Number of computed bands
            179            191
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.1347
# Chi-squares at the beginning and the end of the refinement
    1.2360    0.9200
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2    0    1    5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    1    0   -3   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4    2    2    4   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    0    0    4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2    2   -4   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    1    0    3    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    0   -1    3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    0   -2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -2    4    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12    1    3    0   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13    0   -3    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1   -3    2    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15    2    4    2   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    0   -4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    2   -4    2    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18    2   -2    2    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    0   -5   -1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    1   -3    0    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21    0    2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1   -2   -1    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23    2   -2   -4    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7356   -0.0509   -0.7310   -0.0567    0.0073    1          0.0876          0.0702
    2    0    1    5    0.0007   -0.1995   -0.0130   -0.1762    0.0270    1          0.1072          0.0995
    3    2    0   -6   -0.0330    0.0876   -0.0262    0.0895    0.0071    1          0.1290          0.0967
    4    2    2    4   -0.2073   -0.5834   -0.1957   -0.5833    0.0116    1          0.1369          0.1078
    5    0    0    4    0.0479   -0.2252    0.0560   -0.2234    0.0083    1          0.0852          0.0654
    6    2    2   -4   -0.1120    0.1183   -0.1085    0.1216    0.0048    1          0.1015          0.0778
    7    1    0    3    0.1079   -0.5971    0.1201   -0.5973    0.0122    1          0.0876          0.1302
    8    0   -2    4    0.1704   -0.2034    0.1454   -0.2240    0.0324    1          0.0970          0.1017
    9    1    2   -1   -0.1994    0.0499   -0.1952    0.0486    0.0044    1          0.0514          0.0726
   10    0   -2    2    0.2193   -0.1295    0.2251   -0.1274    0.0062    1          0.0610          0.0467
   11    2   -2    4    0.5239   -0.6192    0.5303   -0.6130    0.0089    1          0.1653          0.1248
   12    1    3    0   -0.1876   -0.0357   -0.1829   -0.0381    0.0053    1          0.0660          0.0984
   13    0   -3    1    0.1923   -0.0091    0.1990   -0.0092    0.0067    1          0.0664          0.0927
   14    1   -3    2    0.5241   -0.1531    0.5293   -0.1451    0.0095    1          0.0988          0.1473
   15    2    4    2   -0.3442   -0.2332   -0.3362   -0.2357    0.0083    1          0.1157          0.0881
   16    0   -4    0    0.1201    0.0360    0.1275    0.0362    0.0074    1          0.0823          0.0679
   17    2   -4    2    0.7251   -0.0850    0.7293   -0.0807    0.0060    1          0.1532          0.1198
   18    2   -2    2    1.0535   -0.5225    1.0696   -0.4972    0.0300    1          0.1683          0.2483
   19    0   -5   -1    0.0682    0.0384    0.0442    0.0295    0.0256    1          0.1038          0.0994
   20    2   -6    0    0.4392    0.1644    0.4423    0.1634    0.0033    1          0.1571          0.1178
   21    0    2    2   -0.0420   -0.0574   -0.0341   -0.0579    0.0079    1          0.0574          0.0568
   22    2   -4   -2    0.2916    0.3338    0.3053    0.3413    0.0156    1          0.1190          0.0899
   23    2   -2   -4    0.0277    0.2705    0.0347    0.2716    0.0071    1          0.1064          0.0816

###            No.29                ###
# Bravais type
        Cubic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2563    1.2613    1.2622   89.9973   90.2275   90.1855      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2599    1.2599    1.2599   90.0000   90.0000   90.0000      0.2963         1.0000    1.0000    4.2529    4.2529    4.2529
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0196         0.0000    0.0000    0.2808    0.2808    0.2808
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1451   -0.1480    0.7686)
 a2 = (   -0.7561   -0.2145    0.1042)
 a3 = (    0.1882   -0.7491   -0.1765)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1464   -0.1473    0.7660) (    0.0036    0.0037    0.0009)
 a2 = (   -0.7580   -0.2112    0.1043) (    0.0014    0.0043    0.0033)
 a3 = (    0.1844   -0.7508   -0.1796) (    0.0042    0.0012    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.2484  103.0808   13.8022    0.2494    0.2610    0.3215
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0076   -0.0004    0.0002      0.0021    0.0020    0.0106

# Number of computed bands
            173            197
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.1041
# Chi-squares at the beginning and the end of the refinement
    1.1951    0.9200
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    0   -1   -5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    1    0    3   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2   -2   -4   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    0   -4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2   -2    4   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    1    0   -3    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    0    1   -3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1   -2    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    0    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2    2   -4    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    1   -3    0   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    0    3   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1    3   -2    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    2   -4   -2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    2    4   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    2    2   -2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    0    5    1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    1    3    0    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    0   -2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1    2    1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    2    2    4    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7355   -0.0510   -0.7310   -0.0567    0.0073    1          0.0876          0.0702
    2    0   -1   -5    0.0007   -0.1994   -0.0130   -0.1762    0.0270    1          0.1073          0.0995
    3    2    0    6   -0.0330    0.0876   -0.0262    0.0895    0.0071    1          0.1291          0.0967
    4    2   -2   -4   -0.2073   -0.5834   -0.1957   -0.5833    0.0116    1          0.1369          0.1078
    5    0    0   -4    0.0479   -0.2252    0.0560   -0.2234    0.0083    1          0.0852          0.0654
    6    2   -2    4   -0.1120    0.1183   -0.1085    0.1216    0.0048    1          0.1015          0.0778
    7    1    0   -3    0.1079   -0.5971    0.1201   -0.5973    0.0122    1          0.0876          0.1302
    8    0    2   -4    0.1704   -0.2034    0.1454   -0.2240    0.0324    1          0.0971          0.1017
    9    1   -2    1   -0.1994    0.0498   -0.1952    0.0486    0.0044    1          0.0514          0.0726
   10    0    2   -2    0.2193   -0.1295    0.2251   -0.1274    0.0062    1          0.0611          0.0467
   11    2    2   -4    0.5239   -0.6192    0.5303   -0.6130    0.0090    1          0.1654          0.1248
   12    1   -3    0   -0.1875   -0.0357   -0.1829   -0.0381    0.0052    1          0.0661          0.0984
   13    0    3   -1    0.1923   -0.0091    0.1990   -0.0092    0.0067    1          0.0665          0.0927
   14    1    3   -2    0.5241   -0.1531    0.5293   -0.1451    0.0095    1          0.0988          0.1473
   15    2   -4   -2   -0.3441   -0.2332   -0.3362   -0.2357    0.0083    1          0.1158          0.0881
   16    0    4    0    0.1201    0.0360    0.1275    0.0362    0.0074    1          0.0823          0.0679
   17    2    4   -2    0.7251   -0.0850    0.7293   -0.0807    0.0060    1          0.1532          0.1198
   18    2    2   -2    1.0535   -0.5226    1.0696   -0.4972    0.0301    1          0.1683          0.2483
   19    0    5    1    0.0682    0.0384    0.0442    0.0295    0.0256    1          0.1039          0.0994
   20    2    6    0    0.4393    0.1644    0.4423    0.1634    0.0032    1          0.1572          0.1178
   21    0   -2   -2   -0.0420   -0.0574   -0.0341   -0.0579    0.0079    1          0.0574          0.0568
   22    2    4    2    0.2917    0.3338    0.3053    0.3413    0.0156    1          0.1190          0.0899
   23    2    2    4    0.0277    0.2705    0.0347    0.2716    0.0071    1          0.1064          0.0816

###                                ###
### Candidates for        Cubic(P) ###
###                                ###

###            No.1                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9875    1.0057    1.0070   89.9624   89.9780   89.1504      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3561         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0225         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2012    0.1799   -0.9761)
 a2 = (    0.9484    0.2690   -0.1306)
 a3 = (    0.2352   -0.9391   -0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1831    0.1828   -0.9660) (    0.0045    0.0045    0.0012)
 a2 = (    0.9536    0.2720   -0.1292) (    0.0018    0.0055    0.0042)
 a3 = (    0.2391   -0.9448   -0.2241) (    0.0053    0.0016    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.6207  102.9510   14.2003    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            133            137
# Figure of merit at the beginning and the end of the refinement
         2.7728        10.0767
# Chi-squares at the beginning and the end of the refinement
    3.3005    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    0    1   -2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -1    0    3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4   -1    1   -2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0   -1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -1    1    2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7   -1    0   -3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    0   -1   -2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -1    2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -1   -1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -1    3    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    0   -2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -1   -3   -2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15   -1    2   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0   -1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -1   -2   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18   -1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    0   -2    1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -1   -3    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    0    1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -1   -2    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -1   -1    2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0    1   -3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3   -1    0    3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -1    1   -2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0   -2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1    1    2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7   -1    0   -3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0   -1   -3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9   -1    2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -1   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1   -1   -2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12   -1    3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0   -3   -1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1   -3   -2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1    2   -1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -1   -2   -1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2   -2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0   -3    1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -1   -3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0    1   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1   -2    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23   -1   -1    2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.2                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9971    1.0008    1.0022   90.0369   90.0865   90.2460      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3561         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0225         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1813   -0.1844    0.9691)
 a2 = (   -0.9530   -0.2703    0.1313)
 a3 = (    0.2364   -0.9436   -0.2222)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1831   -0.1828    0.9660) (    0.0045    0.0045    0.0012)
 a2 = (   -0.9536   -0.2720    0.1292) (    0.0018    0.0055    0.0042)
 a3 = (    0.2391   -0.9448   -0.2241) (    0.0053    0.0016    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.3793  102.9510   14.2003    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            155            138
# Figure of merit at the beginning and the end of the refinement
         3.5160        10.0523
# Chi-squares at the beginning and the end of the refinement
    1.7462    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    0   -1   -3   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3    1    0    3   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    1   -1   -2   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0    0   -2    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6    1   -1    2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    1    0   -3    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    0    1   -3    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    1   -2    1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    1    1   -2    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    1   -3    0   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13    0    2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14    1    3   -2    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    1   -2   -1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    1    2   -1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    1    1   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19    0    3    1    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20    1    3    0    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    0   -1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22    1    2    1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23    1    1    2    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0   -1   -3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    1    0    3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1   -1   -2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0   -2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1   -1    2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    1    0   -3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0    1   -3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1   -2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    1   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    1   -2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1   -3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0    3   -1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    3   -2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1   -2   -1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1    2   -1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2    2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0    3    1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1    3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0   -1   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    2    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1    1    2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.3                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0009    1.0016   90.0451   90.1505   90.5950      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3561         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0225         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1930   -0.1785    0.9674)
 a2 = (    0.9532    0.2704   -0.1295)
 a3 = (   -0.2364    0.9438    0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1831   -0.1828    0.9660) (    0.0045    0.0045    0.0012)
 a2 = (    0.9536    0.2720   -0.1292) (    0.0018    0.0055    0.0042)
 a3 = (   -0.2391    0.9448    0.2241) (    0.0053    0.0016    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.6207   77.0490 -165.7997    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            139            139
# Figure of merit at the beginning and the end of the refinement
         4.5109        10.0281
# Chi-squares at the beginning and the end of the refinement
    0.4113    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0    1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    1    0   -3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    1    1    2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    1    0    3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -1    2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    1    3    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1   -3    2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    1    2    1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -2    1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0   -3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    1   -3    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -2   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    1   -1   -2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0    1    3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    1    0   -3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    1    2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0    2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    1   -2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    1    0    3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0   -1    3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    1    2   -1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -1    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1   -1    2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1    3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0   -3    1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -3    2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1    2    1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1   -2    1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18    2   -2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19    0   -3   -1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1   -3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0    1    1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1   -2   -1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23    1   -1   -2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.4                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9834    1.0081    1.0088   89.9488   89.2557   89.6978      0.3878
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3560         1.0000    1.0000    2.8092    2.8092    2.8092
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0227         0.0000    0.0000    0.1795    0.1795    0.1795
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1724   -0.1850    0.9850)
 a2 = (    0.2349   -0.9377   -0.2226)
 a3 = (    0.9457    0.2682   -0.1285)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1830   -0.1827    0.9660) (    0.0047    0.0049    0.0012)
 a2 = (    0.2393   -0.9448   -0.2240) (    0.0058    0.0016    0.0046)
 a3 = (    0.9536    0.2721   -0.1292) (    0.0019    0.0059    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0541   97.4228  105.9265    0.2719    0.2554    0.3559
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001   -0.0021      0.0021    0.0021    0.0114

# Number of computed bands
            400            140
# Figure of merit at the beginning and the end of the refinement
         4.3518         9.9843
# Chi-squares at the beginning and the end of the refinement
    0.2839    0.0339
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7618   -0.0567   -0.7310   -0.0567    0.0308    0    0.0745    0.0702
    2    0   -3    1   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1078    0.0995
    3    1    3    0   -0.0285    0.0975   -0.0262    0.0895    0.0084    1    0.1058    0.0967
    4    1   -2    1   -0.1983   -0.5990   -0.1957   -0.5833    0.0159    1    0.1138    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0696    0.0654
    6    1    2    1   -0.1139    0.1286   -0.1085    0.1216    0.0089    1    0.0834    0.0778
    7    1   -3    0    0.1223   -0.6041    0.1201   -0.5973    0.0072    1    0.1451    0.1302
    8    0   -3   -1    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1118    0.1017
    9    1    1    2   -0.2065    0.0527   -0.1952    0.0486    0.0120    1    0.0845    0.0726
   10    0   -1   -1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0498    0.0467
   11    1   -2   -1    0.5431   -0.6214    0.5303   -0.6130    0.0152    1    0.1374    0.1248
   12    1    0    3   -0.1911   -0.0394   -0.1829   -0.0381    0.0084    1    0.1084    0.0984
   13    0   -1   -3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1086    0.0927
   14    1   -2   -3    0.5364   -0.1516    0.5293   -0.1451    0.0096    1    0.1633    0.1473
   15    1   -1    2   -0.3473   -0.2448   -0.3362   -0.2357    0.0143    1    0.0957    0.0881
   16    0    0   -2    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0672    0.0679
   17    1   -1   -2    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1272    0.1198
   18    2   -2   -2    1.0767   -0.5174    1.0696   -0.4972    0.0215    1    0.2835    0.2483
   19    0    1   -3    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1049    0.0994
   20    1    0   -3    0.4520    0.1679    0.4423    0.1634    0.0106    1    0.1298    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0469    0.0568
   22    1    1   -2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0988    0.0899
   23    1    2   -1    0.0368    0.2822    0.0347    0.2716    0.0108    1    0.0880    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7329   -0.0578   -0.7310   -0.0567    0.0022    1          0.0664          0.0702
    2    0   -3    1   -0.0129   -0.1741   -0.0130   -0.1762    0.0020    1          0.0995          0.0995
    3    1    3    0   -0.0264    0.0896   -0.0262    0.0895    0.0003    1          0.0974          0.0967
    4    1   -2    1   -0.1944   -0.5858   -0.1957   -0.5833    0.0028    1          0.1032          0.1078
    5    0   -2    0    0.0569   -0.2233    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    2    1   -0.1072    0.1198   -0.1085    0.1216    0.0021    1          0.0767          0.0778
    7    1   -3    0    0.1203   -0.5949    0.1201   -0.5973    0.0025    1          0.1321          0.1302
    8    0   -3   -1    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1032          0.1017
    9    1    1    2   -0.1954    0.0489   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    0   -1   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11    1   -2   -1    0.5341   -0.6132    0.5303   -0.6130    0.0038    1          0.1241          0.1248
   12    1    0    3   -0.1822   -0.0381   -0.1829   -0.0381    0.0007    1          0.0999          0.0984
   13    0   -1   -3    0.1977   -0.0083    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -2   -3    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1490          0.1473
   15    1   -1    2   -0.3363   -0.2377   -0.3362   -0.2357    0.0020    1          0.0875          0.0881
   16    0    0   -2    0.1259    0.0357    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1   -1   -2    0.7306   -0.0811    0.7293   -0.0807    0.0013    1          0.1151          0.1198
   18    2   -2   -2    1.0599   -0.5142    1.0696   -0.4972    0.0196    1          0.2530          0.2483
   19    0    1   -3    0.0434    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    1    0   -3    0.4450    0.1658    0.4423    0.1634    0.0036    1          0.1183          0.1178
   21    0   -1    1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    1   -2    0.2981    0.3351    0.3053    0.3413    0.0095    1          0.0898          0.0899
   23    1    2   -1    0.0343    0.2723    0.0347    0.2716    0.0008    1          0.0804          0.0816

###            No.5                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9996    1.0001    1.0003   89.9471   89.9533   89.9836      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3561         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0225         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9543    0.2707   -0.1297)
 a2 = (    0.1828   -0.1826    0.9659)
 a3 = (    0.2367   -0.9450   -0.2243)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9536    0.2720   -0.1292) (    0.0018    0.0055    0.0042)
 a2 = (    0.1831   -0.1828    0.9660) (    0.0045    0.0045    0.0012)
 a3 = (    0.2391   -0.9448   -0.2241) (    0.0053    0.0016    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6207  102.9510   14.2003    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            151            149
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.7985
# Chi-squares at the beginning and the end of the refinement
    0.2857    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    1    0   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    0    1    3   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    1    1   -2   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    1    1    2   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    0    1   -3    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8   -1    0   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    2    1    1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1   -2    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    3    1    0   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13   -3    0   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -3    1   -2    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    2    1   -1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -2    1   -1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18   -2    2   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19   -3    0    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -3    1    0    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    1    0   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -2    1    1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23   -1    1    2    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    1    0   -3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    0    1    3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    1   -2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0   -2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    1    2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    0    1   -3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8   -1    0   -3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    2    1    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10   -1    0   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    1   -2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    3    1    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -3    0   -1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -3    1   -2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2    1   -1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -2    1   -1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2    2   -2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2533          0.2483
   19   -3    0    1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -3    1    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1    0   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -2    1    1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23   -1    1    2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.6                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0042    1.0073   92.0664   90.3187   90.8309      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3569         1.0000    1.0000    2.8021    2.8021    2.8021
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0234         0.0000    0.0000    0.1837    0.1837    0.1837
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2542    0.9516    0.2272)
 a2 = (   -0.9505   -0.2696    0.1309)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2383    0.9451    0.2237) (    0.0054    0.0016    0.0044)
 a2 = (   -0.9538   -0.2712    0.1297) (    0.0018    0.0056    0.0043)
 a3 = (    0.1832   -0.1824    0.9660) (    0.0046    0.0046    0.0012)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.8915   14.9844   45.1266    0.9582    0.2588    1.0517
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001   -0.0025      0.0021    0.0020    0.0110

# Number of computed bands
            400            152
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.7154
# Chi-squares at the beginning and the end of the refinement
    0.1843    0.0246
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3   -1    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    0    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3    0    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    1    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -1   -2    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    2    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    3    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    2    3    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1   -2    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    2    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1    3    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1   -1    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -1    2    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    1    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7326   -0.0573   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    3   -1    0   -0.0130   -0.1738   -0.0130   -0.1762    0.0024    1          0.0997          0.0995
    3   -3    0    1   -0.0264    0.0899   -0.0262    0.0895    0.0005    1          0.0976          0.0967
    4    2   -1    1   -0.1949   -0.5852   -0.1957   -0.5833    0.0021    1          0.1034          0.1078
    5    2    0    0    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0644          0.0654
    6   -2   -1    1   -0.1072    0.1200   -0.1085    0.1216    0.0020    1          0.0769          0.0778
    7    3    0    1    0.1195   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    3    1    0    0.1435   -0.2201    0.1454   -0.2240    0.0044    1          0.1034          0.1017
    9   -1   -2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1    1    0    0.2256   -0.1275    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    2    1    1    0.5334   -0.6142    0.5303   -0.6130    0.0033    1          0.1244          0.1248
   12    0   -3    1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1          0.1001          0.0984
   13    1    3    0    0.1982   -0.0085    0.1990   -0.0092    0.0010    1          0.1006          0.0927
   14    2    3    1    0.5305   -0.1504    0.5293   -0.1451    0.0055    1          0.1494          0.1473
   15    1   -2    1   -0.3361   -0.2372   -0.3362   -0.2357    0.0015    1          0.0876          0.0881
   16    0    2    0    0.1265    0.0357    0.1275    0.0362    0.0011    1          0.0622          0.0679
   17    1    2    1    0.7313   -0.0822    0.7293   -0.0807    0.0025    1          0.1154          0.1198
   18    2    2    2    1.0599   -0.5164    1.0696   -0.4972    0.0215    1          0.2537          0.2483
   19   -1    3    0    0.0440    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    0    3    1    0.4460    0.1656    0.4423    0.1634    0.0043    1          0.1186          0.1178
   21    1   -1    0   -0.0335   -0.0577   -0.0341   -0.0579    0.0007    1          0.0434          0.0568
   22   -1    2    1    0.2990    0.3355    0.3053    0.3413    0.0086    1          0.0900          0.0899
   23   -2    1    1    0.0346    0.2729    0.0347    0.2716    0.0012    1          0.0806          0.0816

###            No.8                ###
# Bravais type
        Cubic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9839    1.0078    1.0085   89.9502   89.6990   89.4065      0.4460
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0000   90.0000   90.0000      0.3561         1.0000    1.0000    2.8085    2.8085    2.8085
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.0000    0.0000    0.0000      0.0225         0.0000    0.0000    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1750    0.1842   -0.9842)
 a2 = (   -0.9466   -0.2685    0.1286)
 a3 = (   -0.2348    0.9373    0.2225)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1831    0.1828   -0.9660) (    0.0045    0.0045    0.0012)
 a2 = (   -0.9536   -0.2720    0.1292) (    0.0018    0.0055    0.0042)
 a3 = (   -0.2391    0.9448    0.2241) (    0.0053    0.0016    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.3793   77.0490 -165.7997    0.2497    0.2554    0.3221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0017      0.0021    0.0020    0.0106

# Number of computed bands
            151            167
# Figure of merit at the beginning and the end of the refinement
         4.0522         9.4330
# Chi-squares at the beginning and the end of the refinement
    0.4749    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0855    0.0702
    2    0   -1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1    0   -3   -0.0286    0.0973   -0.0262    0.0895    0.0082    1    0.1217    0.0967
    4   -1   -1    2   -0.1989   -0.5977   -0.1957   -0.5833    0.0147    1    0.1308    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1   -1   -2   -0.1139    0.1281   -0.1085    0.1216    0.0085    1    0.0959    0.0778
    7   -1    0    3    0.1217   -0.6040    0.1201   -0.5973    0.0069    1    0.1669    0.1302
    8    0    1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -1   -2   -1   -0.2058    0.0522   -0.1952    0.0486    0.0112    1    0.0973    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1    2    0.5428   -0.6218    0.5303   -0.6130    0.0152    1    0.1580    0.1248
   12   -1   -3    0   -0.1904   -0.0392   -0.1829   -0.0381    0.0076    1    0.1249    0.0984
   13    0    3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -1    3    2    0.5364   -0.1514    0.5293   -0.1451    0.0095    1    0.1879    0.1473
   15   -1   -2    1   -0.3463   -0.2437   -0.3362   -0.2357    0.0129    1    0.1101    0.0881
   16    0    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -1    2    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1463    0.1198
   18   -2    2    2    1.0771   -0.5187    1.0696   -0.4972    0.0228    1    0.3268    0.2483
   19    0    3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -1    3    0    0.4518    0.1678    0.4423    0.1634    0.0105    1    0.1493    0.1178
   21    0   -1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1    2   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1136    0.0899
   23   -1    1   -2    0.0366    0.2822    0.0347    0.2716    0.0107    1    0.1012    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7325   -0.0575   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    0   -1    3   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3   -1    0   -3   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -1   -1    2   -0.1945   -0.5857   -0.1957   -0.5833    0.0026    1          0.1033          0.1078
    5    0    0    2    0.0569   -0.2234    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1   -1   -2   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7   -1    0    3    0.1202   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    0    1    3    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9   -1   -2   -1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    1    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    1    2    0.5340   -0.6132    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12   -1   -3    0   -0.1820   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    0    3    1    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    3    2    0.5301   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1   -2    1   -0.3362   -0.2375   -0.3362   -0.2357    0.0018    1          0.0875          0.0881
   16    0    2    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -1    2    1    0.7305   -0.0811    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -2    2    2    1.0598   -0.5142    1.0696   -0.4972    0.0197    1          0.2532          0.2483
   19    0    3   -1    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -1    3    0    0.4449    0.1658    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    0   -1    1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1    2   -1    0.2980    0.3350    0.3053    0.3413    0.0096    1          0.0898          0.0899
   23   -1    1   -2    0.0343    0.2722    0.0347    0.2716    0.0006    1          0.0805          0.0816

###                                ###
### Candidates for       Hexagonal ###
###                                ###

###                                ###
### Candidates for        Trigonal ###
###                                ###

###            No.1                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1078    1.0749    1.0860  108.5388  111.2897  108.1638      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0909    1.0909    1.0909  109.4557  109.4557  109.4557      0.4491         1.0000    1.0000    2.4293    2.4293    2.4293
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0061    0.0061    0.0079    0.0253    0.0253    0.4945      0.0285         0.0129    0.0129    0.1549    0.1549    0.1552
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5729    0.3516   -0.8793)
 a2 = (    0.9444   -0.5347   -0.2807)
 a3 = (    0.0271   -0.6058   -0.9553)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6113    0.3614   -0.8688) (    0.0053    0.0114    0.0039)
 a2 = (    0.9464   -0.5340   -0.2801) (    0.0032    0.0054    0.0057)
 a3 = (    0.0439   -0.6045   -0.9443) (    0.0049    0.0112    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -78.4470  127.7877  -40.9613    0.5546    0.4156    0.3760
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001   -0.0021      0.0021    0.0023    0.0114

# Number of computed bands
            400             57
# Figure of merit at the beginning and the end of the refinement
         7.5123        33.6854
# Chi-squares at the beginning and the end of the refinement
    1.3103    0.0336
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    2   -1   -2   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -2    2    1   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1    0   -2   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    1   -1   -1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -1    2    0   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    1   -1   -2    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    1   -2   -1    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    0    2   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    0   -1   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    1    2   -2   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13   -1   -2    1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14   -1   -2    0    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    1    1   -2   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16   -1   -1    1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17   -1   -1    0    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18   -1   -1   -1    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19   -2   -1    2    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -2   -1    1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    1    0   -1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -2    0    1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -2    1    1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7328   -0.0574   -0.7310   -0.0567    0.0019    1          0.0665          0.0702
    2    2   -1   -2   -0.0129   -0.1743   -0.0130   -0.1762    0.0019    1          0.0997          0.0995
    3   -2    2    1   -0.0264    0.0895   -0.0262    0.0895    0.0002    1          0.0976          0.0967
    4    1    0   -2   -0.1948   -0.5858   -0.1957   -0.5833    0.0026    1          0.1034          0.1078
    5    1   -1   -1    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0644          0.0654
    6   -1    2    0   -0.1072    0.1199   -0.1085    0.1216    0.0021    1          0.0768          0.0778
    7    1   -1   -2    0.1199   -0.5951    0.1201   -0.5973    0.0023    1          0.1323          0.1302
    8    1   -2   -1    0.1436   -0.2199    0.1454   -0.2240    0.0044    1          0.1033          0.1017
    9    0    2   -1   -0.1956    0.0490   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10    0   -1    0    0.2253   -0.1270    0.2251   -0.1274    0.0004    1          0.0461          0.0467
   11    0   -1   -1    0.5340   -0.6136    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    1    2   -2   -0.1824   -0.0381   -0.1829   -0.0381    0.0005    1          0.1001          0.0984
   13   -1   -2    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1005          0.0927
   14   -1   -2    0    0.5300   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1    1   -2   -0.3365   -0.2377   -0.3362   -0.2357    0.0020    1          0.0876          0.0881
   16   -1   -1    1    0.1256    0.0356    0.1275    0.0362    0.0020    1          0.0622          0.0679
   17   -1   -1    0    0.7305   -0.0810    0.7293   -0.0807    0.0012    1          0.1152          0.1198
   18   -1   -1   -1    1.0604   -0.5145    1.0696   -0.4972    0.0196    1          0.2533          0.2483
   19   -2   -1    2    0.0432    0.0286    0.0442    0.0295    0.0013    1          0.0970          0.0994
   20   -2   -1    1    0.4446    0.1657    0.4423    0.1634    0.0032    1          0.1184          0.1178
   21    1    0   -1   -0.0338   -0.0583   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -2    0    1    0.2977    0.3348    0.3053    0.3413    0.0100    1          0.0899          0.0899
   23   -2    1    1    0.0343    0.2720    0.0347    0.2716    0.0005    1          0.0805          0.0816

###            No.2                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1036    1.0793    1.0790  109.3487  110.2733  107.8834      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0913    1.0913    1.0913  109.4868  109.4868  109.4868      0.4484         1.0000    1.0000    2.4336    2.4336    2.4336
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0048    0.0048    0.0062    0.0211    0.0211    0.3897      0.0300         0.0101    0.0101    0.1633    0.1633    0.1635
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.8835   -0.0685   -0.6497)
 a2 = (    0.0716   -0.6092   -0.9336)
 a3 = (   -0.5744   -0.9745   -0.0732)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9025   -0.0704   -0.6642) (    0.0031    0.0074    0.0042)
 a2 = (    0.0434   -0.6049   -0.9449) (    0.0075    0.0045    0.0029)
 a3 = (   -0.5681   -0.9655   -0.0759) (    0.0077    0.0076    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -136.8033   59.8011  -20.8232    0.3449    0.2946    0.3942
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0000      0.0022    0.0020    0.0117

# Number of computed bands
            400             59
# Figure of merit at the beginning and the end of the refinement
         5.8773        33.2041
# Chi-squares at the beginning and the end of the refinement
    0.0351    0.0199
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    1   -1   -2   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -2    1    2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    0   -1   -1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    1   -1   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -2    1    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    1   -2   -1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    2   -2   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -2    1    0   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    1   -2    0    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -2    1   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    2   -2    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    2   -3    1    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1    0   -1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    1   -1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1   -2    1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    1   -3    1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    1   -1    2    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    1   -2    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    0    0   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    0   -1    2    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -1    0    2    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    0   -0.7312   -0.0572   -0.7310   -0.0567    0.0006    1          0.0666          0.0702
    2    1   -1   -2   -0.0131   -0.1745   -0.0130   -0.1762    0.0017    1          0.0998          0.0995
    3   -2    1    2   -0.0261    0.0888   -0.0262    0.0895    0.0007    1          0.0976          0.0967
    4    0   -1   -1   -0.1950   -0.5849   -0.1957   -0.5833    0.0017    1          0.1035          0.1078
    5    1   -1   -1    0.0566   -0.2237    0.0560   -0.2234    0.0008    1          0.0644          0.0654
    6   -2    1    1   -0.1066    0.1193   -0.1085    0.1216    0.0029    1          0.0768          0.0778
    7    1   -2   -1    0.1193   -0.5947    0.1201   -0.5973    0.0028    1          0.1325          0.1302
    8    2   -2   -1    0.1435   -0.2202    0.1454   -0.2240    0.0042    1          0.1035          0.1017
    9   -2    1    0   -0.1949    0.0489   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1   -1    0    0.2253   -0.1272    0.2251   -0.1274    0.0003    1          0.0461          0.0467
   11    1   -2    0    0.5328   -0.6134    0.5303   -0.6130    0.0026    1          0.1245          0.1248
   12   -2    1   -1   -0.1819   -0.0380   -0.1829   -0.0381    0.0009    1          0.1002          0.0984
   13    2   -2    1    0.1973   -0.0084    0.1990   -0.0092    0.0018    1          0.1005          0.0927
   14    2   -3    1    0.5294   -0.1499    0.5293   -0.1451    0.0047    1          0.1493          0.1473
   15   -1    0   -1   -0.3360   -0.2371   -0.3362   -0.2357    0.0014    1          0.0877          0.0881
   16    1   -1    1    0.1255    0.0355    0.1275    0.0362    0.0021    1          0.0622          0.0679
   17    1   -2    1    0.7295   -0.0816    0.7293   -0.0807    0.0009    1          0.1153          0.1198
   18    1   -3    1    1.0584   -0.5149    1.0696   -0.4972    0.0210    1          0.2538          0.2483
   19    1   -1    2    0.0430    0.0285    0.0442    0.0295    0.0016    1          0.0971          0.0994
   20    1   -2    2    0.4440    0.1651    0.4423    0.1634    0.0024    1          0.1185          0.1178
   21    0    0   -1   -0.0340   -0.0585   -0.0341   -0.0579    0.0006    1          0.0435          0.0568
   22    0   -1    2    0.2974    0.3337    0.3053    0.3413    0.0110    1          0.0899          0.0899
   23   -1    0    2    0.0344    0.2710    0.0347    0.2716    0.0007    1          0.0805          0.0816

###            No.3                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1039    1.0790    1.1036  110.2733  111.1498  107.8862      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0910    1.0910    1.0910  109.4586  109.4586  109.4586      0.4486         1.0000    1.0000    2.4317    2.4317    2.4317
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0047    0.0047    0.0061    0.0197    0.0197    0.3827      0.0300         0.0099    0.0099    0.1631    0.1631    0.1633
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0716   -0.6092   -0.9336)
 a2 = (    0.6460    0.3653   -0.8604)
 a3 = (    0.9551   -0.5407   -0.2839)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0435   -0.6044   -0.9446) (    0.0074    0.0046    0.0029)
 a2 = (    0.6115    0.3611   -0.8689) (    0.0048    0.0072    0.0035)
 a3 = (    0.9460   -0.5346   -0.2804) (    0.0083    0.0066    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -115.8847   69.3189   58.0695    0.3426    0.3225    0.3786
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0001      0.0022    0.0020    0.0118

# Number of computed bands
            400             61
# Figure of merit at the beginning and the end of the refinement
         5.8773        32.9937
# Chi-squares at the beginning and the end of the refinement
    0.2413    0.0198
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -2    2   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    1   -2    2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -2    1    0   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5   -1    1   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    0   -1    2   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -2    1   -1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8   -1    1   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -1    0    2   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -1    0   -1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -2    1    2   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    1   -1   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    0   -1   -2    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -2    1    1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    1   -1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    0   -1   -1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -1   -1   -1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    2   -2   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    1   -2   -1    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1    1    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    1   -2    0    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    1   -2    1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7313   -0.0567   -0.7310   -0.0567    0.0002    1          0.0666          0.0702
    2   -2    2   -1   -0.0131   -0.1743   -0.0130   -0.1762    0.0019    1          0.0998          0.0995
    3    1   -2    2   -0.0262    0.0890   -0.0262    0.0895    0.0005    1          0.0977          0.0967
    4   -2    1    0   -0.1950   -0.5848   -0.1957   -0.5833    0.0017    1          0.1035          0.1078
    5   -1    1   -1    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    0   -1    2   -0.1067    0.1194   -0.1085    0.1216    0.0028    1          0.0769          0.0778
    7   -2    1   -1    0.1194   -0.5944    0.1201   -0.5973    0.0030    1          0.1325          0.1302
    8   -1    1   -2    0.1433   -0.2199    0.1454   -0.2240    0.0045    1          0.1035          0.1017
    9   -1    0    2   -0.1949    0.0489   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    0   -1    0.2250   -0.1271    0.2251   -0.1274    0.0003    1          0.0461          0.0467
   11   -1    0   -1    0.5328   -0.6131    0.5303   -0.6130    0.0025    1          0.1244          0.1248
   12   -2    1    2   -0.1820   -0.0380   -0.1829   -0.0381    0.0009    1          0.1002          0.0984
   13    1   -1   -2    0.1972   -0.0085    0.1990   -0.0092    0.0019    1          0.1006          0.0927
   14    0   -1   -2    0.5291   -0.1497    0.5293   -0.1451    0.0046    1          0.1493          0.1473
   15   -2    1    1   -0.3361   -0.2370   -0.3362   -0.2357    0.0013    1          0.0877          0.0881
   16    1   -1   -1    0.1254    0.0354    0.1275    0.0362    0.0022    1          0.0622          0.0679
   17    0   -1   -1    0.7292   -0.0814    0.7293   -0.0807    0.0007    1          0.1153          0.1198
   18   -1   -1   -1    1.0585   -0.5143    1.0696   -0.4972    0.0204    1          0.2537          0.2483
   19    2   -2   -1    0.0431    0.0285    0.0442    0.0295    0.0015    1          0.0971          0.0994
   20    1   -2   -1    0.4439    0.1651    0.4423    0.1634    0.0023    1          0.1186          0.1178
   21   -1    1    0   -0.0339   -0.0584   -0.0341   -0.0579    0.0005    1          0.0435          0.0568
   22    1   -2    0    0.2973    0.3338    0.3053    0.3413    0.0110    1          0.0900          0.0899
   23    1   -2    1    0.0344    0.2711    0.0347    0.2716    0.0006    1          0.0806          0.0816

###            No.4                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0916    1.0864    1.0954  110.9474  108.9380  108.4956      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0893    1.0893    1.0893  109.3345  109.3345  109.3345      0.4497         1.0000    1.0000    2.4225    2.4225    2.4225
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0061    0.0061    0.0079    0.0198    0.0198    0.4937      0.0286         0.0128    0.0128    0.1545    0.1545    0.1549
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9363    0.5301    0.2783)
 a2 = (   -0.6093   -0.3735    0.8765)
 a3 = (   -0.0450    0.5817    0.9615)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9445    0.5330    0.2783) (    0.0031    0.0054    0.0057)
 a2 = (   -0.6077   -0.3652    0.8666) (    0.0053    0.0114    0.0040)
 a3 = (   -0.0390    0.6028    0.9427) (    0.0049    0.0112    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   18.3541   52.1197  139.0485    0.3472    0.4165    0.3760
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0007    0.0003   -0.0035      0.0021    0.0023    0.0114

# Number of computed bands
            400             57
# Figure of merit at the beginning and the end of the refinement
         6.3733        32.0318
# Chi-squares at the beginning and the end of the refinement
    0.0474    0.0406
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2    1   -2    2   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3   -2    2   -1   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    0   -1    2   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5    1   -1    1    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6   -2    1    0   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7    1   -1    2    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8    2   -1    1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9   -2    0    1   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    0    1    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12   -2   -1    2   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    2    1   -1    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    2    1    0    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15   -1   -1    2   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    1    1   -1    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1    1    0    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    1    1    1    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    1    2   -2    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    1    2   -1    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0   -1    1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    0    2   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23   -1    2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7313   -0.0567   -0.7310   -0.0567    0.0003    1          0.0665          0.0702
    2    1   -2    2   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.0998          0.0995
    3   -2    2   -1   -0.0260    0.0896   -0.0262    0.0895    0.0002    1          0.0977          0.0967
    4    0   -1    2   -0.1964   -0.5847   -0.1957   -0.5833    0.0015    1          0.1033          0.1078
    5    1   -1    1    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6   -2    1    0   -0.1073    0.1204   -0.1085    0.1216    0.0017    1          0.0769          0.0778
    7    1   -1    2    0.1181   -0.5959    0.1201   -0.5973    0.0025    1          0.1320          0.1302
    8    2   -1    1    0.1433   -0.2199    0.1454   -0.2240    0.0046    1          0.1031          0.1017
    9   -2    0    1   -0.1964    0.0491   -0.1952    0.0486    0.0013    1          0.0780          0.0726
   10    1    0    0    0.2250   -0.1268    0.2251   -0.1274    0.0006    1          0.0459          0.0467
   11    1    0    1    0.5346   -0.6168    0.5303   -0.6130    0.0057    1          0.1239          0.1248
   12   -2   -1    2   -0.1831   -0.0387   -0.1829   -0.0381    0.0006    1          0.1003          0.0984
   13    2    1   -1    0.1966   -0.0081    0.1990   -0.0092    0.0026    1          0.1003          0.0927
   14    2    1    0    0.5309   -0.1491    0.5293   -0.1451    0.0043    1          0.1485          0.1473
   15   -1   -1    2   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0877          0.0881
   16    1    1   -1    0.1245    0.0353    0.1275    0.0362    0.0031    1          0.0621          0.0679
   17    1    1    0    0.7323   -0.0794    0.7293   -0.0807    0.0032    1          0.1147          0.1198
   18    1    1    1    1.0671   -0.5168    1.0696   -0.4972    0.0198    1          0.2534          0.2483
   19    1    2   -2    0.0425    0.0278    0.0442    0.0295    0.0024    1          0.0971          0.0994
   20    1    2   -1    0.4434    0.1667    0.4423    0.1634    0.0035    1          0.1181          0.1178
   21    0   -1    1   -0.0338   -0.0590   -0.0341   -0.0579    0.0011    1          0.0435          0.0568
   22    0    2   -1    0.2959    0.3342    0.3053    0.3413    0.0118    1          0.0898          0.0899
   23   -1    2   -1    0.0344    0.2709    0.0347    0.2716    0.0008    1          0.0806          0.0816

###            No.5                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0860    1.0971    1.0749  110.5048  108.5388  108.1618      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0928    1.0928    1.0928  109.5960  109.5960  109.5960      0.4487         1.0000    1.0000    2.4354    2.4354    2.4354
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0063    0.0063    0.0081    0.0324    0.0324    0.5056      0.0285         0.0131    0.0131    0.1553    0.1553    0.1557
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5458    0.9574    0.0760)
 a2 = (    0.5729    0.3516   -0.8793)
 a3 = (   -0.3715    0.8863   -0.5985)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5685    0.9681    0.0741) (    0.0056    0.0035    0.0058)
 a2 = (    0.6131    0.3663   -0.8693) (    0.0056    0.0115    0.0038)
 a3 = (   -0.3311    0.8994   -0.5893) (    0.0080    0.0118    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  175.9665  110.6427 -121.8477    0.3209    0.4115    0.3955
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0021      0.0021    0.0023    0.0115

# Number of computed bands
            400             69
# Figure of merit at the beginning and the end of the refinement
         7.5123        31.5585
# Chi-squares at the beginning and the end of the refinement
    0.9252    0.0327
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    2   -1    1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -1    1   -2   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    2   -1    0   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    1   -1    1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    0    1   -2   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    2   -2    1    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    1   -2    2    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    1    1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -2    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    2    1   -2   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13   -1   -2    2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    0   -3    2    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    2    0   -1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16   -1   -1    1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    0   -2    1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    1   -3    1    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19   -2   -1    1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -1   -2    1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    1    0    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -1   -1    0    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -1    0   -1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7342   -0.0566   -0.7310   -0.0567    0.0032    1          0.0664          0.0702
    2    2   -1    1   -0.0130   -0.1732   -0.0130   -0.1762    0.0030    1          0.0997          0.0995
    3   -1    1   -2   -0.0262    0.0899   -0.0262    0.0895    0.0004    1          0.0976          0.0967
    4    2   -1    0   -0.1946   -0.5849   -0.1957   -0.5833    0.0019    1          0.1031          0.1078
    5    1   -1    1    0.0561   -0.2229    0.0560   -0.2234    0.0005    1          0.0643          0.0654
    6    0    1   -2   -0.1070    0.1202   -0.1085    0.1216    0.0020    1          0.0767          0.0778
    7    2   -2    1    0.1193   -0.5950    0.1201   -0.5973    0.0025    1          0.1319          0.1302
    8    1   -2    2    0.1431   -0.2203    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    1    1   -2   -0.1955    0.0489   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    0   -1    1    0.2258   -0.1277    0.2251   -0.1274    0.0008    1          0.0460          0.0467
   11    1   -2    1    0.5355   -0.6146    0.5303   -0.6130    0.0054    1          0.1241          0.1248
   12    2    1   -2   -0.1816   -0.0385   -0.1829   -0.0381    0.0013    1          0.0998          0.0984
   13   -1   -2    2    0.1983   -0.0084    0.1990   -0.0092    0.0010    1          0.1003          0.0927
   14    0   -3    2    0.5315   -0.1490    0.5293   -0.1451    0.0045    1          0.1489          0.1473
   15    2    0   -1   -0.3354   -0.2377   -0.3362   -0.2357    0.0021    1          0.0874          0.0881
   16   -1   -1    1    0.1265    0.0358    0.1275    0.0362    0.0011    1          0.0621          0.0679
   17    0   -2    1    0.7317   -0.0788    0.7293   -0.0807    0.0030    1          0.1151          0.1198
   18    1   -3    1    1.0647   -0.5110    1.0696   -0.4972    0.0147    1          0.2534          0.2483
   19   -2   -1    1    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20   -1   -2    1    0.4443    0.1668    0.4423    0.1634    0.0039    1          0.1185          0.1178
   21    1    0    0   -0.0330   -0.0575   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -1   -1    0    0.2969    0.3343    0.3053    0.3413    0.0110    1          0.0901          0.0899
   23   -1    0   -1    0.0350    0.2716    0.0347    0.2716    0.0004    1          0.0807          0.0816

###            No.7                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1119    1.0844    1.0861  109.5780  110.4428  109.0259      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0933    1.0933    1.0933  109.6316  109.6316  109.6316      0.4476         1.0000    1.0000    2.4428    2.4428    2.4428
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0063    0.0063    0.0082    0.0344    0.0344    0.5110      0.0290         0.0133    0.0133    0.1587    0.1587    0.1591
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5820   -0.3837    0.8633)
 a2 = (   -0.5552   -0.9827   -0.0812)
 a3 = (    0.3517   -0.9124    0.5858)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6140   -0.3687    0.8687) (    0.0057    0.0118    0.0038)
 a2 = (   -0.5690   -0.9686   -0.0750) (    0.0058    0.0035    0.0061)
 a3 = (    0.3296   -0.9013    0.5887) (    0.0082    0.0119    0.0046)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  124.4740   69.3885   58.1290    0.4815    0.4176    0.4068
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0007    0.0008      0.0021    0.0023    0.0121

# Number of computed bands
            400             69
# Figure of merit at the beginning and the end of the refinement
         8.6014        31.3613
# Chi-squares at the beginning and the end of the refinement
    0.7120    0.0243
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    1   -2   -1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3   -1    1    2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    1   -2    0   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    1   -1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -1    0    2   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    2   -2   -1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    2   -1   -2    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9   -1   -1    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    2   -1   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12   -1   -2    2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    2    1   -2    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    3    0   -2    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    0   -2    1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    1    1   -1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    2    0   -1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    3   -1   -1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1    2   -1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    2    1   -1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    0   -1    0   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    1    1    0    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    0    1    1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7334   -0.0556   -0.7310   -0.0567    0.0026    1          0.0664          0.0702
    2    1   -2   -1   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0998          0.0995
    3   -1    1    2   -0.0258    0.0888   -0.0262    0.0895    0.0007    1          0.0977          0.0967
    4    1   -2    0   -0.1946   -0.5844   -0.1957   -0.5833    0.0015    1          0.1032          0.1078
    5    1   -1   -1    0.0559   -0.2231    0.0560   -0.2234    0.0003    1          0.0643          0.0654
    6   -1    0    2   -0.1064    0.1196   -0.1085    0.1216    0.0029    1          0.0767          0.0778
    7    2   -2   -1    0.1190   -0.5946    0.1201   -0.5973    0.0030    1          0.1321          0.1302
    8    2   -1   -2    0.1428   -0.2204    0.1454   -0.2240    0.0045    1          0.1031          0.1017
    9   -1   -1    2   -0.1952    0.0487   -0.1952    0.0486    0.0001    1          0.0777          0.0726
   10    1    0   -1    0.2253   -0.1276    0.2251   -0.1274    0.0003    1          0.0459          0.0467
   11    2   -1   -1    0.5352   -0.6134    0.5303   -0.6130    0.0049    1          0.1242          0.1248
   12   -1   -2    2   -0.1817   -0.0387   -0.1829   -0.0381    0.0013    1          0.0999          0.0984
   13    2    1   -2    0.1974   -0.0084    0.1990   -0.0092    0.0017    1          0.1003          0.0927
   14    3    0   -2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1489          0.1473
   15    0   -2    1   -0.3352   -0.2375   -0.3362   -0.2357    0.0021    1          0.0874          0.0881
   16    1    1   -1    0.1255    0.0354    0.1275    0.0362    0.0022    1          0.0621          0.0679
   17    2    0   -1    0.7293   -0.0774    0.7293   -0.0807    0.0033    1          0.1151          0.1198
   18    3   -1   -1    1.0635   -0.5074    1.0696   -0.4972    0.0119    1          0.2536          0.2483
   19    1    2   -1    0.0433    0.0283    0.0442    0.0295    0.0015    1          0.0971          0.0994
   20    2    1   -1    0.4417    0.1663    0.4423    0.1634    0.0030    1          0.1185          0.1178
   21    0   -1    0   -0.0334   -0.0581   -0.0341   -0.0579    0.0008    1          0.0435          0.0568
   22    1    1    0    0.2947    0.3320    0.3053    0.3413    0.0141    1          0.0901          0.0899
   23    0    1    1    0.0350    0.2694    0.0347    0.2716    0.0023    1          0.0808          0.0816

###            No.8                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1036    1.0793    1.1039  110.2940  111.1498  107.8834      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0916    1.0916    1.0916  109.5080  109.5080  109.5080      0.4486         1.0000    1.0000    2.4334    2.4334    2.4334
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0047    0.0047    0.0061    0.0213    0.0213    0.3803      0.0300         0.0099    0.0099    0.1632    0.1632    0.1634
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3091   -0.9060    0.5765)
 a2 = (   -0.6460   -0.3653    0.8604)
 a3 = (   -0.5744   -0.9745   -0.0732)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3332   -0.8968    0.5885) (    0.0085    0.0041    0.0045)
 a2 = (   -0.6123   -0.3625    0.8691) (    0.0049    0.0071    0.0034)
 a3 = (   -0.5682   -0.9660   -0.0755) (    0.0077    0.0074    0.0054)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   41.5759  127.8579  -41.0531    0.3616    0.3159    0.4092
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0000      0.0022    0.0020    0.0117

# Number of computed bands
            400             73
# Figure of merit at the beginning and the end of the refinement
         5.8773        31.3182
# Chi-squares at the beginning and the end of the refinement
    0.1723    0.0194
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -1    1   -2   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    2   -1    1   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    0    1   -2   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5   -1    1   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    2   -1    0   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -1    2   -2    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8   -2    2   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    2   -1   -1   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -1    2   -1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    2   -1   -2   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -2    2    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -2    3    0    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    1    0   -2   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16   -1    1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1    2    0    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -1    3   -1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19   -1    1    2    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -1    2    1    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    0    0   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    0    1    1    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    1    0    1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2   -1    1   -2   -0.0132   -0.1742   -0.0130   -0.1762    0.0020    1          0.0998          0.0995
    3    2   -1    1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1          0.0977          0.0967
    4    0    1   -2   -0.1950   -0.5850   -0.1957   -0.5833    0.0019    1          0.1035          0.1078
    5   -1    1   -1    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0644          0.0654
    6    2   -1    0   -0.1066    0.1193   -0.1085    0.1216    0.0029    1          0.0769          0.0778
    7   -1    2   -2    0.1194   -0.5947    0.1201   -0.5973    0.0027    1          0.1324          0.1302
    8   -2    2   -1    0.1433   -0.2202    0.1454   -0.2240    0.0043    1          0.1034          0.1017
    9    2   -1   -1   -0.1949    0.0488   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10   -1    1    0    0.2252   -0.1274    0.2251   -0.1274    0.0001    1          0.0461          0.0467
   11   -1    2   -1    0.5335   -0.6133    0.5303   -0.6130    0.0032    1          0.1245          0.1248
   12    2   -1   -2   -0.1819   -0.0381   -0.1829   -0.0381    0.0010    1          0.1001          0.0984
   13   -2    2    1    0.1974   -0.0085    0.1990   -0.0092    0.0016    1          0.1005          0.0927
   14   -2    3    0    0.5295   -0.1496    0.5293   -0.1451    0.0045    1          0.1493          0.1473
   15    1    0   -2   -0.3360   -0.2372   -0.3362   -0.2357    0.0015    1          0.0876          0.0881
   16   -1    1    1    0.1256    0.0354    0.1275    0.0362    0.0020    1          0.0622          0.0679
   17   -1    2    0    0.7294   -0.0807    0.7293   -0.0807    0.0001    1          0.1153          0.1198
   18   -1    3   -1    1.0596   -0.5129    1.0696   -0.4972    0.0187    1          0.2538          0.2483
   19   -1    1    2    0.0432    0.0285    0.0442    0.0295    0.0014    1          0.0971          0.0994
   20   -1    2    1    0.4437    0.1653    0.4423    0.1634    0.0023    1          0.1186          0.1178
   21    0    0   -1   -0.0338   -0.0583   -0.0341   -0.0579    0.0005    1          0.0435          0.0568
   22    0    1    1    0.2969    0.3335    0.3053    0.3413    0.0115    1          0.0900          0.0899
   23    1    0    1    0.0345    0.2708    0.0347    0.2716    0.0009    1          0.0807          0.0816

###            No.9                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0923    1.0898    1.0830  109.2958  109.3804  109.1199      0.5849
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0917    1.0917    1.0917  109.5150  109.5150  109.5150      0.4489         1.0000    1.0000    2.4318    2.4318    2.4318
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0045    0.0045    0.0058    0.0205    0.0205    0.3627      0.0284         0.0094    0.0094    0.1543    0.1543    0.1546
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3240    0.8890   -0.5880)
 a2 = (   -0.8940   -0.0779   -0.6635)
 a3 = (   -0.9476    0.5365    0.2817)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3370    0.8954   -0.5888) (    0.0082    0.0039    0.0043)
 a2 = (   -0.9035   -0.0697   -0.6639) (    0.0030    0.0074    0.0040)
 a3 = (   -0.9476    0.5344    0.2800) (    0.0077    0.0063    0.0052)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -125.8920   40.3125 -115.8707    0.4344    0.2915    0.3905
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001   -0.0023      0.0022    0.0020    0.0106

# Number of computed bands
             91             73
# Figure of merit at the beginning and the end of the refinement
         4.5957        30.7847
# Chi-squares at the beginning and the end of the refinement
    0.4258    0.0333
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7366   -0.0642   -0.7310   -0.0567    0.0094    1    0.0868    0.0702
    2    2   -2    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1305    0.0995
    3   -2    1   -1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4    1   -2    1   -0.1904   -0.5832   -0.1957   -0.5833    0.0053    1    0.1352    0.1078
    5    1   -1    1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0842    0.0654
    6   -1    0   -1   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7    1   -2    2    0.1203   -0.5904    0.1201   -0.5973    0.0069    1    0.1734    0.1302
    8    1   -1    2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1354    0.1017
    9    0   -1   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0603    0.0467
   11    0   -1    2    0.5278   -0.6067    0.5303   -0.6130    0.0067    1    0.1624    0.1248
   12    1   -2   -1   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13   -1    1    2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1316    0.0927
   14   -1    0    3    0.5259   -0.1504    0.5293   -0.1451    0.0063    1    0.1958    0.1473
   15    1   -2    0   -0.3344   -0.2387   -0.3362   -0.2357    0.0035    1    0.1144    0.0881
   16   -1    1    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0814    0.0679
   17   -1    0    2    0.7228   -0.0846    0.7293   -0.0807    0.0076    1    0.1507    0.1198
   18   -1   -1    3    1.0393   -0.5107    1.0696   -0.4972    0.0331    1    0.3287    0.2483
   19   -2    2    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1270    0.0994
   20   -2    1    2    0.4432    0.1621    0.4423    0.1634    0.0016    1    0.1553    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -2    1    1    0.2994    0.3310    0.3053    0.3413    0.0118    1    0.1176    0.0899
   23   -2    1    0    0.0360    0.2714    0.0347    0.2716    0.0013    1    0.1050    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7319   -0.0565   -0.7310   -0.0567    0.0008    1          0.0664          0.0702
    2    2   -2    1   -0.0127   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3   -2    1   -1   -0.0266    0.0896   -0.0262    0.0895    0.0004    1          0.0976          0.0967
    4    1   -2    1   -0.1947   -0.5861   -0.1957   -0.5833    0.0029    1          0.1032          0.1078
    5    1   -1    1    0.0570   -0.2231    0.0560   -0.2234    0.0011    1          0.0643          0.0654
    6   -1    0   -1   -0.1073    0.1197   -0.1085    0.1216    0.0022    1          0.0769          0.0778
    7    1   -2    2    0.1206   -0.5948    0.1201   -0.5973    0.0026    1          0.1321          0.1302
    8    1   -1    2    0.1437   -0.2194    0.1454   -0.2240    0.0049    1          0.1033          0.1017
    9    0   -1   -1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    0    1    0.2250   -0.1268    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    0   -1    2    0.5340   -0.6127    0.5303   -0.6130    0.0037    1          0.1241          0.1248
   12    1   -2   -1   -0.1822   -0.0378   -0.1829   -0.0381    0.0007    1          0.1001          0.0984
   13   -1    1    2    0.1974   -0.0084    0.1990   -0.0092    0.0017    1          0.1005          0.0927
   14   -1    0    3    0.5296   -0.1496    0.5293   -0.1451    0.0045    1          0.1490          0.1473
   15    1   -2    0   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16   -1    1    1    0.1258    0.0356    0.1275    0.0362    0.0018    1          0.0621          0.0679
   17   -1    0    2    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -1   -1    3    1.0599   -0.5142    1.0696   -0.4972    0.0196    1          0.2530          0.2483
   19   -2    2    1    0.0434    0.0288    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -2    1    2    0.4451    0.1656    0.4423    0.1634    0.0035    1          0.1183          0.1178
   21    1   -1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -2    1    1    0.2982    0.3354    0.3053    0.3413    0.0092    1          0.0898          0.0899
   23   -2    1    0    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.11                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0845    1.0853    1.0973  110.4143  108.9765  108.5291      0.5223
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0940    1.0940    1.0940  109.6837  109.6837  109.6837      0.4486         1.0000    1.0000    2.4388    2.4388    2.4388
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0071    0.0071    0.0092    0.0412    0.0412    0.5726      0.0285         0.0149    0.0149    0.1557    0.1557    0.1562
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5654   -0.9593   -0.0749)
 a2 = (    0.3477   -0.8885    0.5967)
 a3 = (   -0.5924   -0.3563    0.8761)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5696   -0.9696   -0.0733) (    0.0056    0.0034    0.0056)
 a2 = (    0.3277   -0.9024    0.5901) (    0.0146    0.0051    0.0046)
 a3 = (   -0.6148   -0.3698    0.8691) (    0.0139    0.0056    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -5.7491   40.5053 -116.0558    0.4636    0.4558    0.4602
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0007   -0.0019      0.0023    0.0020    0.0109

# Number of computed bands
             61             69
# Figure of merit at the beginning and the end of the refinement
         8.6151        30.7765
# Chi-squares at the beginning and the end of the refinement
    0.1834    0.0366
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0784    0.0702
    2   -2   -1    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1155    0.0995
    3    1    2   -1   -0.0283    0.0932   -0.0262    0.0895    0.0043    1    0.1134    0.0967
    4   -2    0    1   -0.2023   -0.5869   -0.1957   -0.5833    0.0075    1    0.1211    0.1078
    5   -1   -1    1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0746    0.0654
    6    0    2   -1   -0.1111    0.1226   -0.1085    0.1216    0.0028    1    0.0897    0.0778
    7   -2   -1    2    0.1153   -0.6011    0.1201   -0.5973    0.0061    1    0.1546    0.1302
    8   -1   -2    2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1199    0.1017
    9   -1    2   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0912    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0534    0.0467
   11   -1   -1    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1461    0.1248
   12   -2    2   -1   -0.1852   -0.0381   -0.1829   -0.0381    0.0024    1    0.1170    0.0984
   13    1   -2    2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1165    0.0927
   14    0   -2    3    0.5363   -0.1536    0.5293   -0.1451    0.0110    1    0.1739    0.1473
   15   -2    1    0   -0.3399   -0.2368   -0.3362   -0.2357    0.0038    1    0.1026    0.0881
   16    1   -1    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0721    0.0679
   17    0   -1    2    0.7442   -0.0855    0.7293   -0.0807    0.0156    1    0.1352    0.1198
   18   -1   -1    3    1.0810   -0.5400    1.0696   -0.4972    0.0443    1    0.3040    0.2483
   19    2   -1    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1124    0.0994
   20    1   -1    2    0.4521    0.1688    0.4423    0.1634    0.0111    1    0.1378    0.1178
   21   -1    0    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0503    0.0568
   22    1    0    1    0.3021    0.3432    0.3053    0.3413    0.0037    1    0.1047    0.0899
   23    1    1    0    0.0328    0.2785    0.0347    0.2716    0.0071    1    0.0936    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7361   -0.0559   -0.7310   -0.0567    0.0052    1          0.0664          0.0702
    2   -2   -1    1   -0.0132   -0.1721   -0.0130   -0.1762    0.0041    1          0.0997          0.0995
    3    1    2   -1   -0.0262    0.0906   -0.0262    0.0895    0.0012    1          0.0977          0.0967
    4   -2    0    1   -0.1945   -0.5840   -0.1957   -0.5833    0.0014    1          0.1029          0.1078
    5   -1   -1    1    0.0554   -0.2220    0.0560   -0.2234    0.0015    1          0.0642          0.0654
    6    0    2   -1   -0.1074    0.1211   -0.1085    0.1216    0.0012    1          0.0767          0.0778
    7   -2   -1    2    0.1185   -0.5942    0.1201   -0.5973    0.0035    1          0.1317          0.1302
    8   -1   -2    2    0.1421   -0.2199    0.1454   -0.2240    0.0053    1          0.1030          0.1017
    9   -1    2   -1   -0.1964    0.0491   -0.1952    0.0486    0.0012    1          0.0776          0.0726
   10    0   -1    1    0.2251   -0.1277    0.2251   -0.1274    0.0003    1          0.0459          0.0467
   11   -1   -1    2    0.5356   -0.6143    0.5303   -0.6130    0.0055    1          0.1239          0.1248
   12   -2    2   -1   -0.1820   -0.0389   -0.1829   -0.0381    0.0012    1          0.0997          0.0984
   13    1   -2    2    0.1979   -0.0084    0.1990   -0.0092    0.0013    1          0.1002          0.0927
   14    0   -2    3    0.5312   -0.1484    0.5293   -0.1451    0.0037    1          0.1487          0.1473
   15   -2    1    0   -0.3351   -0.2379   -0.3362   -0.2357    0.0024    1          0.0873          0.0881
   16    1   -1    1    0.1261    0.0356    0.1275    0.0362    0.0014    1          0.0621          0.0679
   17    0   -1    2    0.7309   -0.0771    0.7293   -0.0807    0.0040    1          0.1150          0.1198
   18   -1   -1    3    1.0659   -0.5078    1.0696   -0.4972    0.0112    1          0.2531          0.2483
   19    2   -1    1    0.0441    0.0288    0.0442    0.0295    0.0007    1          0.0971          0.0994
   20    1   -1    2    0.4429    0.1671    0.4423    0.1634    0.0038    1          0.1185          0.1178
   21   -1    0    0   -0.0327   -0.0570   -0.0341   -0.0579    0.0017    1          0.0435          0.0568
   22    1    0    1    0.2958    0.3333    0.3053    0.3413    0.0124    1          0.0903          0.0899
   23    1    1    0    0.0356    0.2713    0.0347    0.2716    0.0009    1          0.0810          0.0816

###            No.12                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1039    1.0790    1.0793  109.3487  110.2940  107.8862      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0917    1.0917    1.0917  109.5153  109.5153  109.5153      0.4489         1.0000    1.0000    2.4318    2.4318    2.4318
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0045    0.0045    0.0058    0.0205    0.0205    0.3626      0.0284         0.0094    0.0094    0.1543    0.1543    0.1546
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.8835    0.0685    0.6497)
 a2 = (    0.3091   -0.9060    0.5765)
 a3 = (    0.9551   -0.5407   -0.2839)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9035    0.0697    0.6639) (    0.0030    0.0074    0.0040)
 a2 = (    0.3371   -0.8954    0.5888) (    0.0082    0.0039    0.0043)
 a3 = (    0.9476   -0.5344   -0.2800) (    0.0077    0.0063    0.0052)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   65.9979  139.6890   64.1288    0.4335    0.2915    0.3905
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001   -0.0024      0.0022    0.0020    0.0106

# Number of computed bands
            400             73
# Figure of merit at the beginning and the end of the refinement
         5.8773        30.7754
# Chi-squares at the beginning and the end of the refinement
    0.0432    0.0333
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    2   -2   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -1    2    1   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    2   -1   -1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    1   -1   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    0    1    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    2   -1   -2    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    1   -1   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    1    0    1   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    1    0   -2    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    2   -1    1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -1    1   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    0    1   -3    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    2   -1    0   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16   -1    1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    0    1   -2    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    1    1   -3    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19   -2    2   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -1    2   -2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    1   -1    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -1    2   -1    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -1    2    0    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    0   -0.7318   -0.0566   -0.7310   -0.0567    0.0008    1          0.0664          0.0702
    2    2   -2   -1   -0.0127   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3   -1    2    1   -0.0266    0.0896   -0.0262    0.0895    0.0004    1          0.0976          0.0967
    4    2   -1   -1   -0.1947   -0.5861   -0.1957   -0.5833    0.0029    1          0.1032          0.1078
    5    1   -1   -1    0.0570   -0.2231    0.0560   -0.2234    0.0011    1          0.0643          0.0654
    6    0    1    1   -0.1073    0.1197   -0.1085    0.1216    0.0022    1          0.0769          0.0778
    7    2   -1   -2    0.1206   -0.5948    0.1201   -0.5973    0.0026    1          0.1321          0.1302
    8    1   -1   -2    0.1437   -0.2195    0.1454   -0.2240    0.0048    1          0.1033          0.1017
    9    1    0    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    0   -1    0.2251   -0.1268    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    0   -2    0.5341   -0.6128    0.5303   -0.6130    0.0037    1          0.1241          0.1248
   12    2   -1    1   -0.1821   -0.0378   -0.1829   -0.0381    0.0007    1          0.1001          0.0984
   13   -1    1   -2    0.1974   -0.0084    0.1990   -0.0092    0.0017    1          0.1005          0.0927
   14    0    1   -3    0.5297   -0.1496    0.5293   -0.1451    0.0045    1          0.1490          0.1473
   15    2   -1    0   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16   -1    1   -1    0.1258    0.0356    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    0    1   -2    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    1    1   -3    1.0600   -0.5143    1.0696   -0.4972    0.0196    1          0.2530          0.2483
   19   -2    2   -1    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20   -1    2   -2    0.4451    0.1657    0.4423    0.1634    0.0036    1          0.1183          0.1178
   21    1   -1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1    2   -1    0.2982    0.3355    0.3053    0.3413    0.0092    1          0.0898          0.0899
   23   -1    2    0    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.22                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0928    1.0911    1.0905  109.4385  109.5368  109.5179      0.4144
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0942    1.0942    1.0942  109.6987  109.6987  109.6987      0.4488         1.0000    1.0000    2.4381    2.4381    2.4381
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0071    0.0071    0.0092    0.0420    0.0420    0.5727      0.0285         0.0149    0.0149    0.1556    0.1556    0.1561
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3315    0.8956   -0.5891)
 a2 = (    0.5690    0.9654    0.0753)
 a3 = (    0.6134    0.3607   -0.8699)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3274    0.9029   -0.5903) (    0.0146    0.0051    0.0046)
 a2 = (    0.5698    0.9700    0.0730) (    0.0056    0.0034    0.0056)
 a3 = (    0.6149    0.3704   -0.8692) (    0.0139    0.0056    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -53.7190  139.4933   63.9244    0.5397    0.4558    0.4598
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0008   -0.0020      0.0023    0.0020    0.0109

# Number of computed bands
             75             69
# Figure of merit at the beginning and the end of the refinement
        16.2101        30.4284
# Chi-squares at the beginning and the end of the refinement
    0.0616    0.0374
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0615    0.0702
    2    1    2   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0922    0.0995
    3   -2   -1    1   -0.0264    0.0894   -0.0262    0.0895    0.0002    1    0.0902    0.0967
    4    0    2   -1   -0.1954   -0.5847   -0.1957   -0.5833    0.0014    1    0.0956    0.1078
    5    1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0595    0.0654
    6   -2    0    1   -0.1071    0.1200   -0.1085    0.1216    0.0021    1    0.0709    0.0778
    7    1    2   -2    0.1187   -0.5946    0.1201   -0.5973    0.0031    1    0.1224    0.1302
    8    2    1   -2    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0955    0.1017
    9   -2    1    1   -0.1955    0.0493   -0.1952    0.0486    0.0007    1    0.0720    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0426    0.0467
   11    1    1   -2    0.5326   -0.6136    0.5303   -0.6130    0.0023    1    0.1150    0.1248
   12   -2    2    1   -0.1823   -0.0378   -0.1829   -0.0381    0.0006    1    0.0925    0.0984
   13    2   -1   -2    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0929    0.0927
   14    2    0   -3    0.5294   -0.1500    0.5293   -0.1451    0.0049    1    0.1380    0.1473
   15   -1    2    0   -0.3365   -0.2370   -0.3362   -0.2357    0.0013    1    0.0810    0.0881
   16    1   -1   -1    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0575    0.0679
   17    1    0   -2    0.7294   -0.0815    0.7293   -0.0807    0.0008    1    0.1066    0.1198
   18    1    1   -3    1.0580   -0.5142    1.0696   -0.4972    0.0206    1    0.2345    0.2483
   19    1   -2   -1    0.0431    0.0289    0.0442    0.0295    0.0013    1    0.0897    0.0994
   20    1   -1   -2    0.4441    0.1652    0.4423    0.1634    0.0025    1    0.1096    0.1178
   21    0    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0402    0.0568
   22    0   -1   -1    0.2976    0.3338    0.3053    0.3413    0.0107    1    0.0832    0.0899
   23   -1   -1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0745    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7361   -0.0559   -0.7310   -0.0567    0.0052    1          0.0664          0.0702
    2    1    2   -1   -0.0132   -0.1719   -0.0130   -0.1762    0.0043    1          0.0998          0.0995
    3   -2   -1    1   -0.0262    0.0907   -0.0262    0.0895    0.0013    1          0.0978          0.0967
    4    0    2   -1   -0.1944   -0.5837   -0.1957   -0.5833    0.0014    1          0.1029          0.1078
    5    1    1   -1    0.0553   -0.2219    0.0560   -0.2234    0.0016    1          0.0643          0.0654
    6   -2    0    1   -0.1074    0.1211   -0.1085    0.1216    0.0012    1          0.0767          0.0778
    7    1    2   -2    0.1184   -0.5942    0.1201   -0.5973    0.0036    1          0.1317          0.1302
    8    2    1   -2    0.1420   -0.2200    0.1454   -0.2240    0.0052    1          0.1030          0.1017
    9   -2    1    1   -0.1963    0.0490   -0.1952    0.0486    0.0011    1          0.0776          0.0726
   10    1    0   -1    0.2253   -0.1279    0.2251   -0.1274    0.0005    1          0.0459          0.0467
   11    1    1   -2    0.5358   -0.6146    0.5303   -0.6130    0.0057    1          0.1239          0.1248
   12   -2    2    1   -0.1817   -0.0390   -0.1829   -0.0381    0.0014    1          0.0998          0.0984
   13    2   -1   -2    0.1981   -0.0085    0.1990   -0.0092    0.0011    1          0.1002          0.0927
   14    2    0   -3    0.5315   -0.1484    0.5293   -0.1451    0.0040    1          0.1488          0.1473
   15   -1    2    0   -0.3348   -0.2378   -0.3362   -0.2357    0.0025    1          0.0873          0.0881
   16    1   -1   -1    0.1264    0.0356    0.1275    0.0362    0.0012    1          0.0621          0.0679
   17    1    0   -2    0.7313   -0.0769    0.7293   -0.0807    0.0043    1          0.1150          0.1198
   18    1    1   -3    1.0667   -0.5077    1.0696   -0.4972    0.0109    1          0.2532          0.2483
   19    1   -2   -1    0.0444    0.0289    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    1   -1   -2    0.4431    0.1673    0.4423    0.1634    0.0040    1          0.1186          0.1178
   21    0    1    0   -0.0325   -0.0568   -0.0341   -0.0579    0.0020    1          0.0436          0.0568
   22    0   -1   -1    0.2958    0.3334    0.3053    0.3413    0.0124    1          0.0903          0.0899
   23   -1   -1    0    0.0357    0.2714    0.0347    0.2716    0.0010    1          0.0810          0.0816

###            No.24                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0971    1.0860    1.1078  111.2897  110.1765  108.1618      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0912    1.0912    1.0912  109.4788  109.4788  109.4788      0.4497         1.0000    1.0000    2.4265    2.4265    2.4265
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0296    0.0296    0.5541      0.0296         0.0144    0.0144    0.1602    0.1602    0.1607
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9444   -0.5347   -0.2807)
 a2 = (    0.9173    0.0711    0.6746)
 a3 = (    0.3715   -0.8863    0.5985)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9463   -0.5350   -0.2804) (    0.0033    0.0055    0.0059)
 a2 = (    0.9027    0.0703    0.6637) (    0.0039    0.0129    0.0046)
 a3 = (    0.3349   -0.8950    0.5892) (    0.0071    0.0137    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -16.8038   59.7709  -20.8355    0.3943    0.4203    0.4342
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001   -0.0026      0.0021    0.0024    0.0119

# Number of computed bands
            400             73
# Figure of merit at the beginning and the end of the refinement
         7.5123        30.3889
# Chi-squares at the beginning and the end of the refinement
    0.1082    0.0250
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2   -1    2   -2   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    1   -1    2   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4   -1    2   -1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5   -1    1   -1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    1    0    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7   -2    2   -1    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8   -2    1   -1    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    1    1    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10   -1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2    1    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    1    2   -1   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13   -2   -1    1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14   -3    0    1    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    0    2   -1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16   -1   -1    1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17   -2    0    1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18   -3    1    1    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19   -1   -2    2    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -2   -1    2    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0    1   -1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -1   -1    2    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23    0   -1    2    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7324   -0.0572   -0.7310   -0.0567    0.0015    1          0.0665          0.0702
    2   -1    2   -2   -0.0130   -0.1738   -0.0130   -0.1762    0.0024    1          0.0997          0.0995
    3    1   -1    2   -0.0265    0.0899   -0.0262    0.0895    0.0006    1          0.0977          0.0967
    4   -1    2   -1   -0.1949   -0.5853   -0.1957   -0.5833    0.0021    1          0.1034          0.1078
    5   -1    1   -1    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0644          0.0654
    6    1    0    1   -0.1072    0.1200   -0.1085    0.1216    0.0020    1          0.0769          0.0778
    7   -2    2   -1    0.1196   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8   -2    1   -1    0.1435   -0.2200    0.1454   -0.2240    0.0044    1          0.1035          0.1017
    9    1    1    0   -0.1951    0.0490   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    0    0    0.2255   -0.1274    0.2251   -0.1274    0.0004    1          0.0461          0.0467
   11   -2    1    0    0.5334   -0.6141    0.5303   -0.6130    0.0033    1          0.1244          0.1248
   12    1    2   -1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1          0.1002          0.0984
   13   -2   -1    1    0.1982   -0.0086    0.1990   -0.0092    0.0010    1          0.1006          0.0927
   14   -3    0    1    0.5305   -0.1504    0.5293   -0.1451    0.0055    1          0.1494          0.1473
   15    0    2   -1   -0.3361   -0.2371   -0.3362   -0.2357    0.0014    1          0.0876          0.0881
   16   -1   -1    1    0.1265    0.0357    0.1275    0.0362    0.0011    1          0.0622          0.0679
   17   -2    0    1    0.7314   -0.0822    0.7293   -0.0807    0.0025    1          0.1154          0.1198
   18   -3    1    1    1.0600   -0.5164    1.0696   -0.4972    0.0215    1          0.2536          0.2483
   19   -1   -2    2    0.0440    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -2   -1    2    0.4461    0.1656    0.4423    0.1634    0.0043    1          0.1186          0.1178
   21    0    1   -1   -0.0335   -0.0577   -0.0341   -0.0579    0.0007    1          0.0434          0.0568
   22   -1   -1    2    0.2991    0.3356    0.3053    0.3413    0.0085    1          0.0900          0.0899
   23    0   -1    2    0.0345    0.2730    0.0347    0.2716    0.0013    1          0.0806          0.0816

###            No.35                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0938    1.0904    1.0901  109.3900  109.7138  109.3846      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0895    1.0895    1.0895  109.3487  109.3487  109.3487      0.4482         1.0000    1.0000    2.4307    2.4307    2.4307
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0230    0.0230    0.5547      0.0284         0.0144    0.0144    0.1546    0.1546    0.1551
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3384   -0.8924    0.5885)
 a2 = (    0.9462   -0.5333   -0.2836)
 a3 = (    0.9058    0.0702    0.6637)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3293   -0.8941    0.5886) (    0.0144    0.0053    0.0044)
 a2 = (    0.9440   -0.5328   -0.2817) (    0.0033    0.0054    0.0058)
 a3 = (    0.8982    0.0735    0.6649) (    0.0135    0.0081    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  138.2728   52.1507  138.9092    0.4686    0.4275    0.5059
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0000   -0.0001      0.0023    0.0021    0.0108

# Number of computed bands
             79             72
# Figure of merit at the beginning and the end of the refinement
         4.7313        30.0563
# Chi-squares at the beginning and the end of the refinement
    0.4554    0.0375
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2   -2   -1    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    2    1   -1   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4   -1   -1    2   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5   -1   -1    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1    1    0   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7   -1   -2    2    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8   -1   -2    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    0    1    1   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10    0   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    0   -2    1    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12   -1    1    2   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13    1   -2   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    1   -3    0    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15   -1    0    2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    1   -1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1   -2    0    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18    1   -3    1    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19    2   -1   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    2   -2   -1    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2   -1   -1    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23    2    0   -1    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7351   -0.0602   -0.7310   -0.0567    0.0054    1          0.0666          0.0702
    2   -2   -1    2   -0.0135   -0.1749   -0.0130   -0.1762    0.0014    1          0.0998          0.0995
    3    2    1   -1   -0.0258    0.0887   -0.0262    0.0895    0.0009    1          0.0974          0.0967
    4   -1   -1    2   -0.1943   -0.5853   -0.1957   -0.5833    0.0024    1          0.1037          0.1078
    5   -1   -1    1    0.0564   -0.2246    0.0560   -0.2234    0.0013    1          0.0644          0.0654
    6    1    1    0   -0.1066    0.1198   -0.1085    0.1216    0.0026    1          0.0765          0.0778
    7   -1   -2    2    0.1192   -0.5955    0.1201   -0.5973    0.0020    1          0.1327          0.1302
    8   -1   -2    1    0.1439   -0.2214    0.1454   -0.2240    0.0030    1          0.1033          0.1017
    9    0    1    1   -0.1956    0.0488   -0.1952    0.0486    0.0005    1          0.0776          0.0726
   10    0   -1    0    0.2266   -0.1277    0.2251   -0.1274    0.0015    1          0.0460          0.0467
   11    0   -2    1    0.5341   -0.6145    0.5303   -0.6130    0.0041    1          0.1247          0.1248
   12   -1    1    2   -0.1822   -0.0385   -0.1829   -0.0381    0.0007    1          0.1000          0.0984
   13    1   -2   -1    0.1982   -0.0079    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -3    0    0.5311   -0.1494    0.5293   -0.1451    0.0047    1          0.1494          0.1473
   15   -1    0    2   -0.3358   -0.2385   -0.3362   -0.2357    0.0028    1          0.0877          0.0881
   16    1   -1   -1    0.1257    0.0360    0.1275    0.0362    0.0018    1          0.0622          0.0679
   17    1   -2    0    0.7305   -0.0804    0.7293   -0.0807    0.0012    1          0.1155          0.1198
   18    1   -3    1    1.0594   -0.5135    1.0696   -0.4972    0.0193    1          0.2542          0.2483
   19    2   -1   -2    0.0429    0.0287    0.0442    0.0295    0.0015    1          0.0971          0.0994
   20    2   -2   -1    0.4438    0.1659    0.4423    0.1634    0.0029    1          0.1186          0.1178
   21   -1    0    1   -0.0342   -0.0586   -0.0341   -0.0579    0.0007    1          0.0435          0.0568
   22    2   -1   -1    0.2970    0.3332    0.3053    0.3413    0.0116    1          0.0900          0.0899
   23    2    0   -1    0.0351    0.2707    0.0347    0.2716    0.0010    1          0.0805          0.0816

###            No.36                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0978    1.0968    1.0845  110.3354  109.0141  109.4741      0.4564
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0893    1.0893    1.0893  109.3349  109.3349  109.3349      0.4485         1.0000    1.0000    2.4287    2.4287    2.4287
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0222    0.0222    0.5547      0.0284         0.0144    0.0144    0.1544    0.1544    0.1549
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9397    0.5320    0.2793)
 a2 = (   -0.3468    0.8894   -0.5963)
 a3 = (   -0.9127   -0.0707   -0.6712)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9438    0.5328    0.2812) (    0.0033    0.0054    0.0058)
 a2 = (   -0.3284    0.8938   -0.5890) (    0.0144    0.0053    0.0044)
 a3 = (   -0.8975   -0.0739   -0.6654) (    0.0135    0.0081    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  161.4499  127.8631  -41.0862    0.4494    0.4277    0.5057
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0001   -0.0004      0.0023    0.0021    0.0108

# Number of computed bands
             57             71
# Figure of merit at the beginning and the end of the refinement
        19.8589        29.9734
# Chi-squares at the beginning and the end of the refinement
    0.2271    0.0387
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    1    2   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1   -2    1   -0.0282    0.0931   -0.0262    0.0895    0.0042    1    0.0990    0.0967
    4    1    1   -2   -0.2022   -0.5864   -0.1957   -0.5833    0.0072    1    0.1057    0.1078
    5    1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -1   -1    0   -0.1110    0.1226   -0.1085    0.1216    0.0027    1    0.0783    0.0778
    7    2    1   -2    0.1149   -0.6008    0.1201   -0.5973    0.0063    1    0.1350    0.1302
    8    2    1   -1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -1    0   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    2    0   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -1    1   -2   -0.1851   -0.0382   -0.1829   -0.0381    0.0023    1    0.1022    0.0984
   13    2   -1    1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    3   -1    0    0.5363   -0.1533    0.5293   -0.1451    0.0108    1    0.1517    0.1473
   15    0    1   -2   -0.3395   -0.2367   -0.3362   -0.2357    0.0035    1    0.0897    0.0881
   16    1   -1    1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    2   -1    0    0.7439   -0.0847    0.7293   -0.0807    0.0151    1    0.1181    0.1198
   18    3   -1   -1    1.0814   -0.5390    1.0696   -0.4972    0.0434    1    0.2650    0.2483
   19    1   -2    2    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    2   -2    1    0.4514    0.1690    0.4423    0.1634    0.0106    1    0.1204    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    1   -2    1    0.3014    0.3427    0.3053    0.3413    0.0041    1    0.0914    0.0899
   23    0   -2    1    0.0329    0.2780    0.0347    0.2716    0.0066    1    0.0818    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7364   -0.0607   -0.7310   -0.0567    0.0068    1          0.0667          0.0702
    2    1    2   -2   -0.0135   -0.1749   -0.0130   -0.1762    0.0014    1          0.0999          0.0995
    3   -1   -2    1   -0.0259    0.0889   -0.0262    0.0895    0.0006    1          0.0974          0.0967
    4    1    1   -2   -0.1942   -0.5855   -0.1957   -0.5833    0.0027    1          0.1037          0.1078
    5    1    1   -1    0.0563   -0.2245    0.0560   -0.2234    0.0011    1          0.0644          0.0654
    6   -1   -1    0   -0.1070    0.1202   -0.1085    0.1216    0.0021    1          0.0765          0.0778
    7    2    1   -2    0.1192   -0.5954    0.1201   -0.5973    0.0021    1          0.1327          0.1302
    8    2    1   -1    0.1437   -0.2213    0.1454   -0.2240    0.0031    1          0.1033          0.1017
    9   -1    0   -1   -0.1963    0.0489   -0.1952    0.0486    0.0011    1          0.0777          0.0726
   10    1    0    0    0.2263   -0.1277    0.2251   -0.1274    0.0012    1          0.0460          0.0467
   11    2    0   -1    0.5339   -0.6143    0.5303   -0.6130    0.0038    1          0.1247          0.1248
   12   -1    1   -2   -0.1827   -0.0387   -0.1829   -0.0381    0.0006    1          0.1000          0.0984
   13    2   -1    1    0.1979   -0.0079    0.1990   -0.0092    0.0016    1          0.1004          0.0927
   14    3   -1    0    0.5308   -0.1494    0.5293   -0.1451    0.0046    1          0.1494          0.1473
   15    0    1   -2   -0.3361   -0.2389   -0.3362   -0.2357    0.0032    1          0.0877          0.0881
   16    1   -1    1    0.1254    0.0359    0.1275    0.0362    0.0021    1          0.0622          0.0679
   17    2   -1    0    0.7302   -0.0805    0.7293   -0.0807    0.0009    1          0.1155          0.1198
   18    3   -1   -1    1.0587   -0.5134    1.0696   -0.4972    0.0195    1          0.2540          0.2483
   19    1   -2    2    0.0427    0.0285    0.0442    0.0295    0.0018    1          0.0972          0.0994
   20    2   -2    1    0.4436    0.1657    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0    1   -1   -0.0343   -0.0587   -0.0341   -0.0579    0.0008    1          0.0435          0.0568
   22    1   -2    1    0.2971    0.3330    0.3053    0.3413    0.0117    1          0.0901          0.0899
   23    0   -2    1    0.0353    0.2709    0.0347    0.2716    0.0010    1          0.0806          0.0816

###            No.45                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0942    1.0860    1.0898  109.0811  109.9730  109.1020      0.5885
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0887    1.0887    1.0887  109.2913  109.2913  109.2913      0.4479         1.0000    1.0000    2.4309    2.4309    2.4309
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0200    0.0200    0.5546      0.0283         0.0144    0.0144    0.1545    0.1545    0.1550
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3331   -0.8879    0.5931)
 a2 = (    0.9447   -0.5324   -0.2832)
 a3 = (    0.8996    0.0732    0.6681)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3266   -0.8936    0.5887) (    0.0144    0.0053    0.0044)
 a2 = (    0.9427   -0.5324   -0.2821) (    0.0033    0.0054    0.0058)
 a3 = (    0.8964    0.0748    0.6653) (    0.0135    0.0081    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  138.1905   52.1183  138.8519    0.4694    0.4280    0.5074
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003   -0.0000    0.0007      0.0023    0.0021    0.0108

# Number of computed bands
             87             71
# Figure of merit at the beginning and the end of the refinement
         4.5251        29.2793
# Chi-squares at the beginning and the end of the refinement
    0.5035    0.0417
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7378   -0.0600   -0.7310   -0.0567    0.0076    1    0.0879    0.0702
    2   -2   -1    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    2    1   -1   -0.0270    0.0906   -0.0262    0.0895    0.0014    1    0.1276    0.0967
    4   -1   -1    2   -0.1962   -0.5897   -0.1957   -0.5833    0.0064    1    0.1365    0.1078
    5   -1   -1    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1    1    0   -0.1085    0.1206   -0.1085    0.1216    0.0010    1    0.1005    0.0778
    7   -1   -2    2    0.1209   -0.5994    0.1201   -0.5973    0.0022    1    0.1749    0.1302
    8   -1   -2    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    0    1    1   -0.1965    0.0489   -0.1952    0.0486    0.0013    1    0.1022    0.0726
   10    0   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    0   -2    1    0.5371   -0.6175    0.5303   -0.6130    0.0081    1    0.1650    0.1248
   12   -1    1    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1313    0.0984
   13    1   -2   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    1   -3    0    0.5338   -0.1514    0.5293   -0.1451    0.0078    1    0.1974    0.1473
   15   -1    0    2   -0.3384   -0.2388   -0.3362   -0.2357    0.0038    1    0.1152    0.0881
   16    1   -1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1   -2    0    0.7355   -0.0836    0.7293   -0.0807    0.0068    1    0.1529    0.1198
   18    1   -3    1    1.0639   -0.5199    1.0696   -0.4972    0.0235    1    0.3386    0.2483
   19    2   -1   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    2   -2   -1    0.4495    0.1660    0.4423    0.1634    0.0076    1    0.1564    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2   -1   -1    0.3024    0.3380    0.3053    0.3413    0.0044    1    0.1184    0.0899
   23    2    0   -1    0.0348    0.2758    0.0347    0.2716    0.0042    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7363   -0.0614   -0.7310   -0.0567    0.0071    1          0.0667          0.0702
    2   -2   -1    2   -0.0137   -0.1750   -0.0130   -0.1762    0.0013    1          0.0999          0.0995
    3    2    1   -1   -0.0256    0.0885   -0.0262    0.0895    0.0011    1          0.0974          0.0967
    4   -1   -1    2   -0.1941   -0.5849   -0.1957   -0.5833    0.0023    1          0.1038          0.1078
    5   -1   -1    1    0.0562   -0.2249    0.0560   -0.2234    0.0016    1          0.0644          0.0654
    6    1    1    0   -0.1065    0.1199   -0.1085    0.1216    0.0026    1          0.0764          0.0778
    7   -1   -2    2    0.1187   -0.5956    0.1201   -0.5973    0.0023    1          0.1328          0.1302
    8   -1   -2    1    0.1439   -0.2220    0.1454   -0.2240    0.0025    1          0.1033          0.1017
    9    0    1    1   -0.1958    0.0488   -0.1952    0.0486    0.0007    1          0.0775          0.0726
   10    0   -1    0    0.2270   -0.1280    0.2251   -0.1274    0.0019    1          0.0460          0.0467
   11    0   -2    1    0.5340   -0.6149    0.5303   -0.6130    0.0041    1          0.1249          0.1248
   12   -1    1    2   -0.1823   -0.0387   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    1   -2   -1    0.1984   -0.0077    0.1990   -0.0092    0.0015    1          0.1003          0.0927
   14    1   -3    0    0.5315   -0.1494    0.5293   -0.1451    0.0047    1          0.1495          0.1473
   15   -1    0    2   -0.3355   -0.2388   -0.3362   -0.2357    0.0032    1          0.0877          0.0881
   16    1   -1   -1    0.1256    0.0362    0.1275    0.0362    0.0019    1          0.0622          0.0679
   17    1   -2    0    0.7305   -0.0801    0.7293   -0.0807    0.0013    1          0.1156          0.1198
   18    1   -3    1    1.0589   -0.5133    1.0696   -0.4972    0.0193    1          0.2544          0.2483
   19    2   -1   -2    0.0428    0.0287    0.0442    0.0295    0.0017    1          0.0972          0.0994
   20    2   -2   -1    0.4433    0.1660    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21   -1    0    1   -0.0343   -0.0587   -0.0341   -0.0579    0.0008    1          0.0436          0.0568
   22    2   -1   -1    0.2967    0.3325    0.3053    0.3413    0.0123    1          0.0901          0.0899
   23    2    0   -1    0.0355    0.2703    0.0347    0.2716    0.0016    1          0.0806          0.0816

###            No.46                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0935    1.0899    1.0920  109.4876  109.6263  109.4429      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0906    1.0906    1.0906  109.4297  109.4297  109.4297      0.4487         1.0000    1.0000    2.4305    2.4305    2.4305
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0045    0.0045    0.0058    0.0178    0.0178    0.3654      0.0284         0.0095    0.0095    0.1542    0.1542    0.1545
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9014   -0.0731   -0.6640)
 a2 = (    0.0439   -0.6083   -0.9449)
 a3 = (   -0.5694   -0.9659   -0.0754)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9015   -0.0690   -0.6637) (    0.0031    0.0073    0.0041)
 a2 = (    0.0458   -0.6035   -0.9443) (    0.0071    0.0042    0.0027)
 a3 = (   -0.5666   -0.9651   -0.0748) (    0.0073    0.0072    0.0048)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -136.8379   59.8833  -20.8212    0.3412    0.2821    0.3801
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002   -0.0020      0.0022    0.0020    0.0106

# Number of computed bands
            195             87
# Figure of merit at the beginning and the end of the refinement
         3.3663        29.2634
# Chi-squares at the beginning and the end of the refinement
    0.4686    0.0314
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    0   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    1   -1   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3   -2    1    2   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4    0   -2   -2   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    1   -1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6   -2    1    1   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7    1   -2   -1    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8    2   -2   -1    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9   -2    1    0   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    1   -2    0    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12   -2    1   -1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13    2   -2    1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14    2   -3    1    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15   -1    0   -1   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16    2   -2    2    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17    2   -4    2    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18    1   -3    1    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19    2   -2    3    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20    1   -2    2    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    0    0   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22    0   -1    2    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -1    0    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    0   -0.7331   -0.0563   -0.7310   -0.0567    0.0021    1          0.0664          0.0702
    2    1   -1   -2   -0.0129   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3   -2    1    2   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0975          0.0967
    4    0   -1   -1   -0.1944   -0.5865   -0.1957   -0.5833    0.0035    1          0.1032          0.1078
    5    1   -1   -1    0.0569   -0.2233    0.0560   -0.2234    0.0010    1          0.0643          0.0654
    6   -2    1    1   -0.1071    0.1195   -0.1085    0.1216    0.0025    1          0.0768          0.0778
    7    1   -2   -1    0.1209   -0.5950    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    2   -2   -1    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1033          0.1017
    9   -2    1    0   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    1   -1    0    0.2254   -0.1272    0.2251   -0.1274    0.0004    1          0.0461          0.0467
   11    1   -2    0    0.5346   -0.6124    0.5303   -0.6130    0.0043    1          0.1242          0.1248
   12   -2    1   -1   -0.1819   -0.0378   -0.1829   -0.0381    0.0010    1          0.0999          0.0984
   13    2   -2    1    0.1979   -0.0085    0.1990   -0.0092    0.0012    1          0.1005          0.0927
   14    2   -3    1    0.5299   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1    0   -1   -0.3366   -0.2374   -0.3362   -0.2357    0.0018    1          0.0874          0.0881
   16    1   -1    1    0.1263    0.0357    0.1275    0.0362    0.0013    1          0.0621          0.0679
   17    1   -2    1    0.7301   -0.0810    0.7293   -0.0807    0.0008    1          0.1152          0.1198
   18    1   -3    1    1.0597   -0.5124    1.0696   -0.4972    0.0182    1          0.2531          0.2483
   19    1   -1    2    0.0438    0.0290    0.0442    0.0295    0.0007    1          0.0969          0.0994
   20    1   -2    2    0.4452    0.1656    0.4423    0.1634    0.0036    1          0.1185          0.1178
   21    0    0   -1   -0.0337   -0.0579   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    0   -1    2    0.2983    0.3352    0.3053    0.3413    0.0093    1          0.0899          0.0899
   23   -1    0    2    0.0342    0.2724    0.0347    0.2716    0.0009    1          0.0805          0.0816

###            No.52                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0919    1.0954    1.0864  110.9474  108.6156  108.8448      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0932    1.0932    1.0932  109.6214  109.6214  109.6214      0.4499         1.0000    1.0000    2.4298    2.4298    2.4298
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0063    0.0063    0.0082    0.0340    0.0340    0.5122      0.0286         0.0133    0.0133    0.1549    0.1549    0.1553
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9363   -0.5301   -0.2783)
 a2 = (    0.8913    0.0516    0.6832)
 a3 = (    0.3270   -0.9036    0.5982)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9500   -0.5353   -0.2793) (    0.0031    0.0055    0.0058)
 a2 = (    0.9070    0.0670    0.6632) (    0.0037    0.0122    0.0045)
 a3 = (    0.3422   -0.8965    0.5885) (    0.0068    0.0127    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -16.6741   59.8453  -20.8411    0.3799    0.3843    0.4333
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0040      0.0021    0.0023    0.0114

# Number of computed bands
            400             73
# Figure of merit at the beginning and the end of the refinement
         6.3733        29.1284
# Chi-squares at the beginning and the end of the refinement
    0.7224    0.0373
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2   -1    2   -2   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    1   -1    2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1    2   -1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5   -1    1   -1    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    1    0    1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7   -2    2   -1    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8   -2    1   -1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    1    1    0   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10   -1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2    1    0    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    1    2   -1   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13   -2   -1    1    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14   -3    0    1    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15    0    2   -1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16   -1   -1    1    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17   -2    0    1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18   -3    1    1    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19   -1   -2    2    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20   -2   -1    2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0    1   -1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22   -1   -1    2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    0   -1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7298   -0.0541   -0.7310   -0.0567    0.0028    1          0.0664          0.0702
    2   -1    2   -2   -0.0123   -0.1741   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    1   -1    2   -0.0270    0.0898   -0.0262    0.0895    0.0009    1          0.0977          0.0967
    4   -1    2   -1   -0.1953   -0.5873   -0.1957   -0.5833    0.0040    1          0.1031          0.1078
    5   -1    1   -1    0.0575   -0.2227    0.0560   -0.2234    0.0017    1          0.0643          0.0654
    6    1    0    1   -0.1075    0.1193   -0.1085    0.1216    0.0025    1          0.0772          0.0778
    7   -2    2   -1    0.1216   -0.5950    0.1201   -0.5973    0.0027    1          0.1320          0.1302
    8   -2    1   -1    0.1438   -0.2187    0.1454   -0.2240    0.0056    1          0.1035          0.1017
    9    1    1    0   -0.1948    0.0490   -0.1952    0.0486    0.0006    1          0.0783          0.0726
   10   -1    0    0    0.2244   -0.1264    0.2251   -0.1274    0.0013    1          0.0462          0.0467
   11   -2    1    0    0.5346   -0.6121    0.5303   -0.6130    0.0043    1          0.1239          0.1248
   12    1    2   -1   -0.1822   -0.0375   -0.1829   -0.0381    0.0009    1          0.1002          0.0984
   13   -2   -1    1    0.1970   -0.0087    0.1990   -0.0092    0.0020    1          0.1006          0.0927
   14   -3    0    1    0.5290   -0.1497    0.5293   -0.1451    0.0046    1          0.1490          0.1473
   15    0    2   -1   -0.3375   -0.2367   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16   -1   -1    1    0.1258    0.0353    0.1275    0.0362    0.0019    1          0.0622          0.0679
   17   -2    0    1    0.7304   -0.0818    0.7293   -0.0807    0.0015    1          0.1149          0.1198
   18   -3    1    1    1.0613   -0.5147    1.0696   -0.4972    0.0194    1          0.2526          0.2483
   19   -1   -2    2    0.0436    0.0287    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20   -2   -1    2    0.4459    0.1655    0.4423    0.1634    0.0041    1          0.1183          0.1178
   21    0    1   -1   -0.0336   -0.0582   -0.0341   -0.0579    0.0006    1          0.0433          0.0568
   22   -1   -1    2    0.2986    0.3367    0.3053    0.3413    0.0081    1          0.0897          0.0899
   23    0   -1    2    0.0331    0.2732    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.57                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0913    1.0899    1.0926  109.5458  109.5919  109.3009      0.4543
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0918    1.0918    1.0918  109.5229  109.5229  109.5229      0.4482         1.0000    1.0000    2.4359    2.4359    2.4359
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0045    0.0045    0.0058    0.0208    0.0208    0.3621      0.0284         0.0094    0.0094    0.1546    0.1546    0.1548
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0445   -0.6053   -0.9438)
 a2 = (    0.6141    0.3610   -0.8685)
 a3 = (    0.9457   -0.5354   -0.2811)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0465   -0.6053   -0.9454) (    0.0070    0.0043    0.0027)
 a2 = (    0.6131    0.3595   -0.8702) (    0.0047    0.0065    0.0033)
 a3 = (    0.9474   -0.5344   -0.2814) (    0.0078    0.0062    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -115.8195   69.1920   58.1106    0.3280    0.3024    0.3677
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002   -0.0001   -0.0012      0.0022    0.0020    0.0106

# Number of computed bands
             83             89
# Figure of merit at the beginning and the end of the refinement
        28.7743        28.6361
# Chi-squares at the beginning and the end of the refinement
    0.0387    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0673    0.0702
    2   -2    2   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1012    0.0995
    3    1   -2    2   -0.0261    0.0886   -0.0262    0.0895    0.0009    1    0.0989    0.0967
    4   -2    1    0   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1048    0.1078
    5   -1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0653    0.0654
    6    0   -1    2   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0778    0.0778
    7   -2    1   -1    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.1342    0.1302
    8   -1    1   -2    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1049    0.1017
    9   -1    0    2   -0.1943    0.0490   -0.1952    0.0486    0.0010    1    0.0789    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    0   -1    0.5316   -0.6124    0.5303   -0.6130    0.0014    1    0.1260    0.1248
   12   -2    1    2   -0.1813   -0.0376   -0.1829   -0.0381    0.0016    1    0.1014    0.0984
   13    1   -1   -2    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1019    0.0927
   14    0   -1   -2    0.5286   -0.1497    0.5293   -0.1451    0.0047    1    0.1513    0.1473
   15   -2    1    1   -0.3354   -0.2363   -0.3362   -0.2357    0.0010    1    0.0887    0.0881
   16    1   -1   -1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0631    0.0679
   17    0   -1   -1    0.7279   -0.0814    0.7293   -0.0807    0.0016    1    0.1168    0.1198
   18   -1   -1   -1    1.0556   -0.5129    1.0696   -0.4972    0.0211    1    0.2565    0.2483
   19    2   -2   -1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0984    0.0994
   20    1   -2   -1    0.4432    0.1648    0.4423    0.1634    0.0016    1    0.1202    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0441    0.0568
   22    1   -2    0    0.2968    0.3328    0.3053    0.3413    0.0120    1    0.0912    0.0899
   23    1   -2    1    0.0345    0.2704    0.0347    0.2716    0.0012    1    0.0817    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7333   -0.0576   -0.7310   -0.0567    0.0024    1          0.0664          0.0702
    2   -2    2   -1   -0.0130   -0.1744   -0.0130   -0.1762    0.0017    1          0.0995          0.0995
    3    1   -2    2   -0.0265    0.0892   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -2    1    0   -0.1941   -0.5864   -0.1957   -0.5833    0.0035    1          0.1033          0.1078
    5   -1    1   -1    0.0570   -0.2237    0.0560   -0.2234    0.0011    1          0.0643          0.0654
    6    0   -1    2   -0.1069    0.1194   -0.1085    0.1216    0.0026    1          0.0767          0.0778
    7   -2    1   -1    0.1210   -0.5948    0.1201   -0.5973    0.0026    1          0.1323          0.1302
    8   -1    1   -2    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1034          0.1017
    9   -1    0    2   -0.1948    0.0490   -0.1952    0.0486    0.0005    1          0.0778          0.0726
   10    0    0   -1    0.2257   -0.1272    0.2251   -0.1274    0.0007    1          0.0461          0.0467
   11   -1    0   -1    0.5340   -0.6121    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12   -2    1    2   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1          0.0999          0.0984
   13    1   -1   -2    0.1981   -0.0083    0.1990   -0.0092    0.0012    1          0.1005          0.0927
   14    0   -1   -2    0.5298   -0.1498    0.5293   -0.1451    0.0047    1          0.1493          0.1473
   15   -2    1    1   -0.3365   -0.2376   -0.3362   -0.2357    0.0019    1          0.0874          0.0881
   16    1   -1   -1    0.1263    0.0359    0.1275    0.0362    0.0012    1          0.0621          0.0679
   17    0   -1   -1    0.7298   -0.0817    0.7293   -0.0807    0.0011    1          0.1153          0.1198
   18   -1   -1   -1    1.0573   -0.5132    1.0696   -0.4972    0.0202    1          0.2532          0.2483
   19    2   -2   -1    0.0436    0.0292    0.0442    0.0295    0.0007    1          0.0968          0.0994
   20    1   -2   -1    0.4454    0.1654    0.4423    0.1634    0.0036    1          0.1185          0.1178
   21   -1    1    0   -0.0339   -0.0580   -0.0341   -0.0579    0.0002    1          0.0433          0.0568
   22    1   -2    0    0.2987    0.3351    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1   -2    1    0.0342    0.2724    0.0347    0.2716    0.0009    1          0.0804          0.0816

###            No.58                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0920    1.0892    1.0935  109.5176  109.6263  109.3612      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0918    1.0918    1.0918  109.5236  109.5236  109.5236      0.4482         1.0000    1.0000    2.4359    2.4359    2.4359
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0045    0.0045    0.0058    0.0208    0.0208    0.3621      0.0284         0.0094    0.0094    0.1546    0.1546    0.1548
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6133   -0.3577    0.8695)
 a2 = (   -0.0439    0.6083    0.9449)
 a3 = (   -0.9454    0.5352    0.2810)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6132   -0.3595    0.8702) (    0.0047    0.0065    0.0033)
 a2 = (   -0.0466    0.6053    0.9454) (    0.0070    0.0043    0.0027)
 a3 = (   -0.9474    0.5344    0.2814) (    0.0078    0.0062    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   55.9470  110.8098 -121.8898    0.3426    0.3024    0.3677
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002   -0.0001   -0.0011      0.0022    0.0020    0.0106

# Number of computed bands
            195             89
# Figure of merit at the beginning and the end of the refinement
         3.3663        28.6289
# Chi-squares at the beginning and the end of the refinement
    0.4708    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2   -2   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2   -2    2    1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3    2   -1   -2   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4   -2    4    0   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5   -1    1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6    1    0   -2   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7   -1    2    1    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8   -1    1    2    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9    0    1   -2   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    0    1    1    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12   -1    2   -2   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13    1   -1    2    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14    1    0    2    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15   -1    2   -1   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16    2   -2    2    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17    2    0    2    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18    1    1    1    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19    3   -3    2    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20    2   -1    1    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21   -2    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22    2   -1    0    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23    2   -1   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7333   -0.0576   -0.7310   -0.0567    0.0025    1          0.0664          0.0702
    2   -2    2    1   -0.0130   -0.1744   -0.0130   -0.1762    0.0018    1          0.0995          0.0995
    3    2   -1   -2   -0.0265    0.0892   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -1    2    0   -0.1941   -0.5864   -0.1957   -0.5833    0.0035    1          0.1033          0.1078
    5   -1    1    1    0.0570   -0.2237    0.0560   -0.2234    0.0011    1          0.0643          0.0654
    6    1    0   -2   -0.1069    0.1194   -0.1085    0.1216    0.0026    1          0.0767          0.0778
    7   -1    2    1    0.1210   -0.5948    0.1201   -0.5973    0.0026    1          0.1323          0.1302
    8   -1    1    2    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1034          0.1017
    9    0    1   -2   -0.1948    0.0490   -0.1952    0.0486    0.0005    1          0.0778          0.0726
   10    0    0    1    0.2257   -0.1272    0.2251   -0.1274    0.0007    1          0.0461          0.0467
   11    0    1    1    0.5340   -0.6120    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12   -1    2   -2   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1          0.0999          0.0984
   13    1   -1    2    0.1981   -0.0083    0.1990   -0.0092    0.0012    1          0.1005          0.0927
   14    1    0    2    0.5298   -0.1498    0.5293   -0.1451    0.0047    1          0.1493          0.1473
   15   -1    2   -1   -0.3365   -0.2376   -0.3362   -0.2357    0.0019    1          0.0874          0.0881
   16    1   -1    1    0.1263    0.0359    0.1275    0.0362    0.0012    1          0.0621          0.0679
   17    1    0    1    0.7298   -0.0817    0.7293   -0.0807    0.0011    1          0.1153          0.1198
   18    1    1    1    1.0573   -0.5132    1.0696   -0.4972    0.0202    1          0.2532          0.2483
   19    2   -2    1    0.0436    0.0292    0.0442    0.0295    0.0007    1          0.0968          0.0994
   20    2   -1    1    0.4454    0.1653    0.4423    0.1634    0.0036    1          0.1185          0.1178
   21   -1    1    0   -0.0339   -0.0580   -0.0341   -0.0579    0.0002    1          0.0433          0.0568
   22    2   -1    0    0.2987    0.3351    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    2   -1   -1    0.0342    0.2724    0.0347    0.2716    0.0009    1          0.0804          0.0816

###            No.63                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0916    1.0922    1.0900  109.5645  109.4003  109.4758      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0887    1.0887    1.0887  109.2925  109.2925  109.2925      0.4437         1.0000    1.0000    2.4540    2.4540    2.4540
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0201    0.0201    0.5548      0.0283         0.0144    0.0144    0.1575    0.1575    0.1580
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9450    0.5350    0.2809)
 a2 = (   -0.3353    0.8942   -0.5893)
 a3 = (   -0.9037   -0.0700   -0.6646)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9428    0.5325    0.2815) (    0.0033    0.0054    0.0058)
 a2 = (   -0.3265    0.8933   -0.5892) (    0.0144    0.0053    0.0044)
 a3 = (   -0.8962   -0.0751   -0.6655) (    0.0135    0.0080    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  161.4097  127.8729  -41.1238    0.4504    0.4282    0.5069
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003   -0.0000    0.0004      0.0023    0.0021    0.0108

# Number of computed bands
            175             73
# Figure of merit at the beginning and the end of the refinement
         3.4923        28.5733
# Chi-squares at the beginning and the end of the refinement
    0.4824    0.0417
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2    1    2   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3   -1   -2    1   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4    2    2   -4   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5    1    1   -1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6   -1   -1    0   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7    2    1   -2    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8    2    1   -1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9   -1    0   -1   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10    1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    2    0   -1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12   -1    1   -2   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13    2   -1    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14    3   -1    0    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15    0    1   -2   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16    2   -2    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17    4   -2    0    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18    3   -1   -1    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19    2   -3    3    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20    2   -2    1    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21    0    2   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22    1   -2    1    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23    0   -2    1    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7368   -0.0617   -0.7310   -0.0567    0.0077    1          0.0660          0.0702
    2    1    2   -2   -0.0136   -0.1747   -0.0130   -0.1762    0.0016    1          0.0989          0.0995
    3   -1   -2    1   -0.0257    0.0890   -0.0262    0.0895    0.0007    1          0.0964          0.0967
    4    1    1   -2   -0.1938   -0.5847   -0.1957   -0.5833    0.0024    1          0.1027          0.1078
    5    1    1   -1    0.0561   -0.2245    0.0560   -0.2234    0.0011    1          0.0638          0.0654
    6   -1   -1    0   -0.1068    0.1203   -0.1085    0.1216    0.0021    1          0.0757          0.0778
    7    2    1   -2    0.1187   -0.5951    0.1201   -0.5973    0.0026    1          0.1314          0.1302
    8    2    1   -1    0.1437   -0.2215    0.1454   -0.2240    0.0030    1          0.1023          0.1017
    9   -1    0   -1   -0.1963    0.0489   -0.1952    0.0486    0.0011    1          0.0768          0.0726
   10    1    0    0    0.2266   -0.1278    0.2251   -0.1274    0.0016    1          0.0455          0.0467
   11    2    0   -1    0.5336   -0.6144    0.5303   -0.6130    0.0035    1          0.1235          0.1248
   12   -1    1   -2   -0.1825   -0.0388   -0.1829   -0.0381    0.0008    1          0.0989          0.0984
   13    2   -1    1    0.1982   -0.0078    0.1990   -0.0092    0.0016    1          0.0994          0.0927
   14    3   -1    0    0.5311   -0.1494    0.5293   -0.1451    0.0046    1          0.1480          0.1473
   15    0    1   -2   -0.3355   -0.2390   -0.3362   -0.2357    0.0034    1          0.0869          0.0881
   16    1   -1    1    0.1255    0.0361    0.1275    0.0362    0.0020    1          0.0616          0.0679
   17    2   -1    0    0.7302   -0.0803    0.7293   -0.0807    0.0009    1          0.1144          0.1198
   18    3   -1   -1    1.0581   -0.5133    1.0696   -0.4972    0.0198    1          0.2516          0.2483
   19    1   -2    2    0.0428    0.0287    0.0442    0.0295    0.0016    1          0.0962          0.0994
   20    2   -2    1    0.4434    0.1659    0.4423    0.1634    0.0027    1          0.1175          0.1178
   21    0    1   -1   -0.0341   -0.0585   -0.0341   -0.0579    0.0006    1          0.0431          0.0568
   22    1   -2    1    0.2971    0.3326    0.3053    0.3413    0.0120    1          0.0892          0.0899
   23    0   -2    1    0.0357    0.2708    0.0347    0.2716    0.0013    1          0.0798          0.0816

###            No.64                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0861    1.0830    1.1119  110.4885  110.4428  107.9853      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0898    1.0898    1.0898  109.3689  109.3689  109.3689      0.4479         1.0000    1.0000    2.4331    2.4331    2.4331
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0065    0.0065    0.0083    0.0225    0.0225    0.5206      0.0290         0.0135    0.0135    0.1583    0.1583    0.1587
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9069    0.0703    0.6670)
 a2 = (    0.5552    0.9827    0.0812)
 a3 = (   -0.0268    0.5989    0.9445)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9006    0.0661    0.6631) (    0.0040    0.0122    0.0049)
 a2 = (    0.5657    0.9641    0.0748) (    0.0057    0.0035    0.0060)
 a3 = (   -0.0479    0.6008    0.9444) (    0.0056    0.0114    0.0073)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  113.8276   40.3165 -115.8795    0.5585    0.4411    0.4083
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0000    0.0004   -0.0002      0.0021    0.0023    0.0120

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         8.6014        28.5032
# Chi-squares at the beginning and the end of the refinement
    0.2703    0.0261
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -1    2    1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    2   -2   -1   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    0    1    1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -1    1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    2   -1   -1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -1    1    2    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -2    1    2    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    2    0   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -1    0    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    2    1   -1   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -2   -1    2    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -2   -1    3    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    1    1    0   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16   -1   -1    1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1   -1    2    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -1   -1    3    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19   -1   -2    1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20   -1   -2    2    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    0    1    0   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    0   -2    1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    1   -2    0    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    0   -0.7325   -0.0542   -0.7310   -0.0567    0.0029    1          0.0664          0.0702
    2   -1    2    1   -0.0129   -0.1744   -0.0130   -0.1762    0.0018    1          0.0995          0.0995
    3    2   -2   -1   -0.0266    0.0885   -0.0262    0.0895    0.0010    1          0.0976          0.0967
    4    0    1    1   -0.1943   -0.5875   -0.1957   -0.5833    0.0044    1          0.1032          0.1078
    5   -1    1    1    0.0570   -0.2235    0.0560   -0.2234    0.0010    1          0.0643          0.0654
    6    2   -1   -1   -0.1065    0.1185   -0.1085    0.1216    0.0036    1          0.0769          0.0778
    7   -1    1    2    0.1219   -0.5949    0.1201   -0.5973    0.0030    1          0.1322          0.1302
    8   -2    1    2    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    2    0   -1   -0.1941    0.0488   -0.1952    0.0486    0.0012    1          0.0779          0.0726
   10   -1    0    1    0.2251   -0.1273    0.2251   -0.1274    0.0002    1          0.0461          0.0467
   11   -1    0    2    0.5352   -0.6104    0.5303   -0.6130    0.0056    1          0.1243          0.1248
   12    2    1   -1   -0.1815   -0.0376   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13   -2   -1    2    0.1978   -0.0088    0.1990   -0.0092    0.0012    1          0.1006          0.0927
   14   -2   -1    3    0.5288   -0.1491    0.5293   -0.1451    0.0040    1          0.1493          0.1473
   15    1    1    0   -0.3370   -0.2371   -0.3362   -0.2357    0.0016    1          0.0873          0.0881
   16   -1   -1    1    0.1263    0.0354    0.1275    0.0362    0.0014    1          0.0621          0.0679
   17   -1   -1    2    0.7282   -0.0803    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -1   -1    3    1.0583   -0.5080    1.0696   -0.4972    0.0157    1          0.2530          0.2483
   19   -1   -2    1    0.0437    0.0289    0.0442    0.0295    0.0008    1          0.0968          0.0994
   20   -1   -2    2    0.4442    0.1651    0.4423    0.1634    0.0025    1          0.1185          0.1178
   21    0    1    0   -0.0339   -0.0581   -0.0341   -0.0579    0.0003    1          0.0433          0.0568
   22    0   -2    1    0.2973    0.3343    0.3053    0.3413    0.0106    1          0.0899          0.0899
   23    1   -2    0    0.0337    0.2713    0.0347    0.2716    0.0011    1          0.0805          0.0816

###            No.65                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1078    1.0749    1.0971  110.5048  110.1765  108.1638      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0911    1.0911    1.0911  109.4688  109.4688  109.4688      0.4496         1.0000    1.0000    2.4266    2.4266    2.4266
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0089    0.0293    0.0293    0.5600      0.0296         0.0145    0.0145    0.1605    0.1605    0.1610
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5458   -0.9574   -0.0760)
 a2 = (   -0.9173   -0.0711   -0.6746)
 a3 = (    0.0271   -0.6058   -0.9553)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5678   -0.9653   -0.0746) (    0.0058    0.0035    0.0059)
 a2 = (   -0.9024   -0.0703   -0.6637) (    0.0042    0.0127    0.0050)
 a3 = (    0.0438   -0.6053   -0.9442) (    0.0058    0.0123    0.0075)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -174.1155  139.6187   64.0230    0.4427    0.4665    0.4067
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001   -0.0025      0.0021    0.0023    0.0121

# Number of computed bands
            400             90
# Figure of merit at the beginning and the end of the refinement
         7.5123        28.3788
# Chi-squares at the beginning and the end of the refinement
    0.2603    0.0250
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2   -2    1   -1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    2   -2    1   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4   -1    0   -1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5   -1    1   -1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    1   -2    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7   -1    1   -2    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8   -1    2   -2    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    0   -2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    0    1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -1   -2    1   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    1    2   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    1    2   -3    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15   -1   -1    0   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    1    1   -1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    1    1   -2    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    1    1   -3    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    2    1   -1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    2    1   -2    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21   -1    0    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    2    0   -1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23    2   -1    0    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7326   -0.0573   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2   -2    1   -1   -0.0130   -0.1738   -0.0130   -0.1762    0.0024    1          0.0997          0.0995
    3    2   -2    1   -0.0264    0.0899   -0.0262    0.0895    0.0005    1          0.0977          0.0967
    4   -1    0   -1   -0.1949   -0.5853   -0.1957   -0.5833    0.0021    1          0.1034          0.1078
    5   -1    1   -1    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0644          0.0654
    6    1   -2    1   -0.1072    0.1200   -0.1085    0.1216    0.0020    1          0.0769          0.0778
    7   -1    1   -2    0.1196   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8   -1    2   -2    0.1435   -0.2201    0.1454   -0.2240    0.0044    1          0.1034          0.1017
    9    0   -2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1   -1    0.2256   -0.1275    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    0    1   -2    0.5334   -0.6141    0.5303   -0.6130    0.0033    1          0.1244          0.1248
   12   -1   -2    1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1          0.1001          0.0984
   13    1    2   -2    0.1982   -0.0086    0.1990   -0.0092    0.0010    1          0.1006          0.0927
   14    1    2   -3    0.5305   -0.1504    0.5293   -0.1451    0.0054    1          0.1494          0.1473
   15   -1   -1    0   -0.3361   -0.2372   -0.3362   -0.2357    0.0014    1          0.0876          0.0881
   16    1    1   -1    0.1265    0.0357    0.1275    0.0362    0.0011    1          0.0622          0.0679
   17    1    1   -2    0.7313   -0.0822    0.7293   -0.0807    0.0025    1          0.1154          0.1198
   18    1    1   -3    1.0599   -0.5163    1.0696   -0.4972    0.0214    1          0.2537          0.2483
   19    2    1   -1    0.0440    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    2    1   -2    0.4460    0.1656    0.4423    0.1634    0.0043    1          0.1186          0.1178
   21   -1    0    0   -0.0335   -0.0577   -0.0341   -0.0579    0.0007    1          0.0434          0.0568
   22    2    0   -1    0.2990    0.3355    0.3053    0.3413    0.0086    1          0.0900          0.0899
   23    2   -1    0    0.0346    0.2729    0.0347    0.2716    0.0013    1          0.0806          0.0816

###            No.66                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0864    1.0916    1.0919  111.0060  108.6156  108.4956      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0898    1.0898    1.0898  109.3753  109.3753  109.3753      0.4489         1.0000    1.0000    2.4278    2.4278    2.4278
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0064    0.0064    0.0082    0.0226    0.0226    0.5152      0.0285         0.0134    0.0134    0.1550    0.1550    0.1554
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5643   -0.9552   -0.0850)
 a2 = (   -0.8913   -0.0516   -0.6832)
 a3 = (    0.0450   -0.5817   -0.9615)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5658   -0.9643   -0.0739) (    0.0056    0.0034    0.0058)
 a2 = (   -0.9008   -0.0670   -0.6630) (    0.0040    0.0121    0.0048)
 a3 = (    0.0476   -0.6019   -0.9439) (    0.0056    0.0112    0.0072)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -174.1483  139.6618   64.0642    0.4389    0.4334    0.3957
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0003   -0.0023      0.0021    0.0023    0.0115

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         6.3733        28.3658
# Chi-squares at the beginning and the end of the refinement
    0.3819    0.0308
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2   -2    1   -1   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    2   -2    1   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1    0   -1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5   -1    1   -1    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    1   -2    1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7   -1    1   -2    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8   -1    2   -2    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    0   -2    1   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    0    1   -2    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12   -1   -2    1   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    1    2   -2    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    1    2   -3    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15   -1   -1    0   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    1    1   -1    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1    1   -2    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    1    1   -3    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    2    1   -1    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    2    1   -2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21   -1    0    0   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    2    0   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    2   -1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7336   -0.0549   -0.7310   -0.0567    0.0032    1          0.0664          0.0702
    2   -2    1   -1   -0.0128   -0.1738   -0.0130   -0.1762    0.0024    1          0.0995          0.0995
    3    2   -2    1   -0.0268    0.0896   -0.0262    0.0895    0.0007    1          0.0976          0.0967
    4   -1    0   -1   -0.1942   -0.5874   -0.1957   -0.5833    0.0043    1          0.1031          0.1078
    5   -1    1   -1    0.0569   -0.2230    0.0560   -0.2234    0.0010    1          0.0643          0.0654
    6    1   -2    1   -0.1071    0.1193   -0.1085    0.1216    0.0026    1          0.0769          0.0778
    7   -1    1   -2    0.1218   -0.5949    0.1201   -0.5973    0.0029    1          0.1321          0.1302
    8   -1    2   -2    0.1436   -0.2196    0.1454   -0.2240    0.0047    1          0.1034          0.1017
    9    0   -2    1   -0.1946    0.0490   -0.1952    0.0486    0.0007    1          0.0779          0.0726
   10    0    1   -1    0.2253   -0.1273    0.2251   -0.1274    0.0002    1          0.0461          0.0467
   11    0    1   -2    0.5353   -0.6113    0.5303   -0.6130    0.0053    1          0.1242          0.1248
   12   -1   -2    1   -0.1816   -0.0376   -0.1829   -0.0381    0.0014    1          0.0999          0.0984
   13    1    2   -2    0.1983   -0.0088    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    1    2   -3    0.5297   -0.1496    0.5293   -0.1451    0.0045    1          0.1493          0.1473
   15   -1   -1    0   -0.3369   -0.2373   -0.3362   -0.2357    0.0017    1          0.0872          0.0881
   16    1    1   -1    0.1269    0.0357    0.1275    0.0362    0.0008    1          0.0621          0.0679
   17    1    1   -2    0.7298   -0.0809    0.7293   -0.0807    0.0004    1          0.1153          0.1198
   18    1    1   -3    1.0594   -0.5101    1.0696   -0.4972    0.0164    1          0.2529          0.2483
   19    2    1   -1    0.0443    0.0293    0.0442    0.0295    0.0002    1          0.0968          0.0994
   20    2    1   -2    0.4457    0.1655    0.4423    0.1634    0.0040    1          0.1186          0.1178
   21   -1    0    0   -0.0335   -0.0575   -0.0341   -0.0579    0.0008    1          0.0433          0.0568
   22    2    0   -1    0.2987    0.3357    0.3053    0.3413    0.0087    1          0.0900          0.0899
   23    2   -1    0    0.0339    0.2728    0.0347    0.2716    0.0014    1          0.0805          0.0816

###            No.69                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0873    1.0884    1.0956  109.6749  109.4968  109.0841      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0880    1.0880    1.0880  109.2324  109.2324  109.2324      0.4476         1.0000    1.0000    2.4309    2.4309    2.4309
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0170    0.0170    0.5544      0.0283         0.0144    0.0144    0.1545    0.1545    0.1550
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9464    0.5334    0.2837)
 a2 = (   -0.3300    0.8975   -0.5887)
 a3 = (   -0.8976   -0.0653   -0.6639)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9415    0.5321    0.2821) (    0.0033    0.0054    0.0058)
 a2 = (   -0.3235    0.8931   -0.5889) (    0.0145    0.0053    0.0044)
 a3 = (   -0.8943   -0.0761   -0.6660) (    0.0135    0.0080    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  161.3361  127.9237  -41.2009    0.4520    0.4285    0.5085
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002   -0.0000    0.0012      0.0023    0.0021    0.0108

# Number of computed bands
             91             71
# Figure of merit at the beginning and the end of the refinement
         7.8810        28.1914
# Chi-squares at the beginning and the end of the refinement
    0.1759    0.0480
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2    1    2   -2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3   -1   -2    1   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4    1    1   -2   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5    1    1   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6   -1   -1    0   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7    2    1   -2    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8    2    1   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9   -1    0   -1   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10    1    0    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11    2    0   -1    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12   -1    1   -2   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13    2   -1    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14    3   -1    0    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15    0    1   -2   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16    1   -1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17    2   -1    0    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18    3   -1   -1    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19    1   -2    2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20    2   -2    1    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22    1   -2    1    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23    0   -2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7383   -0.0628   -0.7310   -0.0567    0.0095    1          0.0667          0.0702
    2    1    2   -2   -0.0140   -0.1752   -0.0130   -0.1762    0.0014    1          0.1000          0.0995
    3   -1   -2    1   -0.0254    0.0885   -0.0262    0.0895    0.0013    1          0.0973          0.0967
    4    1    1   -2   -0.1939   -0.5847   -0.1957   -0.5833    0.0023    1          0.1039          0.1078
    5    1    1   -1    0.0558   -0.2252    0.0560   -0.2234    0.0018    1          0.0644          0.0654
    6   -1   -1    0   -0.1065    0.1203   -0.1085    0.1216    0.0023    1          0.0763          0.0778
    7    2    1   -2    0.1182   -0.5956    0.1201   -0.5973    0.0026    1          0.1329          0.1302
    8    2    1   -1    0.1437   -0.2224    0.1454   -0.2240    0.0023    1          0.1032          0.1017
    9   -1    0   -1   -0.1965    0.0489   -0.1952    0.0486    0.0013    1          0.0774          0.0726
   10    1    0    0    0.2271   -0.1282    0.2251   -0.1274    0.0021    1          0.0459          0.0467
   11    2    0   -1    0.5336   -0.6151    0.5303   -0.6130    0.0039    1          0.1249          0.1248
   12   -1    1   -2   -0.1828   -0.0390   -0.1829   -0.0381    0.0009    1          0.0998          0.0984
   13    2   -1    1    0.1983   -0.0076    0.1990   -0.0092    0.0017    1          0.1003          0.0927
   14    3   -1    0    0.5315   -0.1493    0.5293   -0.1451    0.0047    1          0.1495          0.1473
   15    0    1   -2   -0.3355   -0.2395   -0.3362   -0.2357    0.0038    1          0.0878          0.0881
   16    1   -1    1    0.1252    0.0362    0.1275    0.0362    0.0023    1          0.0622          0.0679
   17    2   -1    0    0.7301   -0.0800    0.7293   -0.0807    0.0010    1          0.1156          0.1198
   18    3   -1   -1    1.0578   -0.5129    1.0696   -0.4972    0.0197    1          0.2544          0.2483
   19    1   -2    2    0.0424    0.0285    0.0442    0.0295    0.0021    1          0.0972          0.0994
   20    2   -2    1    0.4427    0.1658    0.4423    0.1634    0.0024    1          0.1187          0.1178
   21    0    1   -1   -0.0345   -0.0589   -0.0341   -0.0579    0.0011    1          0.0436          0.0568
   22    1   -2    1    0.2965    0.3315    0.3053    0.3413    0.0132    1          0.0901          0.0899
   23    0   -2    1    0.0361    0.2698    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.72                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0934    1.0816    1.0900  108.8509  109.9566  108.9669      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0889    1.0889    1.0889  109.3047  109.3047  109.3047      0.4490         1.0000    1.0000    2.4251    2.4251    2.4251
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0092    0.0217    0.0217    0.5807      0.0285         0.0151    0.0151    0.1546    0.1546    0.1551
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0461   -0.5885   -0.9468)
 a2 = (   -0.5676   -0.9629   -0.0751)
 a3 = (   -0.8963   -0.0550   -0.6667)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0499   -0.5999   -0.9434) (    0.0129    0.0055    0.0031)
 a2 = (   -0.5650   -0.9632   -0.0730) (    0.0055    0.0033    0.0056)
 a3 = (   -0.8997   -0.0642   -0.6624) (    0.0146    0.0072    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -64.4063  110.8174 -121.8166    0.5934    0.4795    0.3646
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0001    0.0005   -0.0026      0.0022    0.0020    0.0109

# Number of computed bands
             77             89
# Figure of merit at the beginning and the end of the refinement
        23.7846        27.3972
# Chi-squares at the beginning and the end of the refinement
    0.1508    0.0329
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2   -1   -2    1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    1    2   -2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1   -1    0   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5   -1   -1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    1    1   -2   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7   -2   -1    1    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8   -2   -1    2    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    1    0   -2   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2    0    1    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12    1   -1   -2   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13   -2    1    2    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14   -3    1    2    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15    0   -1   -1   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16   -1    1    1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17   -2    1    1    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18   -3    1    1    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19   -1    2    1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -2    2    1    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1    2    0    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    0    2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7345   -0.0529   -0.7310   -0.0567    0.0051    1          0.0663          0.0702
    2   -1   -2    1   -0.0128   -0.1734   -0.0130   -0.1762    0.0028    1          0.0994          0.0995
    3    1    2   -2   -0.0272    0.0898   -0.0262    0.0895    0.0011    1          0.0977          0.0967
    4   -1   -1    0   -0.1939   -0.5885   -0.1957   -0.5833    0.0055    1          0.1029          0.1078
    5   -1   -1    1    0.0569   -0.2226    0.0560   -0.2234    0.0012    1          0.0643          0.0654
    6    1    1   -2   -0.1072    0.1192   -0.1085    0.1216    0.0027    1          0.0770          0.0778
    7   -2   -1    1    0.1229   -0.5947    0.1201   -0.5973    0.0038    1          0.1319          0.1302
    8   -2   -1    2    0.1434   -0.2193    0.1454   -0.2240    0.0051    1          0.1034          0.1017
    9    1    0   -2   -0.1943    0.0490   -0.1952    0.0486    0.0010    1          0.0779          0.0726
   10   -1    0    1    0.2249   -0.1274    0.2251   -0.1274    0.0002    1          0.0462          0.0467
   11   -2    0    1    0.5360   -0.6096    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1   -1   -2   -0.1813   -0.0374   -0.1829   -0.0381    0.0017    1          0.0998          0.0984
   13   -2    1    2    0.1984   -0.0092    0.1990   -0.0092    0.0005    1          0.1007          0.0927
   14   -3    1    2    0.5291   -0.1495    0.5293   -0.1451    0.0044    1          0.1494          0.1473
   15    0   -1   -1   -0.3375   -0.2371   -0.3362   -0.2357    0.0019    1          0.0871          0.0881
   16   -1    1    1    0.1274    0.0355    0.1275    0.0362    0.0006    1          0.0622          0.0679
   17   -2    1    1    0.7289   -0.0808    0.7293   -0.0807    0.0005    1          0.1153          0.1198
   18   -3    1    1    1.0585   -0.5069    1.0696   -0.4972    0.0147    1          0.2525          0.2483
   19   -1    2    1    0.0449    0.0296    0.0442    0.0295    0.0007    1          0.0968          0.0994
   20   -2    2    1    0.4461    0.1652    0.4423    0.1634    0.0041    1          0.1187          0.1178
   21    0   -1    0   -0.0333   -0.0570   -0.0341   -0.0579    0.0013    1          0.0432          0.0568
   22   -1    2    0    0.2991    0.3360    0.3053    0.3413    0.0081    1          0.0901          0.0899
   23    0    2   -1    0.0337    0.2734    0.0347    0.2716    0.0020    1          0.0806          0.0816

###            No.73                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0889    1.0823    1.0951  109.2833  109.6862  108.9100      0.5875
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0874    1.0874    1.0874  109.1892  109.1892  109.1892      0.4473         1.0000    1.0000    2.4308    2.4308    2.4308
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0147    0.0147    0.5543      0.0283         0.0144    0.0144    0.1544    0.1544    0.1549
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3239   -0.8931    0.5909)
 a2 = (    0.9464   -0.5334   -0.2837)
 a3 = (    0.8914    0.0696    0.6660)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3217   -0.8927    0.5888) (    0.0145    0.0053    0.0044)
 a2 = (    0.9405   -0.5316   -0.2828) (    0.0033    0.0054    0.0058)
 a3 = (    0.8931    0.0771    0.6659) (    0.0135    0.0080    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  138.0475   52.0636  138.7465    0.4707    0.4289    0.5100
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003   -0.0001    0.0021      0.0023    0.0021    0.0107

# Number of computed bands
             91             72
# Figure of merit at the beginning and the end of the refinement
         4.5071        27.2915
# Chi-squares at the beginning and the end of the refinement
    0.4591    0.0526
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7426   -0.0580   -0.7310   -0.0567    0.0117    1    0.0875    0.0702
    2   -2   -1    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    2    1   -1   -0.0263    0.0894   -0.0262    0.0895    0.0001    1    0.1276    0.0967
    4   -1   -1    2   -0.1935   -0.5912   -0.1957   -0.5833    0.0082    1    0.1361    0.1078
    5   -1   -1    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1    1    0   -0.1070    0.1201   -0.1085    0.1216    0.0021    1    0.1003    0.0778
    7   -1   -2    2    0.1236   -0.5978    0.1201   -0.5973    0.0034    1    0.1745    0.1302
    8   -1   -2    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    0    1    1   -0.1956    0.0494   -0.1952    0.0486    0.0008    1    0.1017    0.0726
   10    0   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    0   -2    1    0.5384   -0.6110    0.5303   -0.6130    0.0083    1    0.1644    0.1248
   12   -1    1    2   -0.1824   -0.0378   -0.1829   -0.0381    0.0006    1    0.1307    0.0984
   13    1   -2   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    1   -3    0    0.5313   -0.1493    0.5293   -0.1451    0.0047    1    0.1973    0.1473
   15   -1    0    2   -0.3385   -0.2395   -0.3362   -0.2357    0.0045    1    0.1146    0.0881
   16    1   -1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1   -2    0    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1524    0.1198
   18    1   -3    1    1.0565   -0.5053    1.0696   -0.4972    0.0154    1    0.3347    0.2483
   19    2   -1   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    2   -2   -1    0.4461    0.1648    0.4423    0.1634    0.0040    1    0.1565    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2   -1   -1    0.3006    0.3340    0.3053    0.3413    0.0087    1    0.1185    0.0899
   23    2    0   -1    0.0359    0.2732    0.0347    0.2716    0.0019    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7383   -0.0637   -0.7310   -0.0567    0.0101    1          0.0668          0.0702
    2   -2   -1    2   -0.0141   -0.1752   -0.0130   -0.1762    0.0015    1          0.1001          0.0995
    3    2    1   -1   -0.0252    0.0882   -0.0262    0.0895    0.0016    1          0.0973          0.0967
    4   -1   -1    2   -0.1937   -0.5840   -0.1957   -0.5833    0.0022    1          0.1040          0.1078
    5   -1   -1    1    0.0557   -0.2255    0.0560   -0.2234    0.0021    1          0.0645          0.0654
    6    1    1    0   -0.1061    0.1202   -0.1085    0.1216    0.0027    1          0.0762          0.0778
    7   -1   -2    2    0.1178   -0.5956    0.1201   -0.5973    0.0029    1          0.1331          0.1302
    8   -1   -2    1    0.1439   -0.2229    0.1454   -0.2240    0.0019    1          0.1033          0.1017
    9    0    1    1   -0.1962    0.0488   -0.1952    0.0486    0.0010    1          0.0773          0.0726
   10    0   -1    0    0.2277   -0.1284    0.2251   -0.1274    0.0028    1          0.0460          0.0467
   11    0   -2    1    0.5336   -0.6156    0.5303   -0.6130    0.0042    1          0.1252          0.1248
   12   -1    1    2   -0.1823   -0.0390   -0.1829   -0.0381    0.0011    1          0.0998          0.0984
   13    1   -2   -1    0.1988   -0.0074    0.1990   -0.0092    0.0017    1          0.1003          0.0927
   14    1   -3    0    0.5321   -0.1493    0.5293   -0.1451    0.0050    1          0.1497          0.1473
   15   -1    0    2   -0.3348   -0.2394   -0.3362   -0.2357    0.0040    1          0.0878          0.0881
   16    1   -1   -1    0.1255    0.0364    0.1275    0.0362    0.0020    1          0.0622          0.0679
   17    1   -2    0    0.7304   -0.0797    0.7293   -0.0807    0.0014    1          0.1158          0.1198
   18    1   -3    1    1.0578   -0.5128    1.0696   -0.4972    0.0196    1          0.2550          0.2483
   19    2   -1   -2    0.0425    0.0287    0.0442    0.0295    0.0018    1          0.0973          0.0994
   20    2   -2   -1    0.4426    0.1661    0.4423    0.1634    0.0027    1          0.1189          0.1178
   21   -1    0    1   -0.0345   -0.0588   -0.0341   -0.0579    0.0009    1          0.0437          0.0568
   22    2   -1   -1    0.2963    0.3311    0.3053    0.3413    0.0136    1          0.0902          0.0899
   23    2    0   -1    0.0364    0.2694    0.0347    0.2716    0.0028    1          0.0806          0.0816

###            No.74                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0990    1.0949    1.0874  110.2271  109.2691  109.4952      0.4717
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0889    1.0889    1.0889  109.3018  109.3018  109.3018      0.4493         1.0000    1.0000    2.4237    2.4237    2.4237
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0092    0.0215    0.0215    0.5807      0.0285         0.0151    0.0151    0.1544    0.1544    0.1549
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5661    0.9605    0.0721)
 a2 = (   -0.0287    0.6091    0.9492)
 a3 = (    0.9126    0.0762    0.6694)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5649    0.9631    0.0730) (    0.0055    0.0033    0.0056)
 a2 = (   -0.0501    0.5998    0.9433) (    0.0129    0.0055    0.0031)
 a3 = (    0.8996    0.0640    0.6624) (    0.0146    0.0072    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    4.0015   69.1767   58.1815    0.3009    0.4796    0.3646
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0001    0.0005   -0.0025      0.0022    0.0020    0.0109

# Number of computed bands
             65             89
# Figure of merit at the beginning and the end of the refinement
        15.9837        27.2831
# Chi-squares at the beginning and the end of the refinement
    0.2124    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7284   -0.0608   -0.7310   -0.0567    0.0049    1    0.0705    0.0702
    2    2    1   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1043    0.0995
    3   -2   -1    2   -0.0287    0.0945   -0.0262    0.0895    0.0056    1    0.1023    0.0967
    4    1    1    0   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1090    0.1078
    5    1    1   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0674    0.0654
    6   -1   -1    2   -0.1115    0.1227   -0.1085    0.1216    0.0032    1    0.0809    0.0778
    7    1    2   -1    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1393    0.1302
    8    1    2   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1082    0.1017
    9    0   -1    2   -0.1981    0.0488   -0.1952    0.0486    0.0029    1    0.0823    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0483    0.0467
   11    0    2   -1    0.5310   -0.6252    0.5303   -0.6130    0.0122    1    0.1316    0.1248
   12    1   -1    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1056    0.0984
   13   -1    2   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1054    0.0927
   14   -1    3   -2    0.5354   -0.1544    0.5293   -0.1451    0.0111    1    0.1571    0.1473
   15    1    0    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16   -1    1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0652    0.0679
   17   -1    2   -1    0.7427   -0.0878    0.7293   -0.0807    0.0151    1    0.1222    0.1198
   18   -1    3   -1    1.0721   -0.5417    1.0696   -0.4972    0.0446    1    0.2728    0.2483
   19   -2    1   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1017    0.0994
   20   -2    2   -1    0.4537    0.1681    0.4423    0.1634    0.0123    1    0.1247    0.1178
   21    1    0    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0455    0.0568
   22   -2    1    0    0.3045    0.3441    0.3053    0.3413    0.0029    1    0.0947    0.0899
   23   -2    0    1    0.0334    0.2807    0.0347    0.2716    0.0091    1    0.0845    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7346   -0.0528   -0.7310   -0.0567    0.0053    1          0.0663          0.0702
    2    2    1   -1   -0.0128   -0.1734   -0.0130   -0.1762    0.0028    1          0.0994          0.0995
    3   -2   -1    2   -0.0272    0.0899   -0.0262    0.0895    0.0011    1          0.0978          0.0967
    4    1    1    0   -0.1939   -0.5886   -0.1957   -0.5833    0.0056    1          0.1030          0.1078
    5    1    1   -1    0.0569   -0.2226    0.0560   -0.2234    0.0012    1          0.0643          0.0654
    6   -1   -1    2   -0.1073    0.1192   -0.1085    0.1216    0.0027    1          0.0770          0.0778
    7    1    2   -1    0.1230   -0.5947    0.1201   -0.5973    0.0039    1          0.1320          0.1302
    8    1    2   -2    0.1433   -0.2192    0.1454   -0.2240    0.0052    1          0.1035          0.1017
    9    0   -1    2   -0.1943    0.0491   -0.1952    0.0486    0.0010    1          0.0780          0.0726
   10    0    1   -1    0.2248   -0.1274    0.2251   -0.1274    0.0003    1          0.0462          0.0467
   11    0    2   -1    0.5359   -0.6094    0.5303   -0.6130    0.0067    1          0.1242          0.1248
   12    1   -1    2   -0.1814   -0.0374   -0.1829   -0.0381    0.0017    1          0.0998          0.0984
   13   -1    2   -2    0.1984   -0.0092    0.1990   -0.0092    0.0006    1          0.1007          0.0927
   14   -1    3   -2    0.5289   -0.1495    0.5293   -0.1451    0.0044    1          0.1495          0.1473
   15    1    0    1   -0.3376   -0.2371   -0.3362   -0.2357    0.0019    1          0.0871          0.0881
   16   -1    1   -1    0.1273    0.0355    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1    2   -1    0.7287   -0.0808    0.7293   -0.0807    0.0007    1          0.1154          0.1198
   18   -1    3   -1    1.0583   -0.5066    1.0696   -0.4972    0.0147    1          0.2526          0.2483
   19   -2    1   -1    0.0448    0.0296    0.0442    0.0295    0.0006    1          0.0968          0.0994
   20   -2    2   -1    0.4460    0.1652    0.4423    0.1634    0.0040    1          0.1188          0.1178
   21    1    0    0   -0.0333   -0.0570   -0.0341   -0.0579    0.0013    1          0.0433          0.0568
   22   -2    1    0    0.2991    0.3359    0.3053    0.3413    0.0082    1          0.0901          0.0899
   23   -2    0    1    0.0337    0.2734    0.0347    0.2716    0.0020    1          0.0806          0.0816

###            No.77                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0868    1.0937    1.0876  110.5127  108.6357  108.8551      0.4569
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0874    1.0874    1.0874  109.1855  109.1855  109.1855      0.4477         1.0000    1.0000    2.4287    2.4287    2.4287
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0088    0.0145    0.0145    0.5543      0.0283         0.0144    0.0144    0.1542    0.1542    0.1547
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9387    0.5314    0.2790)
 a2 = (   -0.3299    0.8849   -0.6023)
 a3 = (   -0.8952   -0.0742   -0.6771)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9404    0.5317    0.2825) (    0.0033    0.0054    0.0058)
 a2 = (   -0.3212    0.8927   -0.5889) (    0.0145    0.0053    0.0044)
 a3 = (   -0.8927   -0.0770   -0.6664) (    0.0135    0.0080    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  161.2851  127.9579  -41.2525    0.4532    0.4290    0.5098
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001   -0.0000    0.0020      0.0023    0.0021    0.0107

# Number of computed bands
             71             71
# Figure of merit at the beginning and the end of the refinement
        16.7330        27.1861
# Chi-squares at the beginning and the end of the refinement
    0.2506    0.0543
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7511   -0.0623   -0.7310   -0.0567    0.0209    1    0.0693    0.0702
    2    1    2   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1   -2    1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0988    0.0967
    4    1    1   -2   -0.1978   -0.5929   -0.1957   -0.5833    0.0098    1    0.1063    0.1078
    5    1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -1   -1    0   -0.1134    0.1266   -0.1085    0.1216    0.0071    1    0.0779    0.0778
    7    2    1   -2    0.1195   -0.6012    0.1201   -0.5973    0.0039    1    0.1356    0.1302
    8    2    1   -1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -1    0   -1   -0.2044    0.0509   -0.1952    0.0486    0.0094    1    0.0792    0.0726
   10    1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    2    0   -1    0.5374   -0.6221    0.5303   -0.6130    0.0115    1    0.1281    0.1248
   12   -1    1   -2   -0.1888   -0.0395   -0.1829   -0.0381    0.0062    1    0.1017    0.0984
   13    2   -1    1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    3   -1    0    0.5354   -0.1528    0.5293   -0.1451    0.0097    1    0.1525    0.1473
   15    0    1   -2   -0.3431   -0.2427   -0.3362   -0.2357    0.0098    1    0.0897    0.0881
   16    1   -1    1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    2   -1    0    0.7400   -0.0851    0.7293   -0.0807    0.0116    1    0.1187    0.1198
   18    3   -1   -1    1.0706   -0.5273    1.0696   -0.4972    0.0302    1    0.2642    0.2483
   19    1   -2    2    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    2   -2    1    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1211    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    1   -2    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0920    0.0899
   23    0   -2    1    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0820    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7393   -0.0638   -0.7310   -0.0567    0.0109    1          0.0668          0.0702
    2    1    2   -2   -0.0142   -0.1754   -0.0130   -0.1762    0.0014    1          0.1001          0.0995
    3   -1   -2    1   -0.0252    0.0882   -0.0262    0.0895    0.0016    1          0.0973          0.0967
    4    1    1   -2   -0.1938   -0.5845   -0.1957   -0.5833    0.0022    1          0.1041          0.1078
    5    1    1   -1    0.0556   -0.2256    0.0560   -0.2234    0.0023    1          0.0645          0.0654
    6   -1   -1    0   -0.1064    0.1203   -0.1085    0.1216    0.0024    1          0.0762          0.0778
    7    2    1   -2    0.1178   -0.5957    0.1201   -0.5973    0.0028    1          0.1332          0.1302
    8    2    1   -1    0.1437   -0.2229    0.1454   -0.2240    0.0020    1          0.1033          0.1017
    9   -1    0   -1   -0.1967    0.0489   -0.1952    0.0486    0.0015    1          0.0774          0.0726
   10    1    0    0    0.2273   -0.1284    0.2251   -0.1274    0.0024    1          0.0460          0.0467
   11    2    0   -1    0.5335   -0.6155    0.5303   -0.6130    0.0040    1          0.1252          0.1248
   12   -1    1   -2   -0.1829   -0.0392   -0.1829   -0.0381    0.0011    1          0.0999          0.0984
   13    2   -1    1    0.1983   -0.0075    0.1990   -0.0092    0.0018    1          0.1003          0.0927
   14    3   -1    0    0.5316   -0.1492    0.5293   -0.1451    0.0047    1          0.1497          0.1473
   15    0    1   -2   -0.3354   -0.2398   -0.3362   -0.2357    0.0042    1          0.0879          0.0881
   16    1   -1    1    0.1250    0.0362    0.1275    0.0362    0.0025    1          0.0622          0.0679
   17    2   -1    0    0.7298   -0.0798    0.7293   -0.0807    0.0010    1          0.1158          0.1198
   18    3   -1   -1    1.0572   -0.5125    1.0696   -0.4972    0.0197    1          0.2549          0.2483
   19    1   -2    2    0.0421    0.0284    0.0442    0.0295    0.0024    1          0.0974          0.0994
   20    2   -2    1    0.4421    0.1658    0.4423    0.1634    0.0024    1          0.1189          0.1178
   21    0    1   -1   -0.0347   -0.0591   -0.0341   -0.0579    0.0013    1          0.0437          0.0568
   22    1   -2    1    0.2960    0.3307    0.3053    0.3413    0.0141    1          0.0903          0.0899
   23    0   -2    1    0.0363    0.2692    0.0347    0.2716    0.0029    1          0.0807          0.0816

###            No.90                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0861    1.0830    1.0844  109.3009  109.5780  107.9853      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0868    1.0868    1.0868  109.1412  109.1412  109.1412      0.4510         1.0000    1.0000    2.4098    2.4098    2.4098
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0061    0.0061    0.0078    0.0109    0.0109    0.4927      0.0287         0.0128    0.0128    0.1537    0.1537    0.1541
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9338    0.5286    0.2776)
 a2 = (   -0.5820   -0.3837    0.8633)
 a3 = (   -0.0268    0.5989    0.9445)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9418    0.5315    0.2748) (    0.0031    0.0054    0.0057)
 a2 = (   -0.6018   -0.3701    0.8637) (    0.0053    0.0114    0.0040)
 a3 = (   -0.0314    0.6016    0.9392) (    0.0049    0.0112    0.0068)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   18.2027   52.0459  139.1306    0.3480    0.4185    0.3763
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0016    0.0006   -0.0051      0.0021    0.0023    0.0114

# Number of computed bands
            400             57
# Figure of merit at the beginning and the end of the refinement
         8.6014        26.2762
# Chi-squares at the beginning and the end of the refinement
    0.1304    0.0624
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    1   -2    2   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3   -2    2   -1   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    0   -1    2   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    1   -1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -2    1    0   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    1   -1    2    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    2   -1    1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9   -2    0    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    1    0    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12   -2   -1    2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    2    1   -1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    2    1    0    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1   -1    2   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    1    1   -1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    1    1    0    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    1    1    1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1    2   -2    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    1    2   -1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    0   -1    1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    0    2   -1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -1    2   -1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7276   -0.0567   -0.7310   -0.0567    0.0034    1          0.0666          0.0702
    2    1   -2    2   -0.0123   -0.1725   -0.0130   -0.1762    0.0038    1          0.1001          0.0995
    3   -2    2   -1   -0.0255    0.0910   -0.0262    0.0895    0.0017    1          0.0981          0.0967
    4    0   -1    2   -0.1972   -0.5808   -0.1957   -0.5833    0.0029    1          0.1032          0.1078
    5    1   -1    1    0.0561   -0.2214    0.0560   -0.2234    0.0020    1          0.0643          0.0654
    6   -2    1    0   -0.1079    0.1217   -0.1085    0.1216    0.0006    1          0.0771          0.0778
    7    1   -1    2    0.1153   -0.5947    0.1201   -0.5973    0.0055    1          0.1316          0.1302
    8    2   -1    1    0.1423   -0.2186    0.1454   -0.2240    0.0062    1          0.1029          0.1017
    9   -2    0    1   -0.1975    0.0490   -0.1952    0.0486    0.0023    1          0.0783          0.0726
   10    1    0    0    0.2240   -0.1261    0.2251   -0.1274    0.0017    1          0.0458          0.0467
   11    1    0    1    0.5339   -0.6203    0.5303   -0.6130    0.0082    1          0.1234          0.1248
   12   -2   -1    2   -0.1832   -0.0395   -0.1829   -0.0381    0.0015    1          0.1006          0.0984
   13    2    1   -1    0.1955   -0.0078    0.1990   -0.0092    0.0037    1          0.1001          0.0927
   14    2    1    0    0.5319   -0.1484    0.5293   -0.1451    0.0042    1          0.1478          0.1473
   15   -1   -1    2   -0.3344   -0.2370   -0.3362   -0.2357    0.0022    1          0.0880          0.0881
   16    1    1   -1    0.1237    0.0349    0.1275    0.0362    0.0040    1          0.0622          0.0679
   17    1    1    0    0.7349   -0.0773    0.7293   -0.0807    0.0065    1          0.1143          0.1198
   18    1    1    1    1.0755   -0.5208    1.0696   -0.4972    0.0244    1          0.2536          0.2483
   19    1    2   -2    0.0425    0.0271    0.0442    0.0295    0.0030    1          0.0974          0.0994
   20    1    2   -1    0.4422    0.1683    0.4423    0.1634    0.0049    1          0.1178          0.1178
   21    0   -1    1   -0.0326   -0.0587   -0.0341   -0.0579    0.0018    1          0.0437          0.0568
   22    0    2   -1    0.2940    0.3342    0.3053    0.3413    0.0133    1          0.0899          0.0899
   23   -1    2   -1    0.0349    0.2707    0.0347    0.2716    0.0010    1          0.0810          0.0816

###            No.91                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0901    1.0901    1.0938  109.7138  109.5175  109.2362      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0938    1.0938    1.0938  109.6692  109.6692  109.6692      0.4468         1.0000    1.0000    2.4480    2.4480    2.4480
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0071    0.0071    0.0092    0.0408    0.0408    0.5773      0.0284         0.0150    0.0150    0.1562    0.1562    0.1567
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9462   -0.5333   -0.2836)
 a2 = (    0.0404   -0.6035   -0.9473)
 a3 = (    0.6078    0.3591   -0.8721)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9496   -0.5359   -0.2838) (    0.0033    0.0055    0.0058)
 a2 = (    0.0527   -0.6063   -0.9481) (    0.0125    0.0058    0.0033)
 a3 = (    0.6182    0.3555   -0.8722) (    0.0135    0.0071    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -163.0858  120.0361  159.2165    0.3177    0.4944    0.3918
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0003   -0.0002    0.0003      0.0022    0.0021    0.0108

# Number of computed bands
             79             89
# Figure of merit at the beginning and the end of the refinement
         4.7313        25.3597
# Chi-squares at the beginning and the end of the refinement
    0.4567    0.0380
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2   -1   -2    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    2    1   -2   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4    0   -2    1   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5   -1   -1    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2    0   -1   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7   -1   -2    1    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8   -2   -1    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    2   -1    0   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10   -1    0    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -1   -1    0    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12    2   -2    1   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13   -2    1   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -2    0   -1    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15    1   -2    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16   -1    1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1    0   -1    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18   -1   -1   -1    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19   -1    2   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -1    1   -2    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    0    1   -2    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23    1    1   -2    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7363   -0.0577   -0.7310   -0.0567    0.0054    1          0.0664          0.0702
    2   -1   -2    2   -0.0133   -0.1759   -0.0130   -0.1762    0.0004    1          0.0993          0.0995
    3    2    1   -2   -0.0266    0.0881   -0.0262    0.0895    0.0015    1          0.0971          0.0967
    4    0   -2    1   -0.1931   -0.5896   -0.1957   -0.5833    0.0068    1          0.1034          0.1078
    5   -1   -1    1    0.0575   -0.2251    0.0560   -0.2234    0.0023    1          0.0643          0.0654
    6    2    0   -1   -0.1064    0.1184   -0.1085    0.1216    0.0038    1          0.0765          0.0778
    7   -1   -2    1    0.1234   -0.5955    0.1201   -0.5973    0.0037    1          0.1326          0.1302
    8   -2   -1    1    0.1448   -0.2210    0.1454   -0.2240    0.0030    1          0.1035          0.1017
    9    2   -1    0   -0.1940    0.0490   -0.1952    0.0486    0.0013    1          0.0776          0.0726
   10   -1    0    0    0.2263   -0.1277    0.2251   -0.1274    0.0013    1          0.0462          0.0467
   11   -1   -1    0    0.5343   -0.6090    0.5303   -0.6130    0.0056    1          0.1246          0.1248
   12    2   -2    1   -0.1818   -0.0372   -0.1829   -0.0381    0.0014    1          0.0996          0.0984
   13   -2    1   -1    0.1988   -0.0087    0.1990   -0.0092    0.0005    1          0.1005          0.0927
   14   -2    0   -1    0.5287   -0.1503    0.5293   -0.1451    0.0053    1          0.1498          0.1473
   15    1   -2    1   -0.3380   -0.2383   -0.3362   -0.2357    0.0031    1          0.0871          0.0881
   16   -1    1   -1    0.1269    0.0359    0.1275    0.0362    0.0007    1          0.0620          0.0679
   17   -1    0   -1    0.7273   -0.0835    0.7293   -0.0807    0.0035    1          0.1156          0.1198
   18   -1   -1   -1    1.0503   -0.5099    1.0696   -0.4972    0.0231    1          0.2527          0.2483
   19   -1    2   -2    0.0436    0.0295    0.0442    0.0295    0.0005    1          0.0965          0.0994
   20   -1    1   -2    0.4461    0.1637    0.4423    0.1634    0.0037    1          0.1186          0.1178
   21    0   -1    1   -0.0347   -0.0584   -0.0341   -0.0579    0.0008    1          0.0431          0.0568
   22    0    1   -2    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0897          0.0899
   23    1    1   -2    0.0341    0.2724    0.0347    0.2716    0.0009    1          0.0800          0.0816

###            No.92                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0997    1.0900    1.0816  108.8509  109.8868  109.5150      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0939    1.0939    1.0939  109.6767  109.6767  109.6767      0.4467         1.0000    1.0000    2.4487    2.4487    2.4487
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0071    0.0071    0.0092    0.0412    0.0412    0.5775      0.0283         0.0150    0.0150    0.1562    0.1562    0.1567
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0461    0.5885    0.9468)
 a2 = (   -0.9424    0.5335    0.2801)
 a3 = (   -0.6136   -0.3744    0.8717)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0528    0.6066    0.9482) (    0.0124    0.0058    0.0033)
 a2 = (   -0.9497    0.5358    0.2842) (    0.0033    0.0055    0.0059)
 a3 = (   -0.6180   -0.3553    0.8726) (    0.0135    0.0071    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.5694   59.9532  -20.7612    0.6080    0.4944    0.3919
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0004   -0.0003    0.0005      0.0022    0.0021    0.0108

# Number of computed bands
             77             89
# Figure of merit at the beginning and the end of the refinement
        23.7846        25.3447
# Chi-squares at the beginning and the end of the refinement
    0.2416    0.0380
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2    2    1   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1   -2    2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    2    0   -1   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5    1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    0   -2    1   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7    2    1   -1    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8    1    2   -1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    1   -2    0   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10    0    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1    0    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12    2   -2   -1   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13   -1    2    1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    0    2    1    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15    2   -1   -1   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16   -1    1    1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    0    1    1    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18    1    1    1    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19   -2    1    2    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -1    1    2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1    0    2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23   -1   -1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7358   -0.0578   -0.7310   -0.0567    0.0049    1          0.0663          0.0702
    2    2    1   -2   -0.0133   -0.1756   -0.0130   -0.1762    0.0006    1          0.0992          0.0995
    3   -1   -2    2   -0.0267    0.0881   -0.0262    0.0895    0.0014    1          0.0971          0.0967
    4    2    0   -1   -0.1930   -0.5892   -0.1957   -0.5833    0.0065    1          0.1034          0.1078
    5    1    1   -1    0.0574   -0.2249    0.0560   -0.2234    0.0022    1          0.0643          0.0654
    6    0   -2    1   -0.1063    0.1183   -0.1085    0.1216    0.0039    1          0.0765          0.0778
    7    2    1   -1    0.1234   -0.5952    0.1201   -0.5973    0.0038    1          0.1326          0.1302
    8    1    2   -1    0.1448   -0.2210    0.1454   -0.2240    0.0031    1          0.1035          0.1017
    9    1   -2    0   -0.1937    0.0490   -0.1952    0.0486    0.0015    1          0.0776          0.0726
   10    0    1    0    0.2265   -0.1277    0.2251   -0.1274    0.0014    1          0.0462          0.0467
   11    1    1    0    0.5342   -0.6089    0.5303   -0.6130    0.0056    1          0.1247          0.1248
   12    2   -2   -1   -0.1814   -0.0370   -0.1829   -0.0381    0.0018    1          0.0995          0.0984
   13   -1    2    1    0.1991   -0.0086    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    0    2    1    0.5289   -0.1503    0.5293   -0.1451    0.0052    1          0.1499          0.1473
   15    2   -1   -1   -0.3377   -0.2379   -0.3362   -0.2357    0.0027    1          0.0871          0.0881
   16   -1    1    1    0.1272    0.0361    0.1275    0.0362    0.0003    1          0.0620          0.0679
   17    0    1    1    0.7275   -0.0836    0.7293   -0.0807    0.0034    1          0.1156          0.1198
   18    1    1    1    1.0501   -0.5099    1.0696   -0.4972    0.0233    1          0.2529          0.2483
   19   -2    1    2    0.0439    0.0298    0.0442    0.0295    0.0004    1          0.0965          0.0994
   20   -1    1    2    0.4464    0.1639    0.4423    0.1634    0.0041    1          0.1187          0.1178
   21    1    0   -1   -0.0346   -0.0581   -0.0341   -0.0579    0.0005    1          0.0431          0.0568
   22   -1    0    2    0.3004    0.3350    0.3053    0.3413    0.0080    1          0.0897          0.0899
   23   -1   -1    2    0.0340    0.2726    0.0347    0.2716    0.0012    1          0.0800          0.0816

###            No.99                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0956    1.0933    1.0884  109.4475  109.6749  109.5768      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0941    1.0941    1.0941  109.6921  109.6921  109.6921      0.4467         1.0000    1.0000    2.4493    2.4493    2.4493
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0093    0.0420    0.0420    0.5780      0.0283         0.0150    0.0150    0.1562    0.1562    0.1568
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0489    0.5988    0.9476)
 a2 = (   -0.9464    0.5334    0.2837)
 a3 = (   -0.6164   -0.3641    0.8724)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0535    0.6068    0.9484) (    0.0125    0.0058    0.0033)
 a2 = (   -0.9499    0.5359    0.2844) (    0.0033    0.0055    0.0059)
 a3 = (   -0.6185   -0.3548    0.8729) (    0.0135    0.0071    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.5995   59.9601  -20.7572    0.6079    0.4945    0.3920
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0004   -0.0003    0.0007      0.0022    0.0021    0.0108

# Number of computed bands
             91             92
# Figure of merit at the beginning and the end of the refinement
         7.8810        24.6716
# Chi-squares at the beginning and the end of the refinement
    0.1976    0.0391
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2    2    1   -2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3   -1   -2    2   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4    2    0   -1   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5    1    1   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6    0   -2    1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7    2    1   -1    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8    1    2   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9    1   -2    0   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10    0    1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11    1    1    0    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12    2   -2   -1   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13   -1    2    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14    0    2    1    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15    2   -1   -1   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16   -1    1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17    0    1    1    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18    1    1    1    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19   -2    1    2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20   -1    1    2    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22   -1    0    2    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23   -1   -1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7360   -0.0578   -0.7310   -0.0567    0.0051    1          0.0663          0.0702
    2    2    1   -2   -0.0133   -0.1757   -0.0130   -0.1762    0.0006    1          0.0992          0.0995
    3   -1   -2    2   -0.0268    0.0881   -0.0262    0.0895    0.0015    1          0.0970          0.0967
    4    2    0   -1   -0.1928   -0.5894   -0.1957   -0.5833    0.0067    1          0.1034          0.1078
    5    1    1   -1    0.0575   -0.2250    0.0560   -0.2234    0.0022    1          0.0643          0.0654
    6    0   -2    1   -0.1063    0.1182   -0.1085    0.1216    0.0040    1          0.0765          0.0778
    7    2    1   -1    0.1236   -0.5952    0.1201   -0.5973    0.0041    1          0.1327          0.1302
    8    1    2   -1    0.1448   -0.2210    0.1454   -0.2240    0.0031    1          0.1035          0.1017
    9    1   -2    0   -0.1936    0.0490   -0.1952    0.0486    0.0016    1          0.0776          0.0726
   10    0    1    0    0.2265   -0.1277    0.2251   -0.1274    0.0015    1          0.0462          0.0467
   11    1    1    0    0.5341   -0.6085    0.5303   -0.6130    0.0059    1          0.1247          0.1248
   12    2   -2   -1   -0.1813   -0.0370   -0.1829   -0.0381    0.0019    1          0.0995          0.0984
   13   -1    2    1    0.1992   -0.0086    0.1990   -0.0092    0.0006    1          0.1006          0.0927
   14    0    2    1    0.5288   -0.1504    0.5293   -0.1451    0.0053    1          0.1499          0.1473
   15    2   -1   -1   -0.3377   -0.2380   -0.3362   -0.2357    0.0027    1          0.0871          0.0881
   16   -1    1    1    0.1273    0.0362    0.1275    0.0362    0.0002    1          0.0620          0.0679
   17    0    1    1    0.7273   -0.0837    0.7293   -0.0807    0.0037    1          0.1157          0.1198
   18    1    1    1    1.0493   -0.5096    1.0696   -0.4972    0.0238    1          0.2529          0.2483
   19   -2    1    2    0.0440    0.0299    0.0442    0.0295    0.0004    1          0.0965          0.0994
   20   -1    1    2    0.4465    0.1638    0.4423    0.1634    0.0042    1          0.1187          0.1178
   21    1    0   -1   -0.0347   -0.0580   -0.0341   -0.0579    0.0005    1          0.0431          0.0568
   22   -1    0    2    0.3006    0.3351    0.3053    0.3413    0.0078    1          0.0898          0.0899
   23   -1   -1    2    0.0339    0.2728    0.0347    0.2716    0.0014    1          0.0800          0.0816

###            No.103                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0921    1.0908    1.0918  109.5175  109.6145  109.3847      0.3212
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0944    1.0944    1.0944  109.7089  109.7089  109.7089      0.4467         1.0000    1.0000    2.4501    2.4501    2.4501
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0093    0.0429    0.0429    0.5785      0.0283         0.0150    0.0150    0.1562    0.1562    0.1568
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0431    0.6020    0.9465)
 a2 = (   -0.9468    0.5336    0.2838)
 a3 = (   -0.6108   -0.3612    0.8713)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0541    0.6069    0.9487) (    0.0125    0.0058    0.0033)
 a2 = (   -0.9502    0.5361    0.2847) (    0.0033    0.0055    0.0059)
 a3 = (   -0.6191   -0.3543    0.8732) (    0.0135    0.0072    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.6313   59.9700  -20.7560    0.6078    0.4945    0.3920
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0005   -0.0003    0.0008      0.0022    0.0021    0.0108

# Number of computed bands
             93             90
# Figure of merit at the beginning and the end of the refinement
         4.7664        24.4080
# Chi-squares at the beginning and the end of the refinement
    0.3622    0.0404
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7292   -0.0552   -0.7310   -0.0567    0.0024    1    0.0475    0.0702
    2    2    1   -2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0713    0.0995
    3   -1   -2    2   -0.0262    0.0877   -0.0262    0.0895    0.0017    1    0.0698    0.0967
    4    2    0   -1   -0.1967   -0.5868   -0.1957   -0.5833    0.0036    1    0.0741    0.1078
    5    1    1   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0461    0.0654
    6    0   -2    1   -0.1057    0.1177   -0.1085    0.1216    0.0047    1    0.0550    0.0778
    7    2    1   -1    0.1202   -0.5978    0.1201   -0.5973    0.0005    1    0.0950    0.1302
    8    1    2   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0741    0.1017
    9    1   -2    0   -0.1926    0.0484   -0.1952    0.0486    0.0026    1    0.0558    0.0726
   10    0    1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0331    0.0467
   11    1    1    0    0.5366   -0.6156    0.5303   -0.6130    0.0068    1    0.0895    0.1248
   12    2   -2   -1   -0.1801   -0.0371   -0.1829   -0.0381    0.0029    1    0.0716    0.0984
   13   -1    2    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0721    0.0927
   14    0    2    1    0.5323   -0.1500    0.5293   -0.1451    0.0057    1    0.1073    0.1473
   15    2   -1   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0627    0.0881
   16   -2    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0893    0.0679
   17    0    1    1    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.0830    0.1198
   18    1    1    1    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1825    0.2483
   19   -2    1    2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0694    0.0994
   20   -1    1    2    0.4463    0.1661    0.4423    0.1634    0.0048    1    0.0851    0.1178
   21    2    0   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0621    0.0568
   22   -1    0    2    0.2985    0.3355    0.3053    0.3413    0.0089    1    0.0645    0.0899
   23   -1   -1    2    0.0339    0.2715    0.0347    0.2716    0.0008    1    0.0576    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7363   -0.0579   -0.7310   -0.0567    0.0054    1          0.0663          0.0702
    2    2    1   -2   -0.0133   -0.1757   -0.0130   -0.1762    0.0006    1          0.0992          0.0995
    3   -1   -2    2   -0.0268    0.0880   -0.0262    0.0895    0.0015    1          0.0970          0.0967
    4    2    0   -1   -0.1926   -0.5896   -0.1957   -0.5833    0.0070    1          0.1034          0.1078
    5    1    1   -1    0.0575   -0.2250    0.0560   -0.2234    0.0023    1          0.0643          0.0654
    6    0   -2    1   -0.1063    0.1181   -0.1085    0.1216    0.0041    1          0.0765          0.0778
    7    2    1   -1    0.1239   -0.5951    0.1201   -0.5973    0.0043    1          0.1327          0.1302
    8    1    2   -1    0.1449   -0.2210    0.1454   -0.2240    0.0030    1          0.1036          0.1017
    9    1   -2    0   -0.1935    0.0490   -0.1952    0.0486    0.0017    1          0.0776          0.0726
   10    0    1    0    0.2266   -0.1278    0.2251   -0.1274    0.0015    1          0.0462          0.0467
   11    1    1    0    0.5341   -0.6081    0.5303   -0.6130    0.0062    1          0.1248          0.1248
   12    2   -2   -1   -0.1813   -0.0369   -0.1829   -0.0381    0.0020    1          0.0995          0.0984
   13   -1    2    1    0.1993   -0.0087    0.1990   -0.0092    0.0006    1          0.1006          0.0927
   14    0    2    1    0.5287   -0.1504    0.5293   -0.1451    0.0054    1          0.1500          0.1473
   15    2   -1   -1   -0.3378   -0.2380   -0.3362   -0.2357    0.0028    1          0.0871          0.0881
   16   -1    1    1    0.1274    0.0362    0.1275    0.0362    0.0001    1          0.0621          0.0679
   17    0    1    1    0.7270   -0.0839    0.7293   -0.0807    0.0040    1          0.1158          0.1198
   18    1    1    1    1.0484   -0.5093    1.0696   -0.4972    0.0244    1          0.2529          0.2483
   19   -2    1    2    0.0440    0.0300    0.0442    0.0295    0.0005    1          0.0965          0.0994
   20   -1    1    2    0.4467    0.1636    0.4423    0.1634    0.0043    1          0.1188          0.1178
   21    1    0   -1   -0.0347   -0.0579   -0.0341   -0.0579    0.0006    1          0.0431          0.0568
   22   -1    0    2    0.3008    0.3351    0.3053    0.3413    0.0077    1          0.0898          0.0899
   23   -1   -1    2    0.0339    0.2729    0.0347    0.2716    0.0014    1          0.0800          0.0816

###            No.104                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0983    1.0951    1.0889  109.6862  109.6422  109.7365      0.5875
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0950    1.0950    1.0950  109.7559  109.7559  109.7559      0.4464         1.0000    1.0000    2.4528    2.4528    2.4528
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0093    0.0455    0.0455    0.5799      0.0283         0.0150    0.0150    0.1564    0.1564    0.1569
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9464   -0.5334   -0.2837)
 a2 = (    0.0550   -0.6030   -0.9497)
 a3 = (    0.6224    0.3597   -0.8746)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9510   -0.5364   -0.2855) (    0.0033    0.0055    0.0059)
 a2 = (    0.0561   -0.6077   -0.9493) (    0.0125    0.0058    0.0033)
 a3 = (    0.6203    0.3528   -0.8742) (    0.0135    0.0072    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -163.0125  120.0181  159.2656    0.3176    0.4947    0.3921
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0007   -0.0005    0.0014      0.0022    0.0021    0.0108

# Number of computed bands
             91             91
# Figure of merit at the beginning and the end of the refinement
         4.5071        23.1360
# Chi-squares at the beginning and the end of the refinement
    0.4607    0.0446
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7426   -0.0580   -0.7310   -0.0567    0.0117    1    0.0875    0.0702
    2   -1   -2    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    2    1   -2   -0.0263    0.0894   -0.0262    0.0895    0.0001    1    0.1276    0.0967
    4    0   -2    1   -0.1935   -0.5912   -0.1957   -0.5833    0.0082    1    0.1361    0.1078
    5   -1   -1    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2    0   -1   -0.1070    0.1201   -0.1085    0.1216    0.0021    1    0.1003    0.0778
    7   -1   -2    1    0.1236   -0.5978    0.1201   -0.5973    0.0034    1    0.1745    0.1302
    8   -2   -1    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    2   -1    0   -0.1956    0.0494   -0.1952    0.0486    0.0008    1    0.1017    0.0726
   10   -1    0    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -1   -1    0    0.5384   -0.6110    0.5303   -0.6130    0.0083    1    0.1644    0.1248
   12    2   -2    1   -0.1824   -0.0378   -0.1829   -0.0381    0.0006    1    0.1307    0.0984
   13   -2    1   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -2    0   -1    0.5313   -0.1493    0.5293   -0.1451    0.0047    1    0.1973    0.1473
   15    1   -2    1   -0.3385   -0.2395   -0.3362   -0.2357    0.0045    1    0.1146    0.0881
   16   -1    1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1    0   -1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1524    0.1198
   18   -1   -1   -1    1.0565   -0.5053    1.0696   -0.4972    0.0154    1    0.3347    0.2483
   19   -1    2   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -1    1   -2    0.4461    0.1648    0.4423    0.1634    0.0040    1    0.1565    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    0    1   -2    0.3006    0.3340    0.3053    0.3413    0.0087    1    0.1185    0.0899
   23    1    1   -2    0.0359    0.2732    0.0347    0.2716    0.0019    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7368   -0.0582   -0.7310   -0.0567    0.0059    1          0.0663          0.0702
    2   -1   -2    2   -0.0134   -0.1756   -0.0130   -0.1762    0.0007    1          0.0992          0.0995
    3    2    1   -2   -0.0270    0.0881   -0.0262    0.0895    0.0016    1          0.0970          0.0967
    4    0   -2    1   -0.1920   -0.5899   -0.1957   -0.5833    0.0075    1          0.1034          0.1078
    5   -1   -1    1    0.0576   -0.2250    0.0560   -0.2234    0.0023    1          0.0643          0.0654
    6    2    0   -1   -0.1063    0.1180   -0.1085    0.1216    0.0042    1          0.0764          0.0778
    7   -1   -2    1    0.1245   -0.5947    0.1201   -0.5973    0.0051    1          0.1328          0.1302
    8   -2   -1    1    0.1450   -0.2210    0.1454   -0.2240    0.0030    1          0.1036          0.1017
    9    2   -1    0   -0.1931    0.0490   -0.1952    0.0486    0.0021    1          0.0775          0.0726
   10   -1    0    0    0.2267   -0.1278    0.2251   -0.1274    0.0017    1          0.0463          0.0467
   11   -1   -1    0    0.5339   -0.6068    0.5303   -0.6130    0.0071    1          0.1249          0.1248
   12    2   -2    1   -0.1809   -0.0366   -0.1829   -0.0381    0.0024    1          0.0994          0.0984
   13   -2    1   -1    0.1997   -0.0086    0.1990   -0.0092    0.0009    1          0.1007          0.0927
   14   -2    0   -1    0.5284   -0.1505    0.5293   -0.1451    0.0055    1          0.1503          0.1473
   15    1   -2    1   -0.3378   -0.2379   -0.3362   -0.2357    0.0027    1          0.0870          0.0881
   16   -1    1   -1    0.1279    0.0365    0.1275    0.0362    0.0005    1          0.0621          0.0679
   17   -1    0   -1    0.7264   -0.0845    0.7293   -0.0807    0.0047    1          0.1160          0.1198
   18   -1   -1   -1    1.0460   -0.5084    1.0696   -0.4972    0.0261    1          0.2530          0.2483
   19   -1    2   -2    0.0443    0.0305    0.0442    0.0295    0.0009    1          0.0965          0.0994
   20   -1    1   -2    0.4472    0.1634    0.4423    0.1634    0.0049    1          0.1189          0.1178
   21    0   -1    1   -0.0348   -0.0575   -0.0341   -0.0579    0.0007    1          0.0431          0.0568
   22    0    1   -2    0.3015    0.3356    0.3053    0.3413    0.0069    1          0.0898          0.0899
   23    1    1   -2    0.0338    0.2735    0.0347    0.2716    0.0020    1          0.0799          0.0816

###            No.105                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0985    1.0616    1.0861  107.8862  111.5217  106.7376      0.4715
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0835    1.0835    1.0835  108.8802  108.8802  108.8802      0.4439         1.0000    1.0000    2.4411    2.4411    2.4411
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0069    0.0087    0.0014    0.0014    0.5543      0.0281         0.0144    0.0144    0.1553    0.1553    0.1557
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9245    0.5234    0.2748)
 a2 = (   -0.2679    0.8947   -0.5997)
 a3 = (   -0.8980   -0.0696   -0.6604)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9338    0.5296    0.2852) (    0.0033    0.0054    0.0058)
 a2 = (   -0.3076    0.8897   -0.5896) (    0.0147    0.0052    0.0044)
 a3 = (   -0.8839   -0.0845   -0.6674) (    0.0137    0.0079    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  160.9674  128.0573  -41.5620    0.4609    0.4320    0.5187
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004   -0.0005    0.0071      0.0023    0.0021    0.0107

# Number of computed bands
            400             72
# Figure of merit at the beginning and the end of the refinement
         5.7306        21.3916
# Chi-squares at the beginning and the end of the refinement
    0.5475    0.1094
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0696    0.0702
    2    1    2   -2   -0.0217   -0.1586   -0.0130   -0.1762    0.0196    1    0.1042    0.0995
    3   -1   -2    1   -0.0248    0.1051   -0.0262    0.0895    0.0157    1    0.1010    0.0967
    4    1    1   -2   -0.2154   -0.5560   -0.1957   -0.5833    0.0337    0    0.1069    0.1078
    5    1    1   -1    0.0430   -0.2170    0.0560   -0.2234    0.0145    1    0.0660    0.0654
    6   -1   -1    0   -0.1129    0.1342   -0.1085    0.1216    0.0134    1    0.0786    0.0778
    7    2    1   -2    0.0920   -0.5965    0.1201   -0.5973    0.0281    0    0.1361    0.1302
    8    2    1   -1    0.1345   -0.2219    0.1454   -0.2240    0.0111    1    0.1052    0.1017
    9   -1    0   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0810    0.0726
   10    1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0474    0.0467
   11    2    0   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1296    0.1248
   12   -1    1   -2   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1065    0.0984
   13    2   -1    1    0.1970   -0.0066    0.1990   -0.0092    0.0032    1    0.1065    0.0927
   14    3   -1    0    0.5299   -0.1428    0.5293   -0.1451    0.0023    1    0.1564    0.1473
   15    0    1   -2   -0.3237   -0.2190   -0.3362   -0.2357    0.0209    1    0.0926    0.0881
   16    1   -1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0672    0.0679
   17    2   -1    0    0.7203   -0.0693    0.7293   -0.0807    0.0146    1    0.1211    0.1198
   18    3   -1   -1    1.0674   -0.4947    1.0696   -0.4972    0.0033    1    0.2656    0.2483
   19    1   -2    2    0.0497    0.0320    0.0442    0.0295    0.0060    1    0.1059    0.0994
   20    2   -2    1    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1278    0.1178
   21    0    1   -1   -0.0288   -0.0441   -0.0341   -0.0579    0.0148    1    0.0468    0.0568
   22    1   -2    1    0.3044    0.3161    0.3053    0.3413    0.0253    0    0.0979    0.0899
   23    0   -2    1    0.0544    0.2794    0.0347    0.2716    0.0212    0    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7426   -0.0705   -0.7310   -0.0567    0.0180    1          0.0668          0.0702
    2    1    2   -2   -0.0150   -0.1748   -0.0130   -0.1762    0.0025    1          0.1002          0.0995
    3   -1   -2    1   -0.0238    0.0878   -0.0262    0.0895    0.0029    1          0.0967          0.0967
    4    1    1   -2   -0.1919   -0.5800   -0.1957   -0.5833    0.0051    1          0.1042          0.1078
    5    1    1   -1    0.0544   -0.2264    0.0560   -0.2234    0.0034    1          0.0644          0.0654
    6   -1   -1    0   -0.1051    0.1212   -0.1085    0.1216    0.0034    1          0.0753          0.0778
    7    2    1   -2    0.1149   -0.5943    0.1201   -0.5973    0.0060    1          0.1334          0.1302
    8    2    1   -1    0.1437   -0.2250    0.1454   -0.2240    0.0020    1          0.1028          0.1017
    9   -1    0   -1   -0.1965    0.0488   -0.1952    0.0486    0.0013    1          0.0764          0.0726
   10    1    0    0    0.2299   -0.1296    0.2251   -0.1274    0.0053    1          0.0457          0.0467
   11    2    0   -1    0.5318   -0.6171    0.5303   -0.6130    0.0044    1          0.1256          0.1248
   12   -1    1   -2   -0.1815   -0.0397   -0.1829   -0.0381    0.0021    1          0.0993          0.0984
   13    2   -1    1    0.2003   -0.0064    0.1990   -0.0092    0.0031    1          0.0998          0.0927
   14    3   -1    0    0.5339   -0.1490    0.5293   -0.1451    0.0060    1          0.1497          0.1473
   15    0    1   -2   -0.3317   -0.2403   -0.3362   -0.2357    0.0064    1          0.0878          0.0881
   16    1   -1    1    0.1259    0.0375    0.1275    0.0362    0.0021    1          0.0620          0.0679
   17    2   -1    0    0.7302   -0.0787    0.7293   -0.0807    0.0022    1          0.1160          0.1198
   18    3   -1   -1    1.0539   -0.5121    1.0696   -0.4972    0.0217    1          0.2557          0.2483
   19    1   -2    2    0.0426    0.0292    0.0442    0.0295    0.0016    1          0.0974          0.0994
   20    2   -2    1    0.4409    0.1665    0.4423    0.1634    0.0034    1          0.1190          0.1178
   21    0    1   -1   -0.0343   -0.0582   -0.0341   -0.0579    0.0004    1          0.0438          0.0568
   22    1   -2    1    0.2954    0.3278    0.3053    0.3413    0.0168    1          0.0904          0.0899
   23    0   -2    1    0.0389    0.2676    0.0347    0.2716    0.0059    1          0.0805          0.0816

###            No.106                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0022    1.0008    0.9971   90.2460   90.0865   90.0369      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.1515   90.1515   90.1515      0.3562         1.0000    1.0000    2.8077    2.8077    2.8077
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0001    0.0001    0.5996    0.5996    0.5996      0.0226         0.0001    0.0001    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2364    0.9436    0.2222)
 a2 = (    0.9530    0.2703   -0.1313)
 a3 = (   -0.1813    0.1844   -0.9691)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2377    0.9453    0.2234) (    0.0077    0.0026    0.0051)
 a2 = (    0.9532    0.2731   -0.1295) (    0.0023    0.0070    0.0043)
 a3 = (   -0.1815    0.1854   -0.9658) (    0.0076    0.0114    0.0014)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  120.2002  165.0170 -134.8176    1.3091    0.2596    1.1914
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0018      0.0021    0.0022    0.0106

# Number of computed bands
            155            145
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.8353
# Chi-squares at the beginning and the end of the refinement
    1.8003    0.0321
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    3    1    0   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3   -3    0   -1   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    2    1   -1   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    2    0    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6   -2    1   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    3    0   -1    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    3   -1    0    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9   -1    2   -1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -1   -1    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    0    3   -1   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13    1   -2    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14    2   -3   -1    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    1    2   -1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    1   -2   -1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    1   -1   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19   -1   -3    0    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20    0   -3   -1    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    1    1    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22   -1   -2   -1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23   -2   -1   -1    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7335   -0.0570   -0.7310   -0.0567    0.0025    1          0.0664          0.0702
    2    3    1    0   -0.0130   -0.1735   -0.0130   -0.1762    0.0026    1          0.0997          0.0995
    3   -3    0   -1   -0.0262    0.0898   -0.0262    0.0895    0.0003    1          0.0976          0.0967
    4    2    1   -1   -0.1945   -0.5851   -0.1957   -0.5833    0.0022    1          0.1032          0.1078
    5    2    0    0    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6   -2    1   -1   -0.1071    0.1201   -0.1085    0.1216    0.0020    1          0.0768          0.0778
    7    3    0   -1    0.1197   -0.5948    0.1201   -0.5973    0.0026    1          0.1321          0.1302
    8    3   -1    0    0.1433   -0.2200    0.1454   -0.2240    0.0045    1          0.1032          0.1017
    9   -1    2   -1   -0.1954    0.0489   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1   -1    0    0.2256   -0.1274    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    2   -1   -1    0.5347   -0.6138    0.5303   -0.6130    0.0045    1          0.1241          0.1248
   12    0    3   -1   -0.1819   -0.0383   -0.1829   -0.0381    0.0010    1          0.0999          0.0984
   13    1   -3    0    0.1980   -0.0083    0.1990   -0.0092    0.0013    1          0.1004          0.0927
   14    2   -3   -1    0.5307   -0.1493    0.5293   -0.1451    0.0044    1          0.1490          0.1473
   15    1    2   -1   -0.3358   -0.2376   -0.3362   -0.2357    0.0019    1          0.0875          0.0881
   16    0   -2    0    0.1262    0.0357    0.1275    0.0362    0.0014    1          0.0621          0.0679
   17    1   -2   -1    0.7309   -0.0798    0.7293   -0.0807    0.0018    1          0.1151          0.1198
   18    2   -2   -2    1.0622   -0.5123    1.0696   -0.4972    0.0168    1          0.2533          0.2483
   19   -1   -3    0    0.0438    0.0289    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -3   -1    0.4445    0.1663    0.4423    0.1634    0.0036    1          0.1185          0.1178
   21    1    1    0   -0.0333   -0.0578   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22   -1   -2   -1    0.2974    0.3345    0.3053    0.3413    0.0105    1          0.0900          0.0899
   23   -2   -1   -1    0.0348    0.2719    0.0347    0.2716    0.0002    1          0.0806          0.0816

###            No.107                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0095    1.0077    0.9848   88.7380   86.7622   89.9048      0.7829
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   89.9896   89.9896   89.9896      0.3560         1.0000    1.0000    2.8093    2.8093    2.8093
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.7094    0.7094    0.7094      0.0228         0.0000    0.0000    0.1797    0.1797    0.1797
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9463   -0.2684    0.1303)
 a2 = (   -0.2350    0.9383    0.2227)
 a3 = (   -0.1277    0.1801   -0.9930)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9535   -0.2722    0.1292) (    0.0027    0.0085    0.0045)
 a2 = (   -0.2392    0.9448    0.2240) (    0.0087    0.0021    0.0048)
 a3 = (   -0.1828    0.1826   -0.9660) (    0.0129    0.0084    0.0038)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   29.9737  165.0124 -134.9450    0.9925    0.3260    1.1324
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001   -0.0020      0.0021    0.0021    0.0119

# Number of computed bands
            270            147
# Figure of merit at the beginning and the end of the refinement
         1.0365         9.8214
# Chi-squares at the beginning and the end of the refinement
    8.6559    0.0345
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7979   -0.0656   -0.7310   -0.0567    0.0675    0    0.1527    0.0702
    2   -1    2    0   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1528    0.0995
    3    2   -1    0    0.0128    0.0114   -0.0262    0.0895    0.0873    1    0.1497    0.0967
    4   -1    2   -1   -0.1870   -0.6083   -0.1957   -0.5833    0.0265    0    0.2316    0.1078
    5    0    1    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0703    0.0654
    6   -1   -2   -1   -0.1154    0.1337   -0.1085    0.1216    0.0140    1    0.1669    0.0778
    7    0    3   -1    0.1318   -0.6016    0.1201   -0.5973    0.0125    1    0.2968    0.1302
    8    1    2    0    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1605    0.1017
    9   -2   -1   -1   -0.2119    0.0546   -0.1952    0.0486    0.0177    1    0.1686    0.0726
   10    1    1    0    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.1008    0.0467
   11    1    2   -1    0.5464   -0.6055    0.5303   -0.6130    0.0177    1    0.2802    0.1248
   12   -3    0   -1   -0.1943   -0.0409   -0.1829   -0.0381    0.0118    1    0.2173    0.0984
   13    2    1    0    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1571    0.0927
   14    3    2   -1    0.5333   -0.1494    0.5293   -0.1451    0.0058    1    0.3362    0.1473
   15   -2    1   -1   -0.3506   -0.2543   -0.3362   -0.2357    0.0235    0    0.1928    0.0881
   16    1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    2    1   -1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.2601    0.1198
   18    1    1   -1    1.0506   -0.4884    1.0696   -0.4972    0.0209    1    0.2819    0.2483
   19    2   -1    0    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1497    0.0994
   20    3    0   -1    0.4510    0.1639    0.4423    0.1634    0.0086    1    0.2669    0.1178
   21   -1    1    0   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0949    0.0568
   22    2   -1   -1    0.3105    0.3359    0.3053    0.3413    0.0075    1    0.2025    0.0899
   23    1   -2   -1    0.0428    0.2852    0.0347    0.2716    0.0157    1    0.1789    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7330   -0.0579   -0.7310   -0.0567    0.0023    1          0.0664          0.0702
    2   -1    3    0   -0.0129   -0.1741   -0.0130   -0.1762    0.0020    1          0.0995          0.0995
    3    0   -3   -1   -0.0264    0.0896   -0.0262    0.0895    0.0003    1          0.0974          0.0967
    4   -1    2   -1   -0.1944   -0.5858   -0.1957   -0.5833    0.0028    1          0.1032          0.1078
    5    0    2    0    0.0569   -0.2233    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1   -2   -1   -0.1072    0.1199   -0.1085    0.1216    0.0021    1          0.0767          0.0778
    7    0    3   -1    0.1203   -0.5948    0.1201   -0.5973    0.0025    1          0.1321          0.1302
    8    1    3    0    0.1437   -0.2199    0.1454   -0.2240    0.0044    1          0.1032          0.1017
    9   -2   -1   -1   -0.1954    0.0489   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1    1    0    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11    1    2   -1    0.5341   -0.6132    0.5303   -0.6130    0.0038    1          0.1241          0.1248
   12   -3    0   -1   -0.1822   -0.0381   -0.1829   -0.0381    0.0007    1          0.0999          0.0984
   13    3    1    0    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    3    2   -1    0.5302   -0.1496    0.5293   -0.1451    0.0045    1          0.1490          0.1473
   15   -2    1   -1   -0.3363   -0.2377   -0.3362   -0.2357    0.0020    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0358    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    2    1   -1    0.7306   -0.0811    0.7293   -0.0807    0.0013    1          0.1151          0.1198
   18    2    2   -2    1.0599   -0.5142    1.0696   -0.4972    0.0196    1          0.2530          0.2483
   19    3   -1    0    0.0434    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    3    0   -1    0.4450    0.1658    0.4423    0.1634    0.0036    1          0.1183          0.1178
   21   -1    1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    2   -1   -1    0.2981    0.3351    0.3053    0.3413    0.0095    1          0.0898          0.0899
   23    1   -2   -1    0.0343    0.2723    0.0347    0.2716    0.0008    1          0.0804          0.0816

###            No.109                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0085    1.0078    0.9839   89.4065   89.6990   89.9502      0.4460
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0244   90.0244   90.0244      0.3561         1.0000    1.0000    2.8078    2.8078    2.8078
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.5793    0.5793    0.5793      0.0226         0.0000    0.0000    0.1782    0.1782    0.1782
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2348   -0.9373   -0.2225)
 a2 = (    0.9466    0.2685   -0.1286)
 a3 = (    0.1750   -0.1842    0.9842)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2393   -0.9447   -0.2240) (    0.0084    0.0020    0.0048)
 a2 = (    0.9536    0.2718   -0.1292) (    0.0022    0.0067    0.0043)
 a3 = (    0.1835   -0.1830    0.9658) (    0.0108    0.0064    0.0029)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -119.9553   14.9856   45.0369    1.0055    0.3198    1.0421
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0019      0.0021    0.0020    0.0113

# Number of computed bands
            151            153
# Figure of merit at the beginning and the end of the refinement
         4.0522         9.7106
# Chi-squares at the beginning and the end of the refinement
    0.2880    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0855    0.0702
    2   -3    1    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    3    0    1   -0.0286    0.0973   -0.0262    0.0895    0.0082    1    0.1217    0.0967
    4   -2    1    1   -0.1989   -0.5977   -0.1957   -0.5833    0.0147    1    0.1308    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    2    1    1   -0.1139    0.1281   -0.1085    0.1216    0.0085    1    0.0959    0.0778
    7   -3    0    1    0.1217   -0.6040    0.1201   -0.5973    0.0069    1    0.1669    0.1302
    8   -3   -1    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1    2    1   -0.2058    0.0522   -0.1952    0.0486    0.0112    1    0.0973    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -2   -1    1    0.5428   -0.6218    0.5303   -0.6130    0.0152    1    0.1580    0.1248
   12    0    3    1   -0.1904   -0.0392   -0.1829   -0.0381    0.0076    1    0.1249    0.0984
   13   -1   -3    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -2   -3    1    0.5364   -0.1514    0.5293   -0.1451    0.0095    1    0.1879    0.1473
   15   -1    2    1   -0.3463   -0.2437   -0.3362   -0.2357    0.0129    1    0.1101    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -1   -2    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1463    0.1198
   18   -2   -2    2    1.0771   -0.5187    1.0696   -0.4972    0.0228    1    0.3268    0.2483
   19    1   -3    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    0   -3    1    0.4518    0.1678    0.4423    0.1634    0.0105    1    0.1493    0.1178
   21   -1    1    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -2    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1136    0.0899
   23    2   -1    1    0.0366    0.2822    0.0347    0.2716    0.0107    1    0.1012    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7323   -0.0573   -0.7310   -0.0567    0.0014    1          0.0665          0.0702
    2   -3    1    0   -0.0128   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    3    0    1   -0.0264    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -2    1    1   -0.1946   -0.5858   -0.1957   -0.5833    0.0027    1          0.1033          0.1078
    5   -2    0    0    0.0569   -0.2233    0.0560   -0.2234    0.0010    1          0.0643          0.0654
    6    2    1    1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7   -3    0    1    0.1203   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8   -3   -1    0    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1033          0.1017
    9    1    2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10   -1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11   -2   -1    1    0.5340   -0.6131    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    0    3    1   -0.1820   -0.0379   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -1   -3    0    0.1977   -0.0083    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -2   -3    1    0.5300   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1    2    1   -0.3363   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0357    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17   -1   -2    1    0.7305   -0.0812    0.7293   -0.0807    0.0012    1          0.1151          0.1198
   18   -2   -2    2    1.0599   -0.5143    1.0696   -0.4972    0.0196    1          0.2532          0.2483
   19    1   -3    0    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    0   -3    1    0.4450    0.1657    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1    1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1   -2    1    0.2981    0.3351    0.3053    0.3413    0.0095    1          0.0898          0.0899
   23    2   -1    1    0.0342    0.2722    0.0347    0.2716    0.0007    1          0.0805          0.0816

###            No.111                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0003    1.0001    0.9996   89.9836   89.9533   89.9471      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0248   90.0248   90.0248      0.3561         1.0000    1.0000    2.8078    2.8078    2.8078
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.5796    0.5796    0.5796      0.0226         0.0000    0.0000    0.1782    0.1782    0.1782
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2367    0.9450    0.2243)
 a2 = (   -0.1828    0.1826   -0.9659)
 a3 = (   -0.9543   -0.2707    0.1297)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2394    0.9447    0.2240) (    0.0084    0.0020    0.0048)
 a2 = (   -0.1835    0.1830   -0.9658) (    0.0108    0.0064    0.0030)
 a3 = (   -0.9536   -0.2718    0.1292) (    0.0022    0.0067    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  166.9421   82.5576  -74.0623    0.2786    0.4589    0.5681
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0000   -0.0019      0.0021    0.0020    0.0114

# Number of computed bands
            151            155
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.6686
# Chi-squares at the beginning and the end of the refinement
    0.2901    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    3    0   -1   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3   -3   -1    0   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    2   -1   -1   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6   -2   -1   -1   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    3   -1    0    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8    3    0    1    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9   -1   -1   -2   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10    1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    2   -1    1    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    0   -1   -3   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13    1    0    3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    2   -1    3    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    1   -1   -2   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16    0    0    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17    1   -1    2    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18    2   -2    2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19   -1    0    3    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    0   -1    3    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    1    0   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1   -1    2    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23   -2   -1    1    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7323   -0.0573   -0.7310   -0.0567    0.0014    1          0.0665          0.0702
    2    3    0   -1   -0.0128   -0.1742   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3   -3   -1    0   -0.0264    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    2   -1   -1   -0.1946   -0.5858   -0.1957   -0.5833    0.0027    1          0.1033          0.1078
    5    2    0    0    0.0569   -0.2233    0.0560   -0.2234    0.0010    1          0.0643          0.0654
    6   -2   -1   -1   -0.1071    0.1197   -0.1085    0.1216    0.0023    1          0.0768          0.0778
    7    3   -1    0    0.1203   -0.5948    0.1201   -0.5973    0.0025    1          0.1322          0.1302
    8    3    0    1    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1033          0.1017
    9   -1   -1   -2   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    1    0    1    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    2   -1    1    0.5340   -0.6131    0.5303   -0.6130    0.0037    1          0.1242          0.1248
   12    0   -1   -3   -0.1820   -0.0379   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13    1    0    3    0.1977   -0.0083    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    2   -1    3    0.5300   -0.1496    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1   -1   -2   -0.3363   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0    0    2    0.1259    0.0357    0.1275    0.0362    0.0016    1          0.0621          0.0679
   17    1   -1    2    0.7305   -0.0812    0.7293   -0.0807    0.0012    1          0.1151          0.1198
   18    2   -2    2    1.0599   -0.5143    1.0696   -0.4972    0.0196    1          0.2532          0.2483
   19   -1    0    3    0.0435    0.0289    0.0442    0.0295    0.0010    1          0.0969          0.0994
   20    0   -1    3    0.4450    0.1657    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1    0   -1   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1   -1    2    0.2981    0.3351    0.3053    0.3413    0.0095    1          0.0898          0.0899
   23   -2   -1    1    0.0342    0.2722    0.0347    0.2716    0.0007    1          0.0805          0.0816

###            No.112                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0073    0.9894    1.0042   90.8309   92.0664   90.3187      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.1038   90.1038   90.1038      0.3558         1.0000    1.0000    2.8106    2.8106    2.8106
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.5889    0.5889    0.5890      0.0226         0.0001    0.0001    0.1784    0.1784    0.1784
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1476   -0.1845    0.9649)
 a2 = (   -0.2542    0.9516    0.2272)
 a3 = (   -0.9505   -0.2696    0.1309)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1813   -0.1819    0.9665) (    0.0108    0.0070    0.0031)
 a2 = (   -0.2398    0.9445    0.2246) (    0.0069    0.0024    0.0052)
 a3 = (   -0.9537   -0.2711    0.1298) (    0.0020    0.0071    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   77.0142   82.6666  -74.0512    0.5053    0.5779    0.3742
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002   -0.0000   -0.0012      0.0023    0.0021    0.0110

# Number of computed bands
            400            168
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.3763
# Chi-squares at the beginning and the end of the refinement
    0.5436    0.0326
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    0    3   -1   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3    1   -3    0   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    1    2   -1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    0    2    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6    1   -2   -1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    1    3    0    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    0    3    1    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    1   -1   -2   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    1    2    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    1    0   -3   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    0    1    3    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    1    2    3    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1    1   -2   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    1    2    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19    0   -1    3    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    1    0    3    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    0    1   -1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    1   -1    2    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23    1   -2    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7332   -0.0576   -0.7310   -0.0567    0.0024    1          0.0664          0.0702
    2    0    3   -1   -0.0130   -0.1744   -0.0130   -0.1762    0.0018    1          0.0995          0.0995
    3    1   -3    0   -0.0265    0.0892   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1    2   -1   -0.1941   -0.5864   -0.1957   -0.5833    0.0035    1          0.1033          0.1078
    5    0    2    0    0.0570   -0.2236    0.0560   -0.2234    0.0011    1          0.0643          0.0654
    6    1   -2   -1   -0.1069    0.1194   -0.1085    0.1216    0.0026    1          0.0767          0.0778
    7    1    3    0    0.1209   -0.5948    0.1201   -0.5973    0.0026    1          0.1323          0.1302
    8    0    3    1    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1034          0.1017
    9    1   -1   -2   -0.1949    0.0490   -0.1952    0.0486    0.0005    1          0.0778          0.0726
   10    0    1    1    0.2257   -0.1272    0.2251   -0.1274    0.0007    1          0.0461          0.0467
   11    1    2    1    0.5340   -0.6121    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    1    0   -3   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1          0.0999          0.0984
   13    0    1    3    0.1981   -0.0083    0.1990   -0.0092    0.0012    1          0.1005          0.0927
   14    1    2    3    0.5298   -0.1497    0.5293   -0.1451    0.0046    1          0.1493          0.1473
   15    1    1   -2   -0.3365   -0.2376   -0.3362   -0.2357    0.0019    1          0.0874          0.0881
   16    0    0    2    0.1263    0.0359    0.1275    0.0362    0.0013    1          0.0621          0.0679
   17    1    1    2    0.7298   -0.0817    0.7293   -0.0807    0.0011    1          0.1153          0.1198
   18    2    2    2    1.0574   -0.5132    1.0696   -0.4972    0.0201    1          0.2532          0.2483
   19    0   -1    3    0.0436    0.0292    0.0442    0.0295    0.0007    1          0.0968          0.0994
   20    1    0    3    0.4453    0.1654    0.4423    0.1634    0.0036    1          0.1185          0.1178
   21    0    1   -1   -0.0339   -0.0580   -0.0341   -0.0579    0.0003    1          0.0433          0.0568
   22    1   -1    2    0.2986    0.3351    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1   -2    1    0.0342    0.2724    0.0347    0.2716    0.0009    1          0.0804          0.0816

###            No.113                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0070    1.0057    0.9875   89.1504   89.9780   89.9624      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   90.0700   90.0700   90.0700      0.3563         1.0000    1.0000    2.8070    2.8070    2.8070
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0000    0.6116    0.6116    0.6116      0.0240         0.0001    0.0001    0.1893    0.1893    0.1893
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2352    0.9391    0.2212)
 a2 = (   -0.9484   -0.2690    0.1306)
 a3 = (    0.2012   -0.1799    0.9761)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2397    0.9447    0.2240) (    0.0070    0.0025    0.0058)
 a2 = (   -0.9537   -0.2714    0.1296) (    0.0020    0.0074    0.0055)
 a3 = (    0.1817   -0.1817    0.9664) (    0.0109    0.0070    0.0031)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   60.0047   14.9880   45.0974    0.9758    0.3447    1.0647
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003   -0.0001   -0.0011      0.0029    0.0021    0.0110

# Number of computed bands
            133            168
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.3724
# Chi-squares at the beginning and the end of the refinement
    2.9010    0.0341
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    2   -1    0   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -3    0    1   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    2   -1    1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    1    0    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -2   -1    1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    3    0    1    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    2    1    0    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -1   -2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    2    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    0   -3    1   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    1    2    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    2    3    1    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    1   -2    1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    1    2    1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    1    1    1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19   -1    2    0    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20    0    3    1    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    1   -1    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -1    2    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -2    1    1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7330   -0.0578   -0.7310   -0.0567    0.0023    1          0.0665          0.0702
    2    3   -1    0   -0.0128   -0.1738   -0.0130   -0.1762    0.0024    1          0.0997          0.0995
    3   -3    0    1   -0.0265    0.0898   -0.0262    0.0895    0.0005    1          0.0976          0.0967
    4    2   -1    1   -0.1938   -0.5855   -0.1957   -0.5833    0.0029    1          0.1034          0.1078
    5    2    0    0    0.0569   -0.2229    0.0560   -0.2234    0.0010    1          0.0644          0.0654
    6   -2   -1    1   -0.1072    0.1199   -0.1085    0.1216    0.0021    1          0.0768          0.0778
    7    3    0    1    0.1206   -0.5940    0.1201   -0.5973    0.0034    1          0.1324          0.1302
    8    3    1    0    0.1436   -0.2195    0.1454   -0.2240    0.0048    1          0.1035          0.1017
    9   -1   -2    1   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    1    1    0    0.2253   -0.1269    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    2    1    1    0.5333   -0.6117    0.5303   -0.6130    0.0032    1          0.1244          0.1248
   12    0   -3    1   -0.1819   -0.0378   -0.1829   -0.0381    0.0010    1          0.1001          0.0984
   13    1    3    0    0.1977   -0.0082    0.1990   -0.0092    0.0015    1          0.1006          0.0927
   14    2    3    1    0.5294   -0.1496    0.5293   -0.1451    0.0045    1          0.1494          0.1473
   15    1   -2    1   -0.3361   -0.2374   -0.3362   -0.2357    0.0017    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0359    0.1275    0.0362    0.0014    1          0.0622          0.0679
   17    1    2    1    0.7295   -0.0816    0.7293   -0.0807    0.0009    1          0.1154          0.1198
   18    2    2    2    1.0570   -0.5134    1.0696   -0.4972    0.0205    1          0.2533          0.2483
   19   -1    3    0    0.0437    0.0292    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0    3    1    0.4451    0.1654    0.4423    0.1634    0.0034    1          0.1186          0.1178
   21    1   -1    0   -0.0336   -0.0577   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1    2    1    0.2986    0.3352    0.3053    0.3413    0.0091    1          0.0900          0.0899
   23   -2    1    1    0.0344    0.2727    0.0347    0.2716    0.0011    1          0.0805          0.0816

###            No.114                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0016    1.0009    0.9976   90.5950   90.1505   90.0451      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    1.0000    1.0000   89.8196   89.8196   89.8196      0.3563         1.0000    1.0000    2.8069    2.8069    2.8069
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0001    0.0001    0.4820    0.4820    0.4820      0.0226         0.0001    0.0001    0.1778    0.1778    0.1778
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2364   -0.9438   -0.2241)
 a2 = (   -0.9532   -0.2704    0.1295)
 a3 = (   -0.1930    0.1785   -0.9674)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2408   -0.9445   -0.2236) (    0.0070    0.0018    0.0046)
 a2 = (   -0.9538   -0.2707    0.1302) (    0.0019    0.0065    0.0050)
 a3 = (   -0.1813    0.1857   -0.9657) (    0.0065    0.0090    0.0013)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -59.9152  165.0251 -134.7480    0.9855    0.2608    1.1886
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0003   -0.0022      0.0022    0.0021    0.0107

# Number of computed bands
            139            166
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.3232
# Chi-squares at the beginning and the end of the refinement
    0.2906    0.0308
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2   -3   -1    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    3    0   -1   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4   -2   -1   -1   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    2   -1   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7   -3    0   -1    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8   -3    1    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1   -2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -2    1   -1    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    0   -3   -1   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13   -1    3    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -2    3   -1    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15   -1   -2   -1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17   -1    2   -1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18   -2    2   -2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    1    3    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    0    3   -1    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21   -1   -1    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1    2   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    2    1   -1    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7335   -0.0552   -0.7310   -0.0567    0.0029    1          0.0664          0.0702
    2   -3   -1    0   -0.0128   -0.1738   -0.0130   -0.1762    0.0024    1          0.0995          0.0995
    3    3    0   -1   -0.0268    0.0896   -0.0262    0.0895    0.0006    1          0.0976          0.0967
    4   -2   -1   -1   -0.1942   -0.5872   -0.1957   -0.5833    0.0042    1          0.1031          0.1078
    5   -2    0    0    0.0569   -0.2231    0.0560   -0.2234    0.0010    1          0.0643          0.0654
    6    2   -1   -1   -0.1071    0.1194   -0.1085    0.1216    0.0026    1          0.0769          0.0778
    7   -3    0   -1    0.1216   -0.5949    0.1201   -0.5973    0.0028    1          0.1321          0.1302
    8   -3    1    0    0.1436   -0.2197    0.1454   -0.2240    0.0047    1          0.1034          0.1017
    9    1   -2   -1   -0.1947    0.0490   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    1    0    0.2253   -0.1273    0.2251   -0.1274    0.0002    1          0.0461          0.0467
   11   -2    1   -1    0.5352   -0.6115    0.5303   -0.6130    0.0051    1          0.1242          0.1248
   12    0   -3   -1   -0.1816   -0.0377   -0.1829   -0.0381    0.0013    1          0.0999          0.0984
   13   -1    3    0    0.1982   -0.0087    0.1990   -0.0092    0.0009    1          0.1005          0.0927
   14   -2    3   -1    0.5297   -0.1496    0.5293   -0.1451    0.0045    1          0.1493          0.1473
   15   -1   -2   -1   -0.3369   -0.2373   -0.3362   -0.2357    0.0017    1          0.0873          0.0881
   16    0    2    0    0.1268    0.0357    0.1275    0.0362    0.0009    1          0.0621          0.0679
   17   -1    2   -1    0.7298   -0.0809    0.7293   -0.0807    0.0005    1          0.1153          0.1198
   18   -2    2   -2    1.0595   -0.5105    1.0696   -0.4972    0.0168    1          0.2529          0.2483
   19    1    3    0    0.0442    0.0293    0.0442    0.0295    0.0003    1          0.0968          0.0994
   20    0    3   -1    0.4456    0.1656    0.4423    0.1634    0.0039    1          0.1186          0.1178
   21   -1   -1    0   -0.0335   -0.0575   -0.0341   -0.0579    0.0007    1          0.0433          0.0568
   22    1    2   -1    0.2986    0.3356    0.3053    0.3413    0.0088    1          0.0899          0.0899
   23    2    1   -1    0.0340    0.2728    0.0347    0.2716    0.0013    1          0.0805          0.0816

###            No.115                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3061    1.3134    1.3109  117.6355  116.5293  116.6787      0.4554
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3238    1.3238    1.3238  117.1411  117.1411  117.1411      0.2959         1.0000    1.0000    4.4739    4.4739    4.4739
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0059    0.0059    0.0102    0.3089    0.3089    0.6489      0.0191         0.0122    0.0122    0.2895    0.2895    0.2908
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9600   -0.6435    0.9956)
 a2 = (    1.0070   -1.1288    0.2426)
 a3 = (    1.4583   -0.3631    0.3023)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9990   -0.6665    0.9948) (    0.0063    0.0087    0.0064)
 a2 = (    1.0336   -1.1410    0.2482) (    0.0069    0.0062    0.0070)
 a3 = (    1.4806   -0.3793    0.3097) (    0.0070    0.0089    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  137.2747  109.9162  128.8236    0.3418    0.2470    0.3445
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0008   -0.0087      0.0021    0.0022    0.0136

# Number of computed bands
            233            273
# Figure of merit at the beginning and the end of the refinement
         2.3994         4.2059
# Chi-squares at the beginning and the end of the refinement
    1.6785    0.2085
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7422   -0.0642   -0.7310   -0.0567    0.0135    1    0.1076    0.0702
    2    1   -4    2    0.0096   -0.1998   -0.0130   -0.1762    0.0327    1    0.1309    0.0995
    3    0    2   -1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.0783    0.0967
    4    1   -2    1   -0.1901   -0.5883   -0.1957   -0.5833    0.0075    1    0.0836    0.1078
    5    1   -3    1    0.0570   -0.2252    0.0560   -0.2234    0.0021    1    0.1040    0.0654
    6    0    1    0   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0615    0.0778
    7    3   -5    1    0.1235   -0.5941    0.1201   -0.5973    0.0047    1    0.2153    0.1302
    8    1   -2    0    0.1448   -0.2217    0.1454   -0.2240    0.0023    1    0.0835    0.1017
    9    0    0    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0624    0.0726
   10    1   -1   -1    0.2272   -0.1281    0.2251   -0.1274    0.0022    1    0.0746    0.0467
   11    3   -3   -1    0.5335   -0.6067    0.5303   -0.6130    0.0070    1    0.2021    0.1248
   12    0   -1    2   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.0804    0.0984
   13    1    0   -2    0.1995   -0.0084    0.1990   -0.0092    0.0009    1    0.0813    0.0927
   14    2   -1   -2    0.5285   -0.1498    0.5293   -0.1451    0.0048    1    0.1212    0.1473
   15    1   -3    3   -0.3361   -0.2402   -0.3362   -0.2357    0.0045    1    0.1412    0.0881
   16    1    1   -3    0.1273    0.0361    0.1275    0.0362    0.0002    1    0.1006    0.0679
   17    3   -1   -3    0.7248   -0.0833    0.7293   -0.0807    0.0052    1    0.1875    0.1198
   18    5   -3   -3    1.0430   -0.5055    1.0696   -0.4972    0.0279    1    0.4103    0.2483
   19    1    2   -4    0.0755    0.0383    0.0442    0.0295    0.0326    1    0.1270    0.0994
   20    3    1   -5    0.4451    0.1626    0.4423    0.1634    0.0029    1    0.1930    0.1178
   21    0   -2    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0700    0.0568
   22    1    1   -2    0.3014    0.3320    0.3053    0.3413    0.0101    1    0.0728    0.0899
   23    1    3   -3    0.0365    0.2727    0.0347    0.2716    0.0021    1    0.1297    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7335   -0.0491   -0.7310   -0.0567    0.0080    1          0.0692          0.0702
    2    1   -5    3   -0.0121   -0.1765   -0.0130   -0.1762    0.0010    1          0.1032          0.0995
    3    0    5   -3   -0.0105    0.0664   -0.0262    0.0895    0.0279    1          0.1175          0.0967
    4    2   -4    2   -0.1978   -0.5942   -0.1957   -0.5833    0.0110    1          0.1071          0.1078
    5    1   -3    1    0.0583   -0.2232    0.0560   -0.2234    0.0023    1          0.0668          0.0654
    6    0    2    0   -0.1090    0.1197   -0.1085    0.1216    0.0019    1          0.0807          0.0778
    7    3   -5    1    0.1241   -0.5977    0.1201   -0.5973    0.0039    1          0.1368          0.1302
    8    2   -4    0    0.1433   -0.2173    0.1454   -0.2240    0.0070    1          0.1076          0.1017
    9    0    0    2   -0.1978    0.0499   -0.1952    0.0486    0.0029    1          0.0819          0.0726
   10    1   -1   -1    0.2209   -0.1252    0.2251   -0.1274    0.0047    1          0.0480          0.0467
   11    3   -3   -1    0.5357   -0.6101    0.5303   -0.6130    0.0061    1          0.1280          0.1248
   12    0   -3    5   -0.1673   -0.0602   -0.1829   -0.0381    0.0271    1          0.1206          0.0984
   13    2    0   -4    0.1927   -0.0098    0.1990   -0.0092    0.0063    1          0.1046          0.0927
   14    4   -2   -4    0.5247   -0.1496    0.5293   -0.1451    0.0064    1          0.1541          0.1473
   15    1   -3    3   -0.3437   -0.2386   -0.3362   -0.2357    0.0080    1          0.0910          0.0881
   16    1    1   -3    0.1222    0.0331    0.1275    0.0362    0.0061    1          0.0645          0.0679
   17    3   -1   -3    0.7264   -0.0827    0.7293   -0.0807    0.0035    1          0.1185          0.1198
   18    5   -3   -3    1.0604   -0.5120    1.0696   -0.4972    0.0175    1          0.2601          0.2483
   19    1    3   -5    0.0406    0.0261    0.0442    0.0295    0.0050    1          0.1004          0.0994
   20    3    1   -5    0.4435    0.1628    0.4423    0.1634    0.0013    1          0.1222          0.1178
   21    0   -2    2   -0.0354   -0.0614   -0.0341   -0.0579    0.0037    1          0.0448          0.0568
   22    2    2   -4    0.2978    0.3354    0.3053    0.3413    0.0096    1          0.0927          0.0899
   23    1    3   -3    0.0318    0.2724    0.0347    0.2716    0.0030    1          0.0834          0.0816

###            No.116                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3194    1.3258    1.3023  117.2589  116.4395  117.3898      0.4666
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3150    1.3150    1.3150  117.0185  117.0185  117.0185      0.2864         1.0000    1.0000    4.5917    4.5917    4.5917
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0082    0.0082    0.0140    0.4231    0.4231    0.8931      0.0191         0.0169    0.0169    0.3076    0.3076    0.3102
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1870    1.4647   -0.4189)
 a2 = (    0.9325    1.0426   -0.6406)
 a3 = (    0.2235    0.9871   -1.1781)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1834    1.4742   -0.4079) (    0.0095    0.0025    0.0078)
 a2 = (    0.9351    1.0492   -0.6307) (    0.0097    0.0067    0.0073)
 a3 = (    0.2179    0.9926   -1.1577) (    0.0104    0.0053    0.0118)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -142.1801  154.4185  -62.0933    0.6081    0.3339    0.6446
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003   -0.0000   -0.0024      0.0023    0.0020    0.0186

# Number of computed bands
            281            307
# Figure of merit at the beginning and the end of the refinement
         2.1172         4.1582
# Chi-squares at the beginning and the end of the refinement
    2.6733    0.0536
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7536   -0.0589   -0.7310   -0.0567    0.0227    1    0.0562    0.0702
    2    2    0   -1   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.0817    0.0995
    3   -2    1    0   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0801    0.0967
    4    3    1   -3   -0.1980   -0.5956   -0.1957   -0.5833    0.0124    1    0.1726    0.1078
    5    3   -1   -1    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.1057    0.0654
    6   -3    3   -1   -0.1132    0.1267   -0.1085    0.1216    0.0069    1    0.1266    0.0778
    7    5   -1   -3    0.1213   -0.6023    0.1201   -0.5973    0.0051    1    0.2206    0.1302
    8    4   -2   -1    0.1099   -0.2283    0.1454   -0.2240    0.0358    1    0.1363    0.1017
    9   -1    2   -1   -0.2042    0.0515   -0.1952    0.0486    0.0095    1    0.0642    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0378    0.0467
   11    2   -1   -1    0.5398   -0.6209    0.5303   -0.6130    0.0124    1    0.1039    0.1248
   12    0    3   -2   -0.1490   -0.0731   -0.1829   -0.0381    0.0487    1    0.1095    0.0984
   13    2   -4    1    0.1732    0.0140    0.1990   -0.0092    0.0346    1    0.1320    0.0927
   14    5   -5   -1    0.5353   -0.1522    0.5293   -0.1451    0.0093    1    0.2485    0.1473
   15    1    3   -3   -0.3447   -0.2429   -0.3362   -0.2357    0.0111    1    0.1454    0.0881
   16    1   -3    1    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.1021    0.0679
   17    3   -3   -1    0.7396   -0.0839    0.7293   -0.0807    0.0107    1    0.1930    0.1198
   18    5   -3   -3    1.0723   -0.5224    1.0696   -0.4972    0.0254    1    0.4323    0.2483
   19    0   -2    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.0795    0.0994
   20    1   -2    0    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.0982    0.1178
   21    1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0712    0.0568
   22    0   -1    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0746    0.0899
   23   -1    0    0    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0665    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2   -2   -0.7317   -0.0577   -0.7310   -0.0567    0.0013    1          0.0673          0.0702
    2    4    0   -2   -0.0129   -0.1742   -0.0130   -0.1762    0.0020    1          0.1008          0.0995
    3   -4    0    1    0.0104    0.0958   -0.0262    0.0895    0.0371    1          0.1229          0.0967
    4    3    1   -3   -0.1949   -0.5856   -0.1957   -0.5833    0.0024    1          0.1046          0.1078
    5    3   -1   -1    0.0569   -0.2234    0.0560   -0.2234    0.0010    1          0.0651          0.0654
    6   -3    3   -1   -0.1072    0.1197   -0.1085    0.1216    0.0022    1          0.0778          0.0778
    7    5   -1   -3    0.1199   -0.5948    0.1201   -0.5973    0.0025    1          0.1339          0.1302
    8    5   -3   -1    0.1438   -0.2200    0.1454   -0.2240    0.0043    1          0.1047          0.1017
    9   -2    4   -2   -0.1950    0.0490   -0.1952    0.0486    0.0005    1          0.0789          0.0726
   10    2   -2    0    0.2255   -0.1272    0.2251   -0.1274    0.0004    1          0.0467          0.0467
   11    4   -2   -2    0.5327   -0.6137    0.5303   -0.6130    0.0025    1          0.1258          0.1248
   12   -1    5   -3   -0.1819   -0.0377   -0.1829   -0.0381    0.0011    1          0.1013          0.0984
   13    3   -5    1    0.1980   -0.0085    0.1990   -0.0092    0.0011    1          0.1018          0.0927
   14    5   -5   -1    0.5301   -0.1507    0.5293   -0.1451    0.0057    1          0.1511          0.1473
   15    1    3   -3   -0.3364   -0.2370   -0.3362   -0.2357    0.0013    1          0.0886          0.0881
   16    1   -3    1    0.1263    0.0357    0.1275    0.0362    0.0012    1          0.0629          0.0679
   17    3   -3   -1    0.7310   -0.0833    0.7293   -0.0807    0.0030    1          0.1167          0.1198
   18    5   -3   -3    1.0580   -0.5180    1.0696   -0.4972    0.0238    1          0.2565          0.2483
   19    3   -6    2    0.0534   -0.0012    0.0442    0.0295    0.0321    1          0.1142          0.0994
   20    2   -4    0    0.4464    0.1651    0.4423    0.1634    0.0044    1          0.1199          0.1178
   21    1    1   -1   -0.0338   -0.0579   -0.0341   -0.0579    0.0004    1          0.0439          0.0568
   22    0   -2    0    0.2996    0.3359    0.3053    0.3413    0.0079    1          0.0909          0.0899
   23   -2    0    0    0.0343    0.2732    0.0347    0.2716    0.0016    1          0.0814          0.0816

###            No.117                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3098    1.2994    1.3371  117.7906  118.0851  115.1849      0.5710
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3170    1.3170    1.3170  117.0464  117.0464  117.0464      0.2816         1.0000    1.0000    4.6771    4.6771    4.6771
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0064    0.0064    0.0109    0.3308    0.3308    0.6974      0.0179         0.0132    0.0132    0.2977    0.2977    0.2993
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4240    1.2383    0.8058)
 a2 = (    0.7028    0.5137    1.2765)
 a3 = (    1.1666    0.8179    0.5850)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4158    1.2454    0.8137) (    0.0079    0.0044    0.0056)
 a2 = (    0.6801    0.5344    1.2799) (    0.0059    0.0102    0.0045)
 a3 = (    1.1666    0.8215    0.5918) (    0.0092    0.0079    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   36.7566  118.3198   91.0484    0.2894    0.2552    0.4004
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0010    0.0005   -0.0006      0.0021    0.0020    0.0117

# Number of computed bands
            400            221
# Figure of merit at the beginning and the end of the refinement
         1.5277         4.0905
# Chi-squares at the beginning and the end of the refinement
    3.2219    0.1476
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7274   -0.0469   -0.7310   -0.0567    0.0104    1    0.1349    0.0702
    2    2   -1    0   -0.0126   -0.1698   -0.0130   -0.1762    0.0064    1    0.1009    0.0995
    3   -3    2    0   -0.0025    0.0504   -0.0262    0.0895    0.0457    1    0.1328    0.0967
    4    1    0    0   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1041    0.1078
    5    3   -1   -1    0.0550   -0.2194    0.0560   -0.2234    0.0041    1    0.1301    0.0654
    6   -2    1    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0783    0.0778
    7    2    0   -1    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1330    0.1302
    8    4   -1   -2    0.1078   -0.2255    0.1454   -0.2240    0.0377    1    0.1675    0.1017
    9   -3    1    3   -0.1968    0.0502   -0.1952    0.0486    0.0023    1    0.1581    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0461    0.0467
   11    3    1   -3    0.5399   -0.6284    0.5303   -0.6130    0.0181    1    0.2530    0.1248
   12   -1    0    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1008    0.0984
   13    2    1   -4    0.1744    0.0157    0.1990   -0.0092    0.0349    1    0.1610    0.0927
   14    2    1   -3    0.5403   -0.1488    0.5293   -0.1451    0.0116    1    0.1497    0.1473
   15    0    0    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0884    0.0881
   16    1    1   -3    0.1268    0.0375    0.1275    0.0362    0.0015    1    0.1248    0.0679
   17    1    1   -2    0.7492   -0.0722    0.7293   -0.0807    0.0216    1    0.1167    0.1198
   18    3    2   -4    0.8549   -0.6322    1.0696   -0.4972    0.2536    0    0.3822    0.2483
   19    0    1   -2    0.0443    0.0305    0.0442    0.0295    0.0009    1    0.0976    0.0994
   20    1    3   -5    0.4476    0.1776    0.4423    0.1634    0.0152    1    0.2398    0.1178
   21    1   -1    1   -0.0320   -0.0557   -0.0341   -0.0579    0.0031    1    0.0879    0.0568
   22   -1    3   -3    0.2907    0.3444    0.3053    0.3413    0.0149    1    0.1829    0.0899
   23   -3    3   -1    0.0301    0.2732    0.0347    0.2716    0.0048    1    0.1652    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7344   -0.0573   -0.7310   -0.0567    0.0035    1          0.0665          0.0702
    2    4   -2    0   -0.0127   -0.1772   -0.0130   -0.1762    0.0011    1          0.0995          0.0995
    3   -5    3    1   -0.0251    0.0872   -0.0262    0.0895    0.0025    1          0.0972          0.0967
    4    2    0    0   -0.1954   -0.5887   -0.1957   -0.5833    0.0054    1          0.1035          0.1078
    5    3   -1   -1    0.0576   -0.2257    0.0560   -0.2234    0.0029    1          0.0642          0.0654
    6   -4    2    2   -0.1060    0.1191   -0.1085    0.1216    0.0035    1          0.0765          0.0778
    7    4    0   -2    0.1207   -0.5973    0.1201   -0.5973    0.0006    1          0.1322          0.1302
    8    5   -1   -3    0.1446   -0.2212    0.1454   -0.2240    0.0029    1          0.1031          0.1017
    9   -3    1    3   -0.1961    0.0490   -0.1952    0.0486    0.0010    1          0.0777          0.0726
   10    2    0   -2    0.2253   -0.1272    0.2251   -0.1274    0.0003    1          0.0459          0.0467
   11    3    1   -3    0.5348   -0.6137    0.5303   -0.6130    0.0045    1          0.1240          0.1248
   12   -2    0    4   -0.1841   -0.0389   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    3    1   -5    0.1959   -0.0087    0.1990   -0.0092    0.0031    1          0.1000          0.0927
   14    4    2   -6    0.5287   -0.1493    0.5293   -0.1451    0.0043    1          0.1484          0.1473
   15    0    0    2   -0.3383   -0.2395   -0.3362   -0.2357    0.0043    1          0.0876          0.0881
   16    1    1   -3    0.1235    0.0344    0.1275    0.0362    0.0044    1          0.0619          0.0679
   17    2    2   -4    0.7280   -0.0809    0.7293   -0.0807    0.0014    1          0.1145          0.1198
   18    3    3   -5    1.0590   -0.5125    1.0696   -0.4972    0.0186    1          0.2523          0.2483
   19   -3    3   -2    0.0209    0.0483    0.0442    0.0295    0.0299    1          0.0991          0.0994
   20    1    3   -5    0.4417    0.1638    0.4423    0.1634    0.0007    1          0.1177          0.1178
   21    1   -1    1   -0.0349   -0.0614   -0.0341   -0.0579    0.0036    1          0.0433          0.0568
   22   -1    3   -3    0.2959    0.3308    0.3053    0.3413    0.0141    1          0.0893          0.0899
   23   -3    3   -1    0.0350    0.2683    0.0347    0.2716    0.0033    1          0.0801          0.0816

###            No.118                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3156    1.3149    1.3159  117.0393  117.0951  116.9405      0.5753
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3169    1.3169    1.3169  117.0453  117.0453  117.0453      0.2815         1.0000    1.0000    4.6780    4.6780    4.6780
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0064    0.0064    0.0109    0.3306    0.3306    0.6971      0.0179         0.0132    0.0132    0.2979    0.2979    0.2996
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6835   -0.5324   -1.2745)
 a2 = (   -0.4175   -1.2444   -0.8076)
 a3 = (   -1.1686   -0.8192   -0.5844)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6799   -0.5341   -1.2799) (    0.0059    0.0102    0.0045)
 a2 = (   -0.4159   -1.2452   -0.8136) (    0.0079    0.0044    0.0056)
 a3 = (   -1.1667   -0.8211   -0.5918) (    0.0092    0.0079    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -70.2578   61.6897  -88.9684    0.4767    0.2551    0.4003
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0005   -0.0009      0.0021    0.0020    0.0117

# Number of computed bands
            221            223
# Figure of merit at the beginning and the end of the refinement
         1.9083         4.0766
# Chi-squares at the beginning and the end of the refinement
    3.2357    0.1481
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7287   -0.0545   -0.7310   -0.0567    0.0032    1    0.1353    0.0702
    2    1   -2    0   -0.0134   -0.1731   -0.0130   -0.1762    0.0031    1    0.1015    0.0995
    3   -2    3    0   -0.0020    0.0472   -0.0262    0.0895    0.0487    1    0.1327    0.0967
    4    0   -1    0   -0.1957   -0.5833   -0.1957   -0.5833    0.0000    1    0.1051    0.1078
    5    1   -3    1    0.0561   -0.2227    0.0560   -0.2234    0.0007    1    0.1313    0.0654
    6   -1    2   -1   -0.1065    0.1190   -0.1085    0.1216    0.0032    1    0.0783    0.0778
    7    0   -2    1    0.1186   -0.5937    0.1201   -0.5973    0.0039    1    0.1347    0.1302
    8    1   -4    2    0.1096   -0.2277    0.1454   -0.2240    0.0360    1    0.1695    0.1017
    9   -1    3   -3   -0.1936    0.0490   -0.1952    0.0486    0.0017    1    0.1592    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0470    0.0467
   11   -1   -3    3    0.5323   -0.6132    0.5303   -0.6130    0.0020    1    0.2546    0.1248
   12    0    1   -2   -0.1805   -0.0371   -0.1829   -0.0381    0.0025    1    0.1019    0.0984
   13   -1   -2    4    0.1738    0.0141    0.1990   -0.0092    0.0342    1    0.1642    0.0927
   14   -1   -2    3    0.5294   -0.1501    0.5293   -0.1451    0.0050    1    0.1522    0.1473
   15    0    0   -1   -0.3353   -0.2351   -0.3362   -0.2357    0.0011    1    0.0891    0.0881
   16   -1   -1    3    0.1267    0.0359    0.1275    0.0362    0.0009    1    0.1270    0.0679
   17   -1   -1    2    0.7298   -0.0817    0.7293   -0.0807    0.0011    1    0.1175    0.1198
   18   -3   -3    5    1.0589   -0.5147    1.0696   -0.4972    0.0205    1    0.5258    0.2483
   19   -1    0    2    0.0442    0.0295    0.0442    0.0295    0.0000    1    0.0988    0.0994
   20   -3   -1    5    0.4450    0.1654    0.4423    0.1634    0.0033    1    0.2430    0.1178
   21    1   -1   -1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0885    0.0568
   22   -3    1    3    0.2979    0.3349    0.3053    0.3413    0.0098    1    0.1839    0.0899
   23   -3    3    1    0.0341    0.2719    0.0347    0.2716    0.0006    1    0.1646    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7349   -0.0571   -0.7310   -0.0567    0.0039    1          0.0665          0.0702
    2    2   -4    0   -0.0129   -0.1772   -0.0130   -0.1762    0.0010    1          0.0994          0.0995
    3   -3    5   -1   -0.0252    0.0873   -0.0262    0.0895    0.0024    1          0.0971          0.0967
    4    0   -2    0   -0.1957   -0.5889   -0.1957   -0.5833    0.0056    1          0.1034          0.1078
    5    1   -3    1    0.0575   -0.2257    0.0560   -0.2234    0.0027    1          0.0642          0.0654
    6   -2    4   -2   -0.1062    0.1192   -0.1085    0.1216    0.0033    1          0.0765          0.0778
    7    0   -4    2    0.1206   -0.5974    0.1201   -0.5973    0.0004    1          0.1322          0.1302
    8    1   -5    3    0.1444   -0.2212    0.1454   -0.2240    0.0030    1          0.1030          0.1017
    9   -1    3   -3   -0.1963    0.0491   -0.1952    0.0486    0.0012    1          0.0777          0.0726
   10    0   -2    2    0.2251   -0.1272    0.2251   -0.1274    0.0002    1          0.0459          0.0467
   11   -1   -3    3    0.5346   -0.6138    0.5303   -0.6130    0.0044    1          0.1239          0.1248
   12    0    2   -4   -0.1843   -0.0389   -0.1829   -0.0381    0.0016    1          0.0998          0.0984
   13   -1   -3    5    0.1958   -0.0087    0.1990   -0.0092    0.0032    1          0.1000          0.0927
   14   -2   -4    6    0.5285   -0.1495    0.5293   -0.1451    0.0044    1          0.1484          0.1473
   15    0    0   -2   -0.3387   -0.2395   -0.3362   -0.2357    0.0045    1          0.0875          0.0881
   16   -1   -1    3    0.1234    0.0343    0.1275    0.0362    0.0045    1          0.0619          0.0679
   17   -2   -2    4    0.7279   -0.0811    0.7293   -0.0807    0.0015    1          0.1145          0.1198
   18   -3   -3    5    1.0587   -0.5127    1.0696   -0.4972    0.0189    1          0.2520          0.2483
   19   -3    3    2    0.0208    0.0483    0.0442    0.0295    0.0300    1          0.0990          0.0994
   20   -3   -1    5    0.4418    0.1636    0.4423    0.1634    0.0006    1          0.1177          0.1178
   21    1   -1   -1   -0.0350   -0.0614   -0.0341   -0.0579    0.0036    1          0.0433          0.0568
   22   -3    1    3    0.2960    0.3308    0.3053    0.3413    0.0140    1          0.0893          0.0899
   23   -3    3    1    0.0350    0.2685    0.0347    0.2716    0.0032    1          0.0801          0.0816

###            No.120                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3125    1.2981    1.3159  116.6968  117.7999  116.2856      0.7405
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3271    1.3271    1.3271  117.1862  117.1862  117.1862      0.2787         1.0000    1.0000    4.7623    4.7623    4.7623
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0060    0.0060    0.0103    0.3117    0.3117    0.6536      0.0179         0.0122    0.0122    0.3065    0.3065    0.3079
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.0027    1.1240   -0.2454)
 a2 = (   -0.9596    0.6372   -1.0036)
 a3 = (   -1.4529    0.3601   -0.3050)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.0400    1.1454   -0.2469) (    0.0071    0.0065    0.0072)
 a2 = (   -1.0117    0.6706   -0.9906) (    0.0064    0.0090    0.0064)
 a3 = (   -1.4876    0.3865   -0.3034) (    0.0070    0.0092    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -170.3243   69.6552  -51.1524    0.2864    0.2448    0.3492
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0025   -0.0025   -0.0115      0.0021    0.0023    0.0139

# Number of computed bands
            145            280
# Figure of merit at the beginning and the end of the refinement
         1.2415         4.0079
# Chi-squares at the beginning and the end of the refinement
   15.1809    0.4536
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7481   -0.0672   -0.7310   -0.0567    0.0201    1    0.1767    0.0702
    2    3   -1   -1    0.0569   -0.2268   -0.0130   -0.1762    0.0863    1    0.1692    0.0995
    3   -2    0    1   -0.0265    0.0906   -0.0262    0.0895    0.0012    1    0.1270    0.0967
    4    2   -1   -1   -0.1925   -0.5913   -0.1957   -0.5833    0.0085    1    0.1369    0.1078
    5    3   -1   -1    0.0569   -0.2268    0.0560   -0.2234    0.0036    1    0.1692    0.0654
    6   -1    0    0   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0997    0.0778
    7    4   -2   -1    0.0988   -0.4430    0.1201   -0.5973    0.1558    1    0.2488    0.1302
    8    2   -1    0    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1357    0.1017
    9    0    0   -1   -0.1978    0.0490   -0.1952    0.0486    0.0026    1    0.1013    0.0726
   10    1   -1    1    0.2294   -0.1299    0.2251   -0.1274    0.0050    1    0.1211    0.0467
   11    3   -3    1    0.5357   -0.6164    0.5303   -0.6130    0.0064    1    0.3339    0.1248
   12    1    0   -2   -0.1833   -0.0389   -0.1829   -0.0381    0.0010    1    0.1306    0.0984
   13    0   -1    2    0.2019   -0.0086    0.1990   -0.0092    0.0030    1    0.1318    0.0927
   14    1   -2    2    0.5351   -0.1533    0.5293   -0.1451    0.0100    1    0.1982    0.1473
   15    3   -1   -3   -0.3383   -0.2423   -0.3362   -0.2357    0.0069    1    0.2311    0.0881
   16   -1   -1    3    0.1290    0.0366    0.1275    0.0362    0.0015    1    0.1633    0.0679
   17    1   -3    3    0.7352   -0.0867    0.7293   -0.0807    0.0083    1    0.3093    0.1198
   18    2   -4    3    0.9431   -0.2911    1.0696   -0.4972    0.2418    1    0.4760    0.2483
   19   -3    0    2   -0.0018    0.0475    0.0442    0.0295    0.0494    1    0.1699    0.0994
   20    0   -2    3    0.4449    0.0354    0.4423    0.1634    0.1280    1    0.2054    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1   -1    2    0.3055    0.3370    0.3053    0.3413    0.0043    1    0.1187    0.0899
   23   -3   -1    3    0.0369    0.2767    0.0347    0.2716    0.0055    1    0.2114    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7257   -0.0413   -0.7310   -0.0567    0.0163    1          0.0644          0.0702
    2    5   -1   -3   -0.0146   -0.1696   -0.0130   -0.1762    0.0067    1          0.0966          0.0995
    3   -5    0    3   -0.0138    0.0725   -0.0262    0.0895    0.0210    1          0.1104          0.0967
    4    4   -2   -2   -0.2024   -0.5857   -0.1957   -0.5833    0.0071    1          0.0998          0.1078
    5    3   -1   -1    0.0550   -0.2178    0.0560   -0.2234    0.0057    1          0.0627          0.0654
    6   -2    0    0   -0.1110    0.1220   -0.1085    0.1216    0.0026    1          0.0761          0.0778
    7    5   -3   -1    0.1187   -0.5930    0.1201   -0.5973    0.0046    1          0.1278          0.1302
    8    4   -2    0    0.1401   -0.2137    0.1454   -0.2240    0.0116    1          0.1011          0.1017
    9    0    0   -2   -0.1958    0.0527   -0.1952    0.0486    0.0042    1          0.0771          0.0726
   10    1   -1    1    0.2196   -0.1237    0.2251   -0.1274    0.0066    1          0.0453          0.0467
   11    3   -3    1    0.5306   -0.6114    0.5303   -0.6130    0.0017    1          0.1200          0.1248
   12    3    0   -5   -0.1647   -0.0540   -0.1829   -0.0381    0.0241    1          0.1131          0.0984
   13    0   -2    4    0.1947   -0.0078    0.1990   -0.0092    0.0045    1          0.0985          0.0927
   14    2   -4    4    0.5257   -0.1506    0.5293   -0.1451    0.0065    1          0.1451          0.1473
   15    3   -1   -3   -0.3427   -0.2295   -0.3362   -0.2357    0.0089    1          0.0849          0.0881
   16   -1   -1    3    0.1253    0.0373    0.1275    0.0362    0.0025    1          0.0607          0.0679
   17    1   -3    3    0.7310   -0.0847    0.7293   -0.0807    0.0043    1          0.1118          0.1198
   18    3   -5    3    1.0625   -0.5218    1.0696   -0.4972    0.0257    1          0.2452          0.2483
   19   -3   -1    5    0.0433    0.0326    0.0442    0.0295    0.0032    1          0.0941          0.0994
   20   -1   -3    5    0.4494    0.1670    0.4423    0.1634    0.0080    1          0.1151          0.1178
   21    3    0   -3   -0.0355   -0.0534   -0.0341   -0.0579    0.0047    1          0.0630          0.0568
   22   -2   -2    4    0.3011    0.3453    0.3053    0.3413    0.0058    1          0.0873          0.0899
   23   -3   -1    3    0.0288    0.2808    0.0347    0.2716    0.0109    1          0.0784          0.0816

###            No.121                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3157    1.3099    1.3172  116.9243  117.3474  116.7528      0.6040
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3310    1.3310    1.3310  117.2377  117.2377  117.2377      0.2797         1.0000    1.0000    4.7589    4.7589    4.7589
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0095    0.0095    0.0163    0.4966    0.4966    1.0394      0.0181         0.0194    0.0194    0.3100    0.3100    0.3136
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.0112   -1.1336    0.2436)
 a2 = (    1.4644   -0.3646    0.3036)
 a3 = (    0.9763   -0.6557    0.9927)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.0525   -1.1459    0.2459) (    0.0083    0.0080    0.0076)
 a2 = (    1.4967   -0.3882    0.3008) (    0.0033    0.0104    0.0071)
 a3 = (    1.0260   -0.6731    0.9877) (    0.0064    0.0083    0.0130)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   54.7198   11.0236 -101.6487    1.3592    0.2619    1.2776
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0027   -0.0027   -0.0107      0.0021    0.0020    0.0207

# Number of computed bands
            177            275
# Figure of merit at the beginning and the end of the refinement
         1.6815         3.8991
# Chi-squares at the beginning and the end of the refinement
    6.3610    0.4564
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7318   -0.0580   -0.7310   -0.0567    0.0015    1    0.1423    0.0702
    2   -4    2    1    0.0088   -0.1983   -0.0130   -0.1762    0.0310    1    0.1739    0.0995
    3    2   -1    0   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1043    0.0967
    4   -2    1    1   -0.1957   -0.5833   -0.1957   -0.5833    0.0000    1    0.1106    0.1078
    5   -3    1    1    0.0557   -0.2237    0.0560   -0.2234    0.0004    1    0.1378    0.0654
    6    1    0    0   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0819    0.0778
    7   -5    1    3    0.1182   -0.5952    0.1201   -0.5973    0.0029    1    0.2850    0.1302
    8   -2    0    1    0.1433   -0.2207    0.1454   -0.2240    0.0039    1    0.1103    0.1017
    9    0    1    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0832    0.0726
   10   -1   -1    1    0.2258   -0.1269    0.2251   -0.1274    0.0009    1    0.0985    0.0467
   11   -3   -1    3    0.5355   -0.6137    0.5303   -0.6130    0.0052    1    0.2676    0.1248
   12   -1    2    0   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1071    0.0984
   13    0   -2    1    0.1972   -0.0074    0.1990   -0.0092    0.0025    1    0.1075    0.0927
   14   -1   -2    2    0.5301   -0.1471    0.5293   -0.1451    0.0021    1    0.1595    0.1473
   15   -3    3    1   -0.3348   -0.2366   -0.3362   -0.2357    0.0017    1    0.1881    0.0881
   16    1   -3    1    0.1249    0.0361    0.1275    0.0362    0.0026    1    0.1335    0.0679
   17   -1   -3    3    0.7286   -0.0766    0.7293   -0.0807    0.0041    1    0.2476    0.1198
   18   -2   -3    4    0.9433   -0.2774    1.0696   -0.4972    0.2535    1    0.3794    0.2483
   19    3   -2    0   -0.0018    0.0462    0.0442    0.0295    0.0489    1    0.1395    0.0994
   20    0   -3    2    0.4368    0.0389    0.4423    0.1634    0.1246    1    0.1660    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0466    0.0568
   22    1   -2    1    0.2947    0.3318    0.3053    0.3413    0.0143    1    0.0964    0.0899
   23    3   -3    1    0.0349    0.2698    0.0347    0.2716    0.0019    1    0.1731    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7170   -0.0384   -0.7310   -0.0567    0.0230    1          0.0644          0.0702
    2   -5    3    1   -0.0138   -0.1682   -0.0130   -0.1762    0.0080    1          0.0968          0.0995
    3    5   -3    0   -0.0146    0.0731   -0.0262    0.0895    0.0201    1          0.1110          0.0967
    4   -4    2    2   -0.2019   -0.5841   -0.1957   -0.5833    0.0062    1          0.0998          0.1078
    5   -3    1    1    0.0557   -0.2160    0.0560   -0.2234    0.0074    1          0.0629          0.0654
    6    2    0    0   -0.1107    0.1203   -0.1085    0.1216    0.0026    1          0.0768          0.0778
    7   -5    1    3    0.1202   -0.5908    0.1201   -0.5973    0.0065    1          0.1281          0.1302
    8   -4    0    2    0.1402   -0.2117    0.1454   -0.2240    0.0133    1          0.1018          0.1017
    9    0    2    0   -0.1930    0.0521   -0.1952    0.0486    0.0041    1          0.0778          0.0726
   10   -1   -1    1    0.2191   -0.1227    0.2251   -0.1274    0.0077    1          0.0456          0.0467
   11   -3   -1    3    0.5307   -0.6087    0.5303   -0.6130    0.0043    1          0.1203          0.1248
   12   -3    5    0   -0.1626   -0.0526   -0.1829   -0.0381    0.0249    1          0.1136          0.0984
   13    0   -4    2    0.1951   -0.0077    0.1990   -0.0092    0.0041    1          0.0992          0.0927
   14   -2   -4    4    0.5250   -0.1498    0.5293   -0.1451    0.0064    1          0.1458          0.1473
   15   -3    3    1   -0.3409   -0.2267   -0.3362   -0.2357    0.0101    1          0.0851          0.0881
   16    1   -3    1    0.1265    0.0378    0.1275    0.0362    0.0019    1          0.0610          0.0679
   17   -1   -3    3    0.7312   -0.0840    0.7293   -0.0807    0.0038    1          0.1123          0.1198
   18   -3   -3    5    1.0640   -0.5213    1.0696   -0.4972    0.0248    1          0.2464          0.2483
   19    3   -5    1    0.0446    0.0338    0.0442    0.0295    0.0043    1          0.0944          0.0994
   20    1   -5    3    0.4507    0.1682    0.4423    0.1634    0.0097    1          0.1156          0.1178
   21   -3    3    0   -0.0347   -0.0519   -0.0341   -0.0579    0.0061    1          0.0630          0.0568
   22    2   -4    2    0.3010    0.3488    0.3053    0.3413    0.0086    1          0.0876          0.0899
   23    3   -3    1    0.0264    0.2819    0.0347    0.2716    0.0132    1          0.0788          0.0816

###            No.122                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3159    1.3136    1.3200  117.1332  117.2015  116.7849      0.4569
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3157    1.3157    1.3157  117.0292  117.0292  117.0292      0.2815         1.0000    1.0000    4.6737    4.6737    4.6737
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0080    0.0080    0.0137    0.4136    0.4136    0.8726      0.0192         0.0165    0.0165    0.3194    0.3194    0.3218
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.2335    0.1383    0.9169)
 a2 = (   -0.5145    0.1940    1.4437)
 a3 = (   -0.7831    0.9023    0.9766)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.2357    0.1357    0.9125) (    0.0041    0.0085    0.0058)
 a2 = (   -0.5191    0.1911    1.4395) (    0.0113    0.0080    0.0042)
 a3 = (   -0.7854    0.9024    0.9731) (    0.0074    0.0109    0.0066)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   36.6187   97.2369  179.0812    0.2655    0.3287    0.4015
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0002    0.0023      0.0024    0.0021    0.0125

# Number of computed bands
            217            277
# Figure of merit at the beginning and the end of the refinement
         2.4755         3.8859
# Chi-squares at the beginning and the end of the refinement
    3.3377    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0538    0.0702
    2   -2   -1    4    0.0096   -0.1998   -0.0130   -0.1762    0.0327    1    0.1311    0.0995
    3    0    3   -4   -0.0578    0.1100   -0.0262    0.0895    0.0377    1    0.1376    0.0967
    4   -3    1    3   -0.1973   -0.5863   -0.1957   -0.5833    0.0033    1    0.1679    0.1078
    5   -1   -1    3    0.0570   -0.2252    0.0560   -0.2234    0.0021    1    0.1042    0.0654
    6   -1    3   -3   -0.1065    0.1181   -0.1085    0.1216    0.0040    1    0.1244    0.0778
    7   -1    0    2    0.1194   -0.5980    0.1201   -0.5973    0.0010    1    0.1073    0.1302
    8    0   -1    2    0.1448   -0.2217    0.1454   -0.2240    0.0023    1    0.0836    0.1017
    9   -3    3   -1   -0.1933    0.0483   -0.1952    0.0486    0.0020    1    0.1263    0.0726
   10    1   -1    1    0.2272   -0.1281    0.2251   -0.1274    0.0022    1    0.0747    0.0467
   11    0    0    1    0.5357   -0.6173    0.5303   -0.6130    0.0069    1    0.1011    0.1248
   12   -4    3    0   -0.1957   -0.0017   -0.1829   -0.0381    0.0386    1    0.1411    0.0984
   13    2   -1    0    0.1995   -0.0084    0.1990   -0.0092    0.0009    1    0.0814    0.0927
   14    2   -1    1    0.4423   -0.1592    0.5293   -0.1451    0.0882    1    0.1544    0.1473
   15   -2    1    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0708    0.0881
   16    3   -1   -1    0.1273    0.0361    0.1275    0.0362    0.0002    1    0.1007    0.0679
   17    1    0    0    0.7341   -0.0823    0.7293   -0.0807    0.0050    1    0.0937    0.1198
   18    1    1    1    1.0651   -0.5195    1.0696   -0.4972    0.0228    1    0.4178    0.2483
   19    4   -1   -2    0.0755    0.0383    0.0442    0.0295    0.0326    1    0.1271    0.0994
   20    2    0   -1    0.4473    0.1663    0.4423    0.1634    0.0057    1    0.0960    0.1178
   21   -2    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0701    0.0568
   22    3    1   -3    0.2993    0.3367    0.3053    0.3413    0.0076    1    0.1457    0.0899
   23    1    1   -2    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.0650    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7289   -0.0566   -0.7310   -0.0567    0.0021    1          0.0664          0.0702
    2   -3   -1    5   -0.0130   -0.1747   -0.0130   -0.1762    0.0015    1          0.0997          0.0995
    3    1    3   -5   -0.0259    0.0879   -0.0262    0.0895    0.0016    1          0.0975          0.0967
    4   -3    1    3   -0.1947   -0.5843   -0.1957   -0.5833    0.0014    1          0.1034          0.1078
    5   -1   -1    3    0.0568   -0.2237    0.0560   -0.2234    0.0010    1          0.0644          0.0654
    6   -1    3   -3   -0.1060    0.1184   -0.1085    0.1216    0.0040    1          0.0768          0.0778
    7   -2    0    4    0.1196   -0.5942    0.1201   -0.5973    0.0032    1          0.1324          0.1302
    8    0   -2    4    0.1437   -0.2201    0.1454   -0.2240    0.0042    1          0.1033          0.1017
    9   -3    3   -1   -0.1940    0.0486   -0.1952    0.0486    0.0012    1          0.0779          0.0726
   10    1   -1    1    0.2252   -0.1270    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    0    0    2    0.5332   -0.6124    0.5303   -0.6130    0.0029    1          0.1244          0.1248
   12   -5    3    1   -0.1814   -0.0380   -0.1829   -0.0381    0.0015    1          0.1000          0.0984
   13    4   -2    0    0.1971   -0.0083    0.1990   -0.0092    0.0021    1          0.1004          0.0927
   14    3   -1    1    0.5288   -0.1489    0.5293   -0.1451    0.0038    1          0.1491          0.1473
   15   -4    2    2   -0.3353   -0.2367   -0.3362   -0.2357    0.0013    1          0.0876          0.0881
   16    3   -1   -1    0.1251    0.0355    0.1275    0.0362    0.0025    1          0.0621          0.0679
   17    2    0    0    0.7284   -0.0801    0.7293   -0.0807    0.0011    1          0.1152          0.1198
   18    1    1    1    1.0586   -0.5123    1.0696   -0.4972    0.0187    1          0.2537          0.2483
   19    5   -1   -3    0.0428    0.0283    0.0442    0.0295    0.0019    1          0.0969          0.0994
   20    4    0   -2    0.4426    0.1653    0.4423    0.1634    0.0019    1          0.1183          0.1178
   21   -3    0    3   -0.0341   -0.0588   -0.0341   -0.0579    0.0009    1          0.0651          0.0568
   22    3    1   -3    0.2957    0.3329    0.3053    0.3413    0.0127    1          0.0898          0.0899
   23    2    2   -4    0.0340    0.2696    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.123                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3147    1.3083    1.3143  117.2730  117.0540  116.6164      0.7377
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3102    1.3102    1.3102  116.9484  116.9484  116.9484      0.2843         1.0000    1.0000    4.6077    4.6077    4.6077
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0123    0.3701    0.3701    0.7835      0.0187         0.0149    0.0149    0.3039    0.3039    0.3059
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.2156    0.1450    0.9148)
 a2 = (   -0.4941    0.2009    1.4434)
 a3 = (   -0.7637    0.9118    0.9747)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.2262    0.1313    0.9058) (    0.0039    0.0084    0.0055)
 a2 = (   -0.5043    0.1870    1.4325) (    0.0110    0.0068    0.0041)
 a3 = (   -0.7733    0.9015    0.9647) (    0.0073    0.0109    0.0054)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   36.6264   97.1486  179.1731    0.2551    0.2551    0.3704
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0013    0.0007   -0.0062      0.0021    0.0020    0.0116

# Number of computed bands
            302            277
# Figure of merit at the beginning and the end of the refinement
         1.0640         3.8597
# Chi-squares at the beginning and the end of the refinement
   12.7861    0.0419
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2   -1   -1    3    0.0544   -0.2235   -0.0130   -0.1762    0.0824    1    0.1689    0.0995
    3   -2    2   -1   -0.0331    0.0120   -0.0262    0.0895    0.0778    1    0.1494    0.0967
    4   -3    1    3   -0.1998   -0.5800   -0.1957   -0.5833    0.0053    1    0.2730    0.1078
    5   -1   -1    3    0.0544   -0.2235    0.0560   -0.2234    0.0016    1    0.1689    0.0654
    6   -1    3   -3   -0.1072    0.1206   -0.1085    0.1216    0.0017    1    0.2016    0.0778
    7   -1    0    2    0.1107   -0.5958    0.1201   -0.5973    0.0096    1    0.1735    0.1302
    8    0   -1    2    0.1413   -0.2218    0.1454   -0.2240    0.0047    1    0.1350    0.1017
    9   -3    3   -1   -0.1961    0.0498   -0.1952    0.0486    0.0015    1    0.2043    0.0726
   10    1   -1    1    0.2255   -0.1299    0.2251   -0.1274    0.0025    1    0.1200    0.0467
   11    0    0    1    0.5262   -0.6282    0.5303   -0.6130    0.0158    1    0.1633    0.1248
   12   -4    3    0   -0.1985   -0.0013   -0.1829   -0.0381    0.0399    1    0.2284    0.0984
   13    2   -1    0    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1305    0.0927
   14    2   -1    1    0.4430   -0.1642    0.5293   -0.1451    0.0884    1    0.2487    0.1473
   15   -2    1    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    3   -1   -1    0.1264    0.0359    0.1275    0.0362    0.0011    1    0.1619    0.0679
   17    1    0    0    0.7420   -0.0885    0.7293   -0.0807    0.0149    1    0.1513    0.1198
   18    1    0    1    0.7429   -0.3966    1.0696   -0.4972    0.3418    0    0.3210    0.2483
   19   -1    2   -2   -0.0072    0.0064    0.0442    0.0295    0.0563    1    0.1495    0.0994
   20    2    0   -1    0.4501    0.1678    0.4423    0.1634    0.0090    1    0.1544    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    3    1   -3    0.2986    0.3389    0.3053    0.3413    0.0071    1    0.2358    0.0899
   23    1    1   -2    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7285   -0.0570   -0.7310   -0.0567    0.0026    1          0.0665          0.0702
    2   -3   -1    5   -0.0125   -0.1722   -0.0130   -0.1762    0.0040    1          0.1000          0.0995
    3    1    3   -5   -0.0259    0.0914   -0.0262    0.0895    0.0019    1          0.0980          0.0967
    4   -3    1    3   -0.1973   -0.5811   -0.1957   -0.5833    0.0027    1          0.1030          0.1078
    5   -1   -1    3    0.0559   -0.2216    0.0560   -0.2234    0.0018    1          0.0643          0.0654
    6   -1    3   -3   -0.1081    0.1216   -0.1085    0.1216    0.0004    1          0.0771          0.0778
    7   -2    0    4    0.1152   -0.5950    0.1201   -0.5973    0.0055    1          0.1315          0.1302
    8    0   -2    4    0.1422   -0.2192    0.1454   -0.2240    0.0057    1          0.1030          0.1017
    9   -3    3   -1   -0.1970    0.0488   -0.1952    0.0486    0.0018    1          0.0782          0.0726
   10    1   -1    1    0.2246   -0.1270    0.2251   -0.1274    0.0007    1          0.0458          0.0467
   11    0    0    2    0.5334   -0.6210    0.5303   -0.6130    0.0086    1          0.1235          0.1248
   12   -5    3    1   -0.1825   -0.0393   -0.1829   -0.0381    0.0012    1          0.1005          0.0984
   13    4   -2    0    0.1968   -0.0083    0.1990   -0.0092    0.0024    1          0.1002          0.0927
   14    3   -1    1    0.5327   -0.1499    0.5293   -0.1451    0.0059    1          0.1481          0.1473
   15   -4    2    2   -0.3344   -0.2367   -0.3362   -0.2357    0.0021    1          0.0879          0.0881
   16    3   -1   -1    0.1251    0.0351    0.1275    0.0362    0.0026    1          0.0622          0.0679
   17    2    0    0    0.7361   -0.0794    0.7293   -0.0807    0.0069    1          0.1145          0.1198
   18    1    1    1    1.0740   -0.5233    1.0696   -0.4972    0.0265    1          0.2537          0.2483
   19    5   -1   -3    0.0435    0.0278    0.0442    0.0295    0.0018    1          0.0974          0.0994
   20    4    0   -2    0.4446    0.1679    0.4423    0.1634    0.0050    1          0.1180          0.1178
   21   -3    0    3   -0.0324   -0.0579   -0.0341   -0.0579    0.0018    1          0.0655          0.0568
   22    3    1   -3    0.2962    0.3355    0.3053    0.3413    0.0108    1          0.0899          0.0899
   23    2    2   -4    0.0351    0.2722    0.0347    0.2716    0.0007    1          0.0810          0.0816

###            No.124                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3156    1.3169    1.3199  117.2876  117.1510  116.7201      0.6311
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3100    1.3100    1.3100  116.9457  116.9457  116.9457      0.2834         1.0000    1.0000    4.6217    4.6217    4.6217
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0072    0.0122    0.3664    0.3664    0.7757      0.0179         0.0148    0.0148    0.2922    0.2922    0.2943
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5181   -0.2013   -1.4412)
 a2 = (    1.2365   -0.1456   -0.9148)
 a3 = (    0.7865   -0.9091   -0.9744)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5049   -0.1853   -1.4321) (    0.0108    0.0066    0.0040)
 a2 = (    1.2267   -0.1294   -0.9048) (    0.0038    0.0081    0.0054)
 a3 = (    0.7743   -0.9001   -0.9646) (    0.0072    0.0106    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -70.6284   82.9004   -0.7816    0.4469    0.2516    0.3643
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0014    0.0006   -0.0043      0.0021    0.0020    0.0113

# Number of computed bands
            221            277
# Figure of merit at the beginning and the end of the refinement
         1.5600         3.8593
# Chi-squares at the beginning and the end of the refinement
    4.9959    0.0533
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0742    0.0702
    2    1    2   -4    0.0098   -0.1989   -0.0130   -0.1762    0.0322    1    0.1816    0.0995
    3   -2    2    1   -0.0312    0.0112   -0.0262    0.0895    0.0784    1    0.1285    0.0967
    4   -1    3   -3   -0.1953   -0.5849   -0.1957   -0.5833    0.0016    1    0.2323    0.1078
    5    1    1   -3    0.0569   -0.2238    0.0560   -0.2234    0.0010    1    0.1443    0.0654
    6   -3    1    3   -0.1064    0.1182   -0.1085    0.1216    0.0039    1    0.1724    0.0778
    7    0    1   -2    0.1195   -0.5941    0.1201   -0.5973    0.0032    1    0.1482    0.1302
    8    1    0   -2    0.1437   -0.2202    0.1454   -0.2240    0.0042    1    0.1159    0.1017
    9   -3    3    1   -0.1933    0.0487   -0.1952    0.0486    0.0019    1    0.1750    0.0726
   10    1   -1   -1    0.2252   -0.1277    0.2251   -0.1274    0.0003    1    0.1035    0.0467
   11    0    0   -1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1393    0.1248
   12   -3    4    0   -0.1959   -0.0012   -0.1829   -0.0381    0.0391    1    0.1955    0.0984
   13    1   -2    0    0.1983   -0.0091    0.1990   -0.0092    0.0007    1    0.1126    0.0927
   14    1   -2   -1    0.4388   -0.1599    0.5293   -0.1451    0.0917    1    0.2138    0.1473
   15   -1    2   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0978    0.0881
   16    1   -3    1    0.1268    0.0355    0.1275    0.0362    0.0010    1    0.1392    0.0679
   17    0   -1    0    0.7297   -0.0859    0.7293   -0.0807    0.0052    1    0.1292    0.1198
   18   -1   -1   -1    1.0533   -0.5206    1.0696   -0.4972    0.0286    1    0.5797    0.2483
   19   -2    1    2   -0.0060    0.0053    0.0442    0.0295    0.0557    1    0.1283    0.0994
   20    0   -2    1    0.4471    0.1638    0.4423    0.1634    0.0047    1    0.1326    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0484    0.0568
   22   -1   -3    3    0.3002    0.3358    0.3053    0.3413    0.0075    1    0.2014    0.0899
   23   -1   -1    2    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.0897    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7280   -0.0570   -0.7310   -0.0567    0.0031    1          0.0665          0.0702
    2    1    3   -5   -0.0123   -0.1725   -0.0130   -0.1762    0.0038    1          0.0999          0.0995
    3   -3   -1    5   -0.0257    0.0909   -0.0262    0.0895    0.0015    1          0.0979          0.0967
    4   -1    3   -3   -0.1967   -0.5811   -0.1957   -0.5833    0.0024    1          0.1030          0.1078
    5    1    1   -3    0.0561   -0.2215    0.0560   -0.2234    0.0019    1          0.0642          0.0654
    6   -3    1    3   -0.1078    0.1215   -0.1085    0.1216    0.0006    1          0.0770          0.0778
    7    0    2   -4    0.1158   -0.5943    0.1201   -0.5973    0.0053    1          0.1314          0.1302
    8    2    0   -4    0.1423   -0.2186    0.1454   -0.2240    0.0062    1          0.1028          0.1017
    9   -3    3    1   -0.1972    0.0489   -0.1952    0.0486    0.0020    1          0.0781          0.0726
   10    1   -1   -1    0.2241   -0.1262    0.2251   -0.1274    0.0016    1          0.0458          0.0467
   11    0    0   -2    0.5335   -0.6191    0.5303   -0.6130    0.0069    1          0.1233          0.1248
   12   -3    5   -1   -0.1830   -0.0393   -0.1829   -0.0381    0.0013    1          0.1004          0.0984
   13    2   -4    0    0.1957   -0.0079    0.1990   -0.0092    0.0035    1          0.1000          0.0927
   14    1   -3   -1    0.5314   -0.1486    0.5293   -0.1451    0.0041    1          0.1477          0.1473
   15   -2    4   -2   -0.3344   -0.2369   -0.3362   -0.2357    0.0022    1          0.0878          0.0881
   16    1   -3    1    0.1240    0.0350    0.1275    0.0362    0.0037    1          0.0621          0.0679
   17    0   -2    0    0.7340   -0.0779    0.7293   -0.0807    0.0055    1          0.1142          0.1198
   18   -1   -1   -1    1.0728   -0.5199    1.0696   -0.4972    0.0230    1          0.2532          0.2483
   19    1   -5    3    0.0427    0.0274    0.0442    0.0295    0.0026    1          0.0972          0.0994
   20    0   -4    2    0.4425    0.1679    0.4423    0.1634    0.0045    1          0.1178          0.1178
   21    0    3   -3   -0.0326   -0.0585   -0.0341   -0.0579    0.0016    1          0.0654          0.0568
   22   -1   -3    3    0.2946    0.3343    0.3053    0.3413    0.0128    1          0.0897          0.0899
   23   -2   -2    4    0.0348    0.2710    0.0347    0.2716    0.0007    1          0.0808          0.0816

###            No.125                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3202    1.3253    1.3183  117.6152  116.9499  116.7539      0.5776
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3099    1.3099    1.3099  116.9439  116.9439  116.9439      0.2838         1.0000    1.0000    4.6153    4.6153    4.6153
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0079    0.0079    0.0133    0.4015    0.4015    0.8501      0.0183         0.0162    0.0162    0.2986    0.2986    0.3010
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4271   -1.2473   -0.8116)
 a2 = (   -1.1751   -0.8238   -0.5893)
 a3 = (   -0.7032   -0.5460   -1.2839)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4120   -1.2348   -0.8031) (    0.0098    0.0071    0.0076)
 a2 = (   -1.1648   -0.8034   -0.5806) (    0.0053    0.0076    0.0081)
 a3 = (   -0.6727   -0.5178   -1.2723) (    0.0064    0.0106    0.0116)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -79.3244  147.7020  174.1180    0.5226    0.3614    0.5546
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0077    0.0026      0.0022    0.0021    0.0181

# Number of computed bands
            219            225
# Figure of merit at the beginning and the end of the refinement
         1.8575         3.8196
# Chi-squares at the beginning and the end of the refinement
    3.4007    0.4861
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7263   -0.0613   -0.7310   -0.0567    0.0067    1    0.1372    0.0702
    2   -2    0    1   -0.0134   -0.1731   -0.0130   -0.1762    0.0031    1    0.1015    0.0995
    3    3    0   -2   -0.0024    0.0500   -0.0262    0.0895    0.0461    1    0.1324    0.0967
    4   -1    0    0   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1060    0.1078
    5   -3    1    1    0.0561   -0.2227    0.0560   -0.2234    0.0007    1    0.1313    0.0654
    6    2   -1   -1   -0.1106    0.1215   -0.1085    0.1216    0.0022    1    0.0786    0.0778
    7   -2    1    0    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1355    0.1302
    8   -4    2    1    0.1096   -0.2277    0.1454   -0.2240    0.0360    1    0.1695    0.1017
    9    3   -3   -1   -0.1974    0.0485   -0.1952    0.0486    0.0022    1    0.1605    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0470    0.0467
   11   -3    3   -1    0.5298   -0.6246    0.5303   -0.6130    0.0116    1    0.2569    0.1248
   12    1   -2    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1027    0.0984
   13   -2    4   -1    0.1738    0.0141    0.1990   -0.0092    0.0342    1    0.1642    0.0927
   14   -2    3   -1    0.5342   -0.1545    0.5293   -0.1451    0.0106    1    0.1527    0.1473
   15    0   -1    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0900    0.0881
   16   -1    3   -1    0.1267    0.0359    0.1275    0.0362    0.0009    1    0.1270    0.0679
   17   -1    2   -1    0.7411   -0.0885    0.7293   -0.0807    0.0141    1    0.1186    0.1198
   18   -3    5   -3    1.0690   -0.5425    1.0696   -0.4972    0.0454    1    0.5380    0.2483
   19    0    2   -1    0.0442    0.0295    0.0442    0.0295    0.0000    1    0.0988    0.0994
   20   -1    5   -3    0.4524    0.1672    0.4423    0.1634    0.0108    1    0.2434    0.1178
   21   -1   -1    1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0885    0.0568
   22    1    3   -3    0.3035    0.3427    0.3053    0.3413    0.0023    1    0.1841    0.0899
   23    3    1   -3    0.0330    0.2787    0.0347    0.2716    0.0073    1    0.1644    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7316   -0.0521   -0.7310   -0.0567    0.0046    1          0.0668          0.0702
    2   -4    0    2   -0.0128   -0.1773   -0.0130   -0.1762    0.0011    1          0.1000          0.0995
    3    5   -1   -3   -0.0267    0.0842   -0.0262    0.0895    0.0053    1          0.0987          0.0967
    4   -2    0    0   -0.1945   -0.5914   -0.1957   -0.5833    0.0081    1          0.1033          0.1078
    5   -3    1    1    0.0556   -0.2266    0.0560   -0.2234    0.0032    1          0.0648          0.0654
    6    4   -2   -2   -0.1060    0.1128   -0.1085    0.1216    0.0091    1          0.0779          0.0778
    7   -4    2    0    0.1208   -0.5970    0.1201   -0.5973    0.0008    1          0.1326          0.1302
    8   -5    3    1    0.1408   -0.2241    0.1454   -0.2240    0.0046    1          0.1044          0.1017
    9    3   -3   -1   -0.1920    0.0433   -0.1952    0.0486    0.0062    1          0.0786          0.0726
   10   -2    2    0    0.2222   -0.1348    0.2251   -0.1274    0.0079    1          0.0467          0.0467
   11   -3    3   -1    0.5295   -0.6124    0.5303   -0.6130    0.0011    1          0.1248          0.1248
   12    2   -4    0   -0.1792   -0.0425   -0.1829   -0.0381    0.0057    1          0.1005          0.0984
   13   -3    5   -1    0.1981   -0.0180    0.1990   -0.0092    0.0089    1          0.1017          0.0927
   14   -3    5   -2    0.6012   -0.1416    0.5293   -0.1451    0.0720    1          0.1320          0.1473
   15    0   -2    0   -0.3366   -0.2401   -0.3362   -0.2357    0.0044    1          0.0874          0.0881
   16   -1    3   -1    0.1288    0.0274    0.1275    0.0362    0.0089    1          0.0627          0.0679
   17   -2    4   -2    0.7228   -0.0922    0.7293   -0.0807    0.0132    1          0.1163          0.1198
   18   -3    5   -3    1.0463   -0.5126    1.0696   -0.4972    0.0279    1          0.2536          0.2483
   19    3    2   -3    0.0233    0.0482    0.0442    0.0295    0.0280    1          0.1000          0.0994
   20   -1    5   -3    0.4463    0.1538    0.4423    0.1634    0.0104    1          0.1200          0.1178
   21   -1   -1    1   -0.0318   -0.0617   -0.0341   -0.0579    0.0044    1          0.0435          0.0568
   22    1    3   -3    0.3020    0.3265    0.3053    0.3413    0.0152    1          0.0910          0.0899
   23    3    1   -3    0.0359    0.2669    0.0347    0.2716    0.0049    1          0.0815          0.0816

###            No.127                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3258    1.3262    1.3197  117.4963  117.2720  116.6579      0.5736
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3355    1.3355    1.3355  117.2949  117.2949  117.2949      0.2850         1.0000    1.0000    4.6855    4.6855    4.6855
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0062    0.0062    0.0107    0.3271    0.3271    0.6833      0.0184         0.0127    0.0127    0.3036    0.3036    0.3052
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2122   -1.0336    1.1388)
 a2 = (   -0.9247   -1.0888    0.6148)
 a3 = (   -0.1796   -1.5106    0.3933)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2535   -1.0479    1.1617) (    0.0107    0.0053    0.0056)
 a2 = (   -0.9543   -1.0936    0.6368) (    0.0076    0.0061    0.0064)
 a3 = (   -0.2156   -1.5131    0.4195) (    0.0095    0.0073    0.0073)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  119.3419  122.7666   32.4891    0.4571    0.2564    0.3687
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0014    0.0026   -0.0015      0.0022    0.0021    0.0113

# Number of computed bands
            400            356
# Figure of merit at the beginning and the end of the refinement
         1.4014         3.6969
# Chi-squares at the beginning and the end of the refinement
    5.0005    0.2860
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0672    0.0702
    2    1    0   -2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1030    0.0995
    3    0   -1    2   -0.0240    0.0819   -0.0262    0.0895    0.0078    1    0.1004    0.0967
    4    3   -1   -3   -0.1906   -0.5809   -0.1957   -0.5833    0.0056    1    0.2115    0.1078
    5    1    1   -3    0.0557   -0.2242    0.0560   -0.2234    0.0009    1    0.1325    0.0654
    6    1   -3    3   -0.1023    0.1163   -0.1085    0.1216    0.0081    1    0.1568    0.0778
    7    3    1   -5    0.1165   -0.5908    0.1201   -0.5973    0.0075    1    0.2709    0.1302
    8    1    2   -4    0.1087   -0.2292    0.1454   -0.2240    0.0370    1    0.1701    0.1017
    9    1   -2    1   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0786    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0465    0.0467
   11    1    1   -2    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.1256    0.1248
   12    2   -3    0   -0.1463   -0.0746   -0.1829   -0.0381    0.0517    1    0.1356    0.0984
   13   -1    4   -2    0.1691    0.0162    0.1990   -0.0092    0.0392    1    0.1621    0.0927
   14    1    4   -4    0.6087   -0.1246    0.5293   -0.1451    0.0820    1    0.2641    0.1473
   15    3   -3   -1   -0.3339   -0.2416   -0.3362   -0.2357    0.0063    1    0.1790    0.0881
   16   -1    3   -1    0.1201    0.0364    0.1275    0.0362    0.0074    1    0.1258    0.0679
   17    1    3   -3    0.7302   -0.0692    0.7293   -0.0807    0.0116    1    0.2324    0.1198
   18    3    3   -5    1.0722   -0.5061    1.0696   -0.4972    0.0093    1    0.5220    0.2483
   19   -1    2    0    0.0373    0.0260    0.0442    0.0295    0.0077    1    0.0988    0.0994
   20    0    2   -1    0.4319    0.1725    0.4423    0.1634    0.0139    1    0.1190    0.1178
   21    1   -1   -1   -0.0359   -0.0630   -0.0341   -0.0579    0.0054    1    0.0896    0.0568
   22    0    1    0    0.2786    0.3281    0.3053    0.3413    0.0298    0    0.0909    0.0899
   23    0    0    1    0.0305    0.2568    0.0347    0.2716    0.0155    1    0.0827    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7457   -0.0512   -0.7310   -0.0567    0.0156    1          0.0668          0.0702
    2    2    1   -5    0.0185   -0.1985   -0.0130   -0.1762    0.0386    1          0.1138          0.0995
    3    1   -4    4   -0.0524    0.0517   -0.0262    0.0895    0.0460    1          0.0947          0.0967
    4    3   -1   -3   -0.1926   -0.5768   -0.1957   -0.5833    0.0073    1          0.1027          0.1078
    5    1    1   -3    0.0514   -0.2164    0.0560   -0.2234    0.0083    1          0.0646          0.0654
    6    1   -3    3   -0.1079    0.1259   -0.1085    0.1216    0.0043    1          0.0773          0.0778
    7    3    1   -5    0.1138   -0.5903    0.1201   -0.5973    0.0095    1          0.1312          0.1302
    8    1    3   -5    0.1373   -0.2185    0.1454   -0.2240    0.0098    1          0.1029          0.1017
    9    2   -4    2   -0.1992    0.0495   -0.1952    0.0486    0.0041    1          0.0775          0.0726
   10    0    2   -2    0.2241   -0.1291    0.2251   -0.1274    0.0019    1          0.0457          0.0467
   11    2    2   -4    0.5398   -0.6161    0.5303   -0.6130    0.0100    1          0.1238          0.1248
   12    3   -5    1   -0.1806   -0.0414   -0.1829   -0.0381    0.0041    1          0.0999          0.0984
   13   -1    5   -3    0.1987   -0.0086    0.1990   -0.0092    0.0006    1          0.1004          0.0927
   14    1    5   -5    0.5341   -0.1443    0.5293   -0.1451    0.0049    1          0.1489          0.1473
   15    3   -3   -1   -0.3300   -0.2384   -0.3362   -0.2357    0.0068    1          0.0875          0.0881
   16   -1    3   -1    0.1276    0.0354    0.1275    0.0362    0.0008    1          0.0627          0.0679
   17    1    3   -3    0.7316   -0.0649    0.7293   -0.0807    0.0160    1          0.1154          0.1198
   18    3    3   -5    1.0819   -0.4871    1.0696   -0.4972    0.0159    1          0.2545          0.2483
   19   -2    2    3    0.0180    0.0352    0.0442    0.0295    0.0267    1          0.1243          0.0994
   20    0    4   -2    0.4375    0.1711    0.4423    0.1634    0.0091    1          0.1202          0.1178
   21    1   -1   -1   -0.0283   -0.0529   -0.0341   -0.0579    0.0077    1          0.0444          0.0568
   22    0    2    0    0.2902    0.3285    0.3053    0.3413    0.0198    1          0.0925          0.0899
   23    0    0    2    0.0401    0.2696    0.0347    0.2716    0.0058    1          0.0834          0.0816

###            No.128                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3136    1.3155    1.3144  117.1602  116.9194  116.9545      0.3977
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3375    1.3375    1.3375  117.3203  117.3203  117.3203      0.2900         1.0000    1.0000    4.6113    4.6113    4.6113
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0064    0.0064    0.0110    0.3360    0.3360    0.7012      0.0186         0.0130    0.0130    0.2962    0.2962    0.2978
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2203    0.9933   -1.1539)
 a2 = (    0.1875    1.4740   -0.4028)
 a3 = (    0.9383    1.0490   -0.6259)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2604    1.0453   -1.1685) (    0.0086    0.0064    0.0061)
 a2 = (    0.2265    1.5133   -0.4295) (    0.0096    0.0022    0.0064)
 a3 = (    0.9610    1.0889   -0.6455) (    0.0110    0.0059    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -47.7613   83.2476   83.3908    0.3280    0.2506    0.3509
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0023    0.0100   -0.0083      0.0020    0.0022    0.0144

# Number of computed bands
            291            358
# Figure of merit at the beginning and the end of the refinement
         2.6490         3.5056
# Chi-squares at the beginning and the end of the refinement
    1.3998    0.7853
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0469    0.0702
    2   -1    2    0   -0.0140   -0.1771   -0.0130   -0.1762    0.0014    1    0.0702    0.0995
    3    0   -2    1   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.0685    0.0967
    4   -3    3    1   -0.1978   -0.5867   -0.1957   -0.5833    0.0039    1    0.1464    0.1078
    5   -1    3   -1    0.0566   -0.2260    0.0560   -0.2234    0.0027    1    0.0908    0.0654
    6   -1   -3    3   -0.1061    0.1185   -0.1085    0.1216    0.0039    1    0.1082    0.0778
    7   -3    5   -1    0.1183   -0.5973    0.1201   -0.5973    0.0018    1    0.1875    0.1302
    8   -1    4   -2    0.1106   -0.2302    0.1454   -0.2240    0.0354    1    0.1170    0.1017
    9   -1   -1    2   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0549    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0325    0.0467
   11   -1    2   -1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0877    0.1248
   12   -3   -1    5   -0.1835   -0.0378   -0.1829   -0.0381    0.0007    1    0.1415    0.0984
   13    1    2   -4    0.1712    0.0138    0.1990   -0.0092    0.0360    1    0.1132    0.0927
   14   -1    5   -5    0.5283   -0.1505    0.5293   -0.1451    0.0054    1    0.2107    0.1473
   15   -3    1    3   -0.3383   -0.2371   -0.3362   -0.2357    0.0025    1    0.1239    0.0881
   16    1    1   -3    0.1236    0.0349    0.1275    0.0362    0.0041    1    0.0876    0.0679
   17   -1    3   -3    0.7280   -0.0830    0.7293   -0.0807    0.0026    1    0.1624    0.1198
   18   -3    5   -3    1.0567   -0.5176    1.0696   -0.4972    0.0241    1    0.3593    0.2483
   19    1    0   -2    0.0409    0.0273    0.0442    0.0295    0.0040    1    0.0683    0.0994
   20    0    1   -2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0832    0.1178
   21   -1    1    1   -0.0359   -0.0606   -0.0341   -0.0579    0.0032    1    0.0612    0.0568
   22    0    0   -1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0630    0.0899
   23    0   -1    0    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0565    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    2   -0.7475   -0.0566   -0.7310   -0.0567    0.0164    1          0.0673          0.0702
    2   -2    5   -1    0.0175   -0.2008   -0.0130   -0.1762    0.0392    1          0.1148          0.0995
    3    0   -4    2   -0.0249    0.0939   -0.0262    0.0895    0.0046    1          0.1008          0.0967
    4   -3    3    1   -0.1936   -0.5782   -0.1957   -0.5833    0.0056    1          0.1029          0.1078
    5   -1    3   -1    0.0495   -0.2197    0.0560   -0.2234    0.0074    1          0.0651          0.0654
    6   -1   -3    3   -0.1091    0.1229   -0.1085    0.1216    0.0015    1          0.0781          0.0778
    7   -3    5   -1    0.1091   -0.5951    0.1201   -0.5973    0.0113    1          0.1316          0.1302
    8   -1    5   -3    0.1350   -0.2247    0.1454   -0.2240    0.0104    1          0.1037          0.1017
    9   -2   -2    4   -0.1992    0.0435   -0.1952    0.0486    0.0065    1          0.0782          0.0726
   10    0    2   -2    0.2246   -0.1385    0.2251   -0.1274    0.0111    1          0.0461          0.0467
   11   -2    4   -2    0.5359   -0.6297    0.5303   -0.6130    0.0176    1          0.1244          0.1248
   12   -3   -1    5   -0.1776   -0.0477   -0.1829   -0.0381    0.0109    1          0.1008          0.0984
   13    1    3   -5    0.2031   -0.0173    0.1990   -0.0092    0.0092    1          0.1014          0.0927
   14   -1    5   -5    0.5386   -0.1569    0.5293   -0.1451    0.0150    1          0.1504          0.1473
   15   -3    1    3   -0.3270   -0.2425   -0.3362   -0.2357    0.0115    1          0.0880          0.0881
   16    1    1   -3    0.1333    0.0287    0.1275    0.0362    0.0095    1          0.0635          0.0679
   17   -1    3   -3    0.7394   -0.0782    0.7293   -0.0807    0.0104    1          0.1169          0.1198
   18   -3    5   -3    1.0856   -0.5081    1.0696   -0.4972    0.0194    1          0.2570          0.2483
   19    2   -3   -2    0.0221    0.0339    0.0442    0.0295    0.0225    1          0.1260          0.0994
   20    0    2   -4    0.4465    0.1640    0.4423    0.1634    0.0042    1          0.1220          0.1178
   21   -1    1    1   -0.0243   -0.0547   -0.0341   -0.0579    0.0103    1          0.0450          0.0568
   22    0    0   -2    0.2989    0.3260    0.3053    0.3413    0.0166    1          0.0941          0.0899
   23    0   -2    0    0.0442    0.2699    0.0347    0.2716    0.0097    1          0.0848          0.0816

###            No.129                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3106    1.3068    1.3295  117.7528  117.4577  115.8670      0.5657
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3362    1.3362    1.3362  117.3044  117.3044  117.3044      0.2870         1.0000    1.0000    4.6559    4.6559    4.6559
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0065    0.0065    0.0112    0.3409    0.3409    0.7118      0.0184         0.0132    0.0132    0.3002    0.3002    0.3018
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1873   -1.4672    0.4197)
 a2 = (   -0.2299   -0.9776    1.1757)
 a3 = (   -0.9342   -1.0444    0.6417)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2235   -1.5120    0.4254) (    0.0096    0.0023    0.0069)
 a2 = (   -0.2567   -1.0448    1.1660) (    0.0085    0.0064    0.0061)
 a3 = (   -0.9588   -1.0880    0.6434) (    0.0112    0.0059    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   15.6621   96.6440  -96.5515    0.2599    0.2453    0.3506
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0015    0.0097   -0.0097      0.0021    0.0021    0.0148

# Number of computed bands
            219            363
# Figure of merit at the beginning and the end of the refinement
         1.7722         3.4828
# Chi-squares at the beginning and the end of the refinement
    3.8954    0.6585
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7514   -0.0713   -0.7310   -0.0567    0.0251    1    0.0676    0.0702
    2   -2    1    0   -0.0126   -0.1709   -0.0130   -0.1762    0.0053    1    0.0997    0.0995
    3    2    0   -1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0973    0.0967
    4   -3    3   -1   -0.1883   -0.5867   -0.1957   -0.5833    0.0082    1    0.2089    0.1078
    5   -3    1    1    0.0558   -0.2205    0.0560   -0.2234    0.0029    1    0.1289    0.0654
    6    3    1   -3   -0.1128    0.1260   -0.1085    0.1216    0.0061    1    0.1532    0.0778
    7   -5    3    1    0.1210   -0.5916    0.1201   -0.5973    0.0058    1    0.2677    0.1302
    8   -4    1    2    0.1088   -0.2261    0.1454   -0.2240    0.0367    1    0.1662    0.1017
    9    1    1   -2   -0.2028    0.0497   -0.1952    0.0486    0.0077    1    0.0775    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0460    0.0467
   11   -2    1    1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1252    0.1248
   12    0    2   -3   -0.1452   -0.0730   -0.1829   -0.0381    0.0514    1    0.1328    0.0984
   13   -2   -1    4    0.1749    0.0148    0.1990   -0.0092    0.0340    1    0.1603    0.0927
   14   -4    1    4    0.6113   -0.1356    0.5293   -0.1451    0.0826    1    0.2651    0.1473
   15   -1    3   -3   -0.3369   -0.2443   -0.3362   -0.2357    0.0086    1    0.1761    0.0881
   16   -1   -1    3    0.1276    0.0368    0.1275    0.0362    0.0007    1    0.1241    0.0679
   17   -3    1    3    0.7353   -0.0866    0.7293   -0.0807    0.0083    1    0.2342    0.1198
   18   -5    3    3    1.0523   -0.5230    1.0696   -0.4972    0.0311    1    0.5207    0.2483
   19    0   -1    2    0.0450    0.0305    0.0442    0.0295    0.0013    1    0.0967    0.0994
   20   -1    0    2    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1193    0.1178
   21   -1    1   -1   -0.0324   -0.0557   -0.0341   -0.0579    0.0028    1    0.0868    0.0568
   22    0    0    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0907    0.0899
   23    1    0    0    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0808    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2   -2   -0.7473   -0.0558   -0.7310   -0.0567    0.0163    1          0.0664          0.0702
    2   -5    2    1    0.0172   -0.2039   -0.0130   -0.1762    0.0410    1          0.1136          0.0995
    3    4    0   -2   -0.0252    0.0914   -0.0262    0.0895    0.0022    1          0.0995          0.0967
    4   -3    3   -1   -0.1959   -0.5817   -0.1957   -0.5833    0.0017    1          0.1020          0.1078
    5   -3    1    1    0.0498   -0.2228    0.0560   -0.2234    0.0062    1          0.0645          0.0654
    6    3    1   -3   -0.1084    0.1210   -0.1085    0.1216    0.0006    1          0.0771          0.0778
    7   -5    3    1    0.1095   -0.5993    0.1201   -0.5973    0.0108    1          0.1305          0.1302
    8   -5    1    3    0.1363   -0.2271    0.1454   -0.2240    0.0096    1          0.1026          0.1017
    9    2    2   -4   -0.1984    0.0433   -0.1952    0.0486    0.0062    1          0.0773          0.0726
   10   -2    0    2    0.2262   -0.1392    0.2251   -0.1274    0.0119    1          0.0456          0.0467
   11   -4    2    2    0.5386   -0.6326    0.5303   -0.6130    0.0213    1          0.1235          0.1248
   12    1    3   -5   -0.1783   -0.0472   -0.1829   -0.0381    0.0102    1          0.0996          0.0984
   13   -3   -1    5    0.2036   -0.0170    0.1990   -0.0092    0.0091    1          0.1003          0.0927
   14   -5    1    5    0.5404   -0.1570    0.5293   -0.1451    0.0163    1          0.1490          0.1473
   15   -1    3   -3   -0.3293   -0.2428   -0.3362   -0.2357    0.0099    1          0.0871          0.0881
   16   -1   -1    3    0.1328    0.0291    0.1275    0.0362    0.0089    1          0.0627          0.0679
   17   -3    1    3    0.7415   -0.0779    0.7293   -0.0807    0.0125    1          0.1157          0.1198
   18   -5    3    3    1.0900   -0.5097    1.0696   -0.4972    0.0239    1          0.2551          0.2483
   19    3   -2    2    0.0204    0.0323    0.0442    0.0295    0.0240    1          0.1243          0.0994
   20   -2    0    4    0.4466    0.1648    0.4423    0.1634    0.0044    1          0.1205          0.1178
   21   -1    1   -1   -0.0262   -0.0563   -0.0341   -0.0579    0.0081    1          0.0444          0.0568
   22    0    0    2    0.2977    0.3264    0.3053    0.3413    0.0167    1          0.0928          0.0899
   23    2    0    0    0.0426    0.2684    0.0347    0.2716    0.0086    1          0.0835          0.0816

###            No.130                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3159    1.3238    1.2981  117.1560  116.1772  117.6145      0.5799
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3309    1.3309    1.3309  117.2357  117.2357  117.2357      0.2771         1.0000    1.0000    4.8037    4.8037    4.8037
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0106    0.0106    0.0182    0.5553    0.5553    1.1623      0.0217         0.0217    0.0217    0.3787    0.3787    0.3824
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9183   -1.0428    0.6381)
 a2 = (   -0.1720   -1.4653    0.4163)
 a3 = (   -0.1934   -0.9866    1.1711)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9406   -1.0905    0.6374) (    0.0134    0.0093    0.0090)
 a2 = (   -0.1954   -1.5052    0.4198) (    0.0110    0.0028    0.0082)
 a3 = (   -0.2367   -1.0353    1.1629) (    0.0145    0.0062    0.0142)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  109.0389   25.3510  118.3224    0.8198    0.4349    0.6669
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0083    0.0032    0.0009      0.0023    0.0021    0.0225

# Number of computed bands
            171            331
# Figure of merit at the beginning and the end of the refinement
         1.8792         3.4567
# Chi-squares at the beginning and the end of the refinement
    4.9623    0.9672
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0691    0.0702
    2    0   -2    1   -0.0134   -0.1731   -0.0130   -0.1762    0.0031    1    0.1017    0.0995
    3   -1    2    0   -0.0287    0.0943   -0.0262    0.0895    0.0054    1    0.0998    0.0967
    4   -1   -3    3   -0.2021   -0.5865   -0.1957   -0.5833    0.0071    1    0.2139    0.1078
    5    1   -3    1    0.0561   -0.2227    0.0560   -0.2234    0.0007    1    0.1316    0.0654
    6   -3    3    1   -0.1116    0.1230   -0.1085    0.1216    0.0035    1    0.1584    0.0778
    7    1   -5    3    0.1154   -0.6007    0.1201   -0.5973    0.0058    1    0.2739    0.1302
    8    2   -4    1    0.1096   -0.2277    0.1454   -0.2240    0.0360    1    0.1698    0.1017
    9   -2    1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0804    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0471    0.0467
   11    1   -2    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1287    0.1248
   12   -3    0    2   -0.1460   -0.0712   -0.1829   -0.0381    0.0496    1    0.1368    0.0984
   13    4   -2   -1    0.1738    0.0141    0.1990   -0.0092    0.0342    1    0.1644    0.0927
   14    4   -4    1    0.6174   -0.1366    0.5293   -0.1451    0.0885    1    0.2708    0.1473
   15   -3   -1    3   -0.3395   -0.2364   -0.3362   -0.2357    0.0033    1    0.1812    0.0881
   16    3   -1   -1    0.1267    0.0359    0.1275    0.0362    0.0009    1    0.1272    0.0679
   17    3   -3    1    0.7452   -0.0860    0.7293   -0.0807    0.0167    1    0.2397    0.1198
   18    3   -4    2    0.9638   -0.2983    1.0696   -0.4972    0.2252    1    0.3714    0.2483
   19    2    0   -1    0.0442    0.0295    0.0442    0.0295    0.0000    1    0.0990    0.0994
   20    2   -1    0    0.4536    0.1691    0.4423    0.1634    0.0126    1    0.1215    0.1178
   21   -1   -1    1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0886    0.0568
   22    1    0    0    0.3035    0.3447    0.3053    0.3413    0.0038    1    0.0923    0.0899
   23    0    1    0    0.0329    0.2802    0.0347    0.2716    0.0088    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    2   -0.7330   -0.0613   -0.7310   -0.0567    0.0051    1          0.0652          0.0702
    2    1   -5    2    0.0279   -0.1990   -0.0130   -0.1762    0.0469    1          0.1108          0.0995
    3   -4    4    1   -0.0460    0.0500   -0.0262    0.0895    0.0441    1          0.0925          0.0967
    4   -1   -3    3   -0.1794   -0.5780   -0.1957   -0.5833    0.0171    1          0.1001          0.1078
    5    1   -3    1    0.0610   -0.2163    0.0560   -0.2234    0.0087    1          0.0630          0.0654
    6   -3    3    1   -0.1026    0.1232   -0.1085    0.1216    0.0061    1          0.0753          0.0778
    7    1   -5    3    0.1265   -0.5875    0.1201   -0.5973    0.0117    1          0.1280          0.1302
    8    3   -5    1    0.1464   -0.2168    0.1454   -0.2240    0.0072    1          0.1004          0.1017
    9   -4    2    2   -0.1917    0.0464   -0.1952    0.0486    0.0041    1          0.0758          0.0726
   10    2   -2    0    0.2310   -0.1272    0.2251   -0.1274    0.0059    1          0.0447          0.0467
   11    2   -4    2    0.5470   -0.6092    0.5303   -0.6130    0.0171    1          0.1206          0.1248
   12   -5    1    3   -0.1726   -0.0433   -0.1829   -0.0381    0.0115    1          0.0976          0.0984
   13    5   -3   -1    0.2051   -0.0082    0.1990   -0.0092    0.0062    1          0.0980          0.0927
   14    5   -5    1    0.5393   -0.1424    0.5293   -0.1451    0.0104    1          0.1453          0.1473
   15   -3   -1    3   -0.3203   -0.2412   -0.3362   -0.2357    0.0169    1          0.0854          0.0881
   16    3   -1   -1    0.1343    0.0353    0.1275    0.0362    0.0068    1          0.0611          0.0679
   17    3   -3    1    0.7369   -0.0648    0.7293   -0.0807    0.0176    1          0.1126          0.1198
   18    3   -5    3    1.0824   -0.4861    1.0696   -0.4972    0.0169    1          0.2476          0.2483
   19    2    3   -2    0.0247    0.0348    0.0442    0.0295    0.0202    1          0.1205          0.0994
   20    4   -2    0    0.4449    0.1718    0.4423    0.1634    0.0088    1          0.1170          0.1178
   21   -1   -1    1   -0.0210   -0.0540   -0.0341   -0.0579    0.0138    1          0.0431          0.0568
   22    2    0    0    0.2971    0.3317    0.3053    0.3413    0.0126    1          0.0898          0.0899
   23    0    2    0    0.0439    0.2709    0.0347    0.2716    0.0092    1          0.0808          0.0816

###            No.131                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3373    1.3164    1.3292  117.1842  118.2551  116.1346      0.5445
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3449    1.3449    1.3449  117.4113  117.4113  117.4113      0.2868         1.0000    1.0000    4.6890    4.6890    4.6890
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0063    0.0063    0.0109    0.3329    0.3329    0.6925      0.0186         0.0128    0.0128    0.3056    0.3056    0.3072
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9037    1.1043   -0.6217)
 a2 = (    0.1896    1.0490   -1.1468)
 a3 = (    0.1685    1.5206   -0.3970)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9722    1.1044   -0.6427) (    0.0075    0.0061    0.0065)
 a2 = (    0.2788    1.0668   -1.1671) (    0.0109    0.0053    0.0056)
 a3 = (    0.2423    1.5278   -0.4300) (    0.0095    0.0072    0.0073)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -151.5476   57.1633 -147.7313    0.3092    0.2584    0.3706
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0023    0.0104   -0.0003      0.0021    0.0021    0.0113

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.4609         3.3178
# Chi-squares at the beginning and the end of the refinement
    4.4759    0.8948
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0639    0.0702
    2    0   -1    2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.0979    0.0995
    3    1    0   -2   -0.0240    0.0819   -0.0262    0.0895    0.0078    1    0.0955    0.0967
    4    1   -3    3   -0.1940   -0.5815   -0.1957   -0.5833    0.0025    1    0.2014    0.1078
    5   -1   -1    3    0.0553   -0.2263    0.0560   -0.2234    0.0031    1    0.1258    0.0654
    6    3   -1   -3   -0.1020    0.1162   -0.1085    0.1216    0.0084    1    0.1485    0.0778
    7   -1   -3    5    0.1125   -0.5987    0.1201   -0.5973    0.0077    1    0.2580    0.1302
    8   -2   -1    4    0.1091   -0.2329    0.1454   -0.2240    0.0374    1    0.1611    0.1017
    9    2   -1   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0742    0.0726
   10   -1    0    1    0.2314   -0.1310    0.2251   -0.1274    0.0073    1    0.0438    0.0467
   11   -1   -1    2    0.5419   -0.6361    0.5303   -0.6130    0.0258    1    0.1209    0.1248
   12    3   -2    0   -0.1446   -0.0753   -0.1829   -0.0381    0.0534    1    0.1282    0.0984
   13   -4    1    2    0.1748    0.0185    0.1990   -0.0092    0.0367    1    0.1525    0.0927
   14   -5   -1    5    0.5482   -0.1464    0.5293   -0.1451    0.0189    1    0.2872    0.1473
   15    3   -3    1   -0.3327   -0.2429   -0.3362   -0.2357    0.0080    1    0.1699    0.0881
   16   -3    1    1    0.1241    0.0392    0.1275    0.0362    0.0046    1    0.1186    0.0679
   17   -3   -1    3    0.7550   -0.0630    0.7293   -0.0807    0.0312    0    0.2232    0.1198
   18   -3   -2    4    0.9877   -0.2744    1.0696   -0.4972    0.2373    0    0.3483    0.2483
   19   -2    1    0    0.0394    0.0282    0.0442    0.0295    0.0049    1    0.0935    0.0994
   20   -2    0    1    0.4390    0.1843    0.4423    0.1634    0.0212    1    0.1131    0.1178
   21    1   -1    1   -0.0347   -0.0619   -0.0341   -0.0579    0.0040    1    0.0852    0.0568
   22   -1    0    0    0.2759    0.3372    0.3053    0.3413    0.0297    0    0.0867    0.0899
   23    0    0   -1    0.0286    0.2579    0.0347    0.2716    0.0150    1    0.0790    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7519   -0.0513   -0.7310   -0.0567    0.0216    1          0.0673          0.0702
    2   -1   -2    5    0.0158   -0.1974   -0.0130   -0.1762    0.0358    1          0.1146          0.0995
    3    2    0   -4   -0.0239    0.0944   -0.0262    0.0895    0.0055    1          0.1009          0.0967
    4    1   -3    3   -0.1930   -0.5735   -0.1957   -0.5833    0.0102    1          0.1024          0.1078
    5   -1   -1    3    0.0470   -0.2163    0.0560   -0.2234    0.0114    1          0.0649          0.0654
    6    3   -1   -3   -0.1086    0.1253   -0.1085    0.1216    0.0037    1          0.0778          0.0778
    7   -1   -3    5    0.1061   -0.5901    0.1201   -0.5973    0.0158    1          0.1306          0.1302
    8   -3   -1    5    0.1312   -0.2221    0.1454   -0.2240    0.0143    1          0.1029          0.1017
    9    4   -2   -2   -0.2017    0.0449   -0.1952    0.0486    0.0075    1          0.0776          0.0726
   10   -2    0    2    0.2205   -0.1370    0.2251   -0.1274    0.0106    1          0.0456          0.0467
   11   -2   -2    4    0.5340   -0.6241    0.5303   -0.6130    0.0117    1          0.1233          0.1248
   12    5   -3   -1   -0.1795   -0.0486   -0.1829   -0.0381    0.0111    1          0.1003          0.0984
   13   -5    1    3    0.1984   -0.0170    0.1990   -0.0092    0.0078    1          0.1006          0.0927
   14   -5   -1    5    0.5325   -0.1522    0.5293   -0.1451    0.0078    1          0.1490          0.1473
   15    3   -3    1   -0.3261   -0.2425   -0.3362   -0.2357    0.0121    1          0.0877          0.0881
   16   -3    1    1    0.1292    0.0276    0.1275    0.0362    0.0087    1          0.0632          0.0679
   17   -3   -1    3    0.7290   -0.0704    0.7293   -0.0807    0.0104    1          0.1157          0.1198
   18   -3   -3    5    1.0816   -0.4885    1.0696   -0.4972    0.0148    1          0.2546          0.2483
   19   -2    2   -3    0.0218    0.0325    0.0442    0.0295    0.0225    1          0.1266          0.0994
   20   -4    0    2    0.4357    0.1630    0.4423    0.1634    0.0066    1          0.1215          0.1178
   21    1   -1    1   -0.0242   -0.0549   -0.0341   -0.0579    0.0104    1          0.0451          0.0568
   22   -2    0    0    0.2911    0.3176    0.3053    0.3413    0.0277    0          0.0943          0.0899
   23    0    0   -2    0.0459    0.2642    0.0347    0.2716    0.0135    1          0.0853          0.0816

###            No.132                ###
# Bravais type
        Trigonal
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3190    1.2898    1.3341  117.3919  118.1707  115.4496      0.4546
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3068    1.3068    1.3068  116.8989  116.8989  116.8989      0.2746         1.0000    1.0000    4.7598    4.7598    4.7598
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0055    0.0055    0.0093    0.2811    0.2811    0.5962      0.0178         0.0114    0.0114    0.3092    0.3092    0.3104
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.4445   -0.3821    0.3187)
 a2 = (    0.9520   -0.6751    1.0218)
 a3 = (    0.9992   -1.1375    0.2597)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.4463   -0.3716    0.2997) (    0.0029    0.0089    0.0066)
 a2 = (    0.9502   -0.6615    0.9896) (    0.0084    0.0078    0.0064)
 a3 = (    0.9850   -1.1388    0.2298) (    0.0078    0.0080    0.0073)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   12.8169  117.5157   -8.4083    0.2868    0.2641    0.3358
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0053   -0.0017    0.0246      0.0021    0.0022    0.0114

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.8933         3.3129
# Chi-squares at the beginning and the end of the refinement
    1.8010    0.3938
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7709   -0.0443   -0.7310   -0.0567    0.0418    0    0.1104    0.0702
    2    2    1   -4    0.0100   -0.1989   -0.0130   -0.1762    0.0323    1    0.1292    0.0995
    3   -1    0    2   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0783    0.0967
    4    1    1   -2   -0.1991   -0.6091   -0.1957   -0.5833    0.0260    1    0.0839    0.1078
    5    1    1   -3    0.0571   -0.2237    0.0560   -0.2234    0.0012    1    0.1027    0.0654
    6    0    0    1   -0.1132    0.1289   -0.1085    0.1216    0.0087    1    0.0618    0.0778
    7    1    3   -5    0.1290   -0.6084    0.1201   -0.5973    0.0142    1    0.2150    0.1302
    8    0    1   -2    0.1438   -0.2199    0.1454   -0.2240    0.0044    1    0.0826    0.1017
    9    1    0    0   -0.2062    0.0545   -0.1952    0.0486    0.0125    1    0.0624    0.0726
   10   -1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0738    0.0467
   11   -1    3   -3    0.5527   -0.6165    0.5303   -0.6130    0.0226    1    0.2039    0.1248
   12    2    0   -1   -0.1923   -0.0380   -0.1829   -0.0381    0.0095    1    0.0797    0.0984
   13   -2    1    0    0.1981   -0.0091    0.1990   -0.0092    0.0009    1    0.0803    0.0927
   14   -2    2   -1    0.5364   -0.1491    0.5293   -0.1451    0.0081    1    0.1208    0.1473
   15    3    1   -3   -0.3531   -0.2456   -0.3362   -0.2357    0.0196    1    0.1407    0.0881
   16   -3    1    1    0.1267    0.0354    0.1275    0.0362    0.0011    1    0.0992    0.0679
   17   -3    3   -1    0.7388   -0.0771    0.7293   -0.0807    0.0101    1    0.1887    0.1198
   18   -3    5   -3    1.0828   -0.4983    1.0696   -0.4972    0.0133    1    0.4223    0.2483
   19   -4    1    2    0.0752    0.0378    0.0442    0.0295    0.0321    1    0.1251    0.0994
   20   -5    3    1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1928    0.1178
   21    2    0   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0690    0.0568
   22   -2    1    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0731    0.0899
   23   -3    1    3    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.1305    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7228   -0.0528   -0.7310   -0.0567    0.0091    1          0.0667          0.0702
    2    3    1   -5   -0.0117   -0.1809   -0.0130   -0.1762    0.0049    1          0.1003          0.0995
    3   -1    0    3   -0.0444    0.1019   -0.0262    0.0895    0.0221    1          0.0838          0.0967
    4    2    2   -4   -0.1942   -0.5803   -0.1957   -0.5833    0.0034    1          0.1052          0.1078
    5    1    1   -3    0.0598   -0.2311    0.0560   -0.2234    0.0086    1          0.0646          0.0654
    6    1    0    2   -0.1301    0.1066   -0.1085    0.1216    0.0263    1          0.1095          0.0778
    7    1    3   -5    0.1178   -0.5966    0.1201   -0.5973    0.0024    1          0.1347          0.1302
    8    1    2   -5    0.0994   -0.2368    0.1454   -0.2240    0.0478    1          0.1150          0.1017
    9    2    0    0   -0.1843    0.0504   -0.1952    0.0486    0.0110    1          0.0766          0.0726
   10   -1    1   -1    0.2334   -0.1291    0.2251   -0.1274    0.0084    1          0.0458          0.0467
   11   -1    3   -3    0.5347   -0.6139    0.5303   -0.6130    0.0045    1          0.1268          0.1248
   12    5    0   -3   -0.1576   -0.0577   -0.1829   -0.0381    0.0320    1          0.1154          0.0984
   13   -4    2    0    0.2009   -0.0065    0.1990   -0.0092    0.0032    1          0.0998          0.0927
   14   -4    4   -2    0.5306   -0.1468    0.5293   -0.1451    0.0021    1          0.1498          0.1473
   15    3    1   -3   -0.3303   -0.2340   -0.3362   -0.2357    0.0062    1          0.0881          0.0881
   16   -3    1    1    0.1255    0.0360    0.1275    0.0362    0.0020    1          0.0619          0.0679
   17   -3    3   -1    0.7224   -0.0763    0.7293   -0.0807    0.0083    1          0.1158          0.1198
   18   -3    5   -3    1.0517   -0.5017    1.0696   -0.4972    0.0184    1          0.2576          0.2483
   19   -5    1    3    0.0419    0.0261    0.0442    0.0295    0.0041    1          0.0970          0.0994
   20   -5    3    1    0.4340    0.1615    0.4423    0.1634    0.0085    1          0.1182          0.1178
   21    3    0   -3   -0.0340   -0.0636   -0.0341   -0.0579    0.0057    1          0.0655          0.0568
   22   -4    2    2    0.2899    0.3159    0.3053    0.3413    0.0297    0          0.0894          0.0899
   23   -3    1    3    0.0421    0.2530    0.0347    0.2716    0.0200    0          0.0799          0.0816

###                                ###
### Candidates for   Tetragonal(I) ###
###                                ###

###            No.1                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2599    1.2621    1.2578   90.0519   89.4779   90.1363      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2610    1.2610    1.2579   90.0000   90.0000   90.0000      0.4475         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0471    0.0000    0.0000    0.0000      0.0335         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7570   -0.2147    0.1043)
 a2 = (   -0.1895    0.7481    0.1794)
 a3 = (   -0.1406    0.1494   -0.7682)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7562   -0.2157    0.1026) (    0.0015    0.0044    0.0041)
 a2 = (   -0.1896    0.7492    0.1780) (    0.0042    0.0015    0.0050)
 a3 = (   -0.1457    0.1455   -0.7679) (    0.0095    0.0089    0.0276)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   29.9752  164.9853 -134.9558    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
             91             57
# Figure of merit at the beginning and the end of the refinement
         7.8810        33.6588
# Chi-squares at the beginning and the end of the refinement
    0.1734    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2   -1    3    0   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3    0   -3   -1   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4   -1    2   -1   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5    0    2    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6   -1   -2   -1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7    0    3   -1    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8    1    3    0    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9   -2   -1   -1   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10    1    1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11    1    2   -1    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12   -3    0   -1   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13    3    1    0    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14    3    2   -1    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15   -2    1   -1   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17    2    1   -1    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18    2    2   -2    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19    3   -1    0    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20    3    0   -1    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22    2   -1   -1    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23    1   -2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2   -1    3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0   -3   -1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -1    2   -1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0    2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1   -2   -1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0    3   -1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8    1    3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9   -2   -1   -1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    1    2   -1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12   -3    0   -1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    3    1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14    3    2   -1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -2    1   -1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    2    1   -1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18    2    2   -2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    3   -1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    3    0   -1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1    1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    2   -1   -1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23    1   -2   -1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.2                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2655    1.2663    1.2482   90.3198   90.9100   89.9930      0.4717
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2610    1.2610    1.2579   90.0000   90.0000   90.0000      0.4475         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0471    0.0000    0.0000    0.0000      0.0335         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7537    0.2138   -0.1038)
 a2 = (   -0.1876    0.7467    0.1760)
 a3 = (    0.1589   -0.1376    0.7732)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7562    0.2157   -0.1026) (    0.0015    0.0044    0.0041)
 a2 = (   -0.1896    0.7492    0.1780) (    0.0042    0.0015    0.0050)
 a3 = (    0.1457   -0.1455    0.7679) (    0.0095    0.0089    0.0276)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -29.9752   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
             65             57
# Figure of merit at the beginning and the end of the refinement
        15.9837        33.6588
# Chi-squares at the beginning and the end of the refinement
    0.0788    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7284   -0.0608   -0.7310   -0.0567    0.0049    1    0.0705    0.0702
    2    1    3    0   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1043    0.0995
    3    0   -3    1   -0.0287    0.0945   -0.0262    0.0895    0.0056    1    0.1023    0.0967
    4    1    2    1   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1090    0.1078
    5    0    2    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0674    0.0654
    6    1   -2    1   -0.1115    0.1227   -0.1085    0.1216    0.0032    1    0.0809    0.0778
    7    0    3    1    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1393    0.1302
    8   -1    3    0    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1082    0.1017
    9    2   -1    1   -0.1981    0.0488   -0.1952    0.0486    0.0029    1    0.0823    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0483    0.0467
   11   -1    2    1    0.5310   -0.6252    0.5303   -0.6130    0.0122    1    0.1316    0.1248
   12    3    0    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1056    0.0984
   13   -3    1    0    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1054    0.0927
   14   -3    2    1    0.5354   -0.1544    0.5293   -0.1451    0.0111    1    0.1571    0.1473
   15    2    1    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0652    0.0679
   17   -2    1    1    0.7427   -0.0878    0.7293   -0.0807    0.0151    1    0.1222    0.1198
   18   -2    2    2    1.0721   -0.5417    1.0696   -0.4972    0.0446    1    0.2728    0.2483
   19   -3   -1    0    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1017    0.0994
   20   -3    0    1    0.4537    0.1681    0.4423    0.1634    0.0123    1    0.1247    0.1178
   21    1    1    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0455    0.0568
   22   -2   -1    1    0.3045    0.3441    0.3053    0.3413    0.0029    1    0.0947    0.0899
   23   -1   -2    1    0.0334    0.2807    0.0347    0.2716    0.0091    1    0.0845    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2    1    3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0   -3    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4    1    2    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0    2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1   -2    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0    3    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8   -1    3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9    2   -1    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10   -1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -1    2    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    3    0    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13   -3    1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14   -3    2    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2    1    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17   -2    1    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -2    2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19   -3   -1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20   -3    0    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1    1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -2   -1    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23   -1   -2    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.3                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2671    1.2670    1.2460   90.0137   89.0386   89.9144      0.4564
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2610    1.2610    1.2579   90.0000   90.0000   90.0000      0.4475         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0471    0.0000    0.0000    0.0000      0.0335         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7528    0.2141   -0.1022)
 a2 = (    0.1869   -0.7461   -0.1771)
 a3 = (   -0.1599    0.1433   -0.7734)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7562    0.2157   -0.1026) (    0.0015    0.0044    0.0041)
 a2 = (    0.1896   -0.7492   -0.1780) (    0.0042    0.0015    0.0050)
 a3 = (   -0.1457    0.1455   -0.7679) (    0.0095    0.0089    0.0276)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -150.0248  164.9853 -134.9558    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
             57             57
# Figure of merit at the beginning and the end of the refinement
        19.8589        33.6588
# Chi-squares at the beginning and the end of the refinement
    0.0719    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    1   -3    0   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    0    3   -1   -0.0282    0.0931   -0.0262    0.0895    0.0042    1    0.0990    0.0967
    4    1   -2   -1   -0.2022   -0.5864   -0.1957   -0.5833    0.0072    1    0.1057    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    1    2   -1   -0.1110    0.1226   -0.1085    0.1216    0.0027    1    0.0783    0.0778
    7    0   -3   -1    0.1149   -0.6008    0.1201   -0.5973    0.0063    1    0.1350    0.1302
    8   -1   -3    0    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    2    1   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1   -2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    3    0   -1   -0.1851   -0.0382   -0.1829   -0.0381    0.0023    1    0.1022    0.0984
   13   -3   -1    0    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14   -3   -2   -1    0.5363   -0.1533    0.5293   -0.1451    0.0108    1    0.1517    0.1473
   15    2   -1   -1   -0.3395   -0.2367   -0.3362   -0.2357    0.0035    1    0.0897    0.0881
   16   -2    0    0    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17   -2   -1   -1    0.7439   -0.0847    0.7293   -0.0807    0.0151    1    0.1181    0.1198
   18   -2   -2   -2    1.0814   -0.5390    1.0696   -0.4972    0.0434    1    0.2650    0.2483
   19   -3    1    0    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -3    0   -1    0.4514    0.1690    0.4423    0.1634    0.0106    1    0.1204    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -2    1   -1    0.3014    0.3427    0.3053    0.3413    0.0041    1    0.0914    0.0899
   23   -1    2   -1    0.0329    0.2780    0.0347    0.2716    0.0066    1    0.0818    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2    1   -3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0    3   -1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4    1   -2   -1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0   -2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    2   -1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0   -3   -1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8   -1   -3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9    2    1   -1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10   -1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -1   -2   -1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    3    0   -1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13   -3   -1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14   -3   -2   -1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2   -1   -1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17   -2   -1   -1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -2   -2   -2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19   -3    1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20   -3    0   -1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1   -1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -2    1   -1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23   -1    2   -1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.8                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2677    1.2684    1.2439   90.0220   89.1120   89.9984      0.4773
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2609    1.2609    1.2579   90.0000   90.0000   90.0000      0.4475         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0471    0.0000    0.0000    0.0000      0.0335         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7524   -0.2134    0.1036)
 a2 = (    0.1873   -0.7454   -0.1757)
 a3 = (    0.1603   -0.1427    0.7748)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7562   -0.2157    0.1026) (    0.0015    0.0044    0.0041)
 a2 = (    0.1896   -0.7492   -0.1780) (    0.0042    0.0015    0.0050)
 a3 = (    0.1457   -0.1455    0.7679) (    0.0095    0.0089    0.0276)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  150.0248   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
             57             58
# Figure of merit at the beginning and the end of the refinement
        14.8418        33.4643
# Chi-squares at the beginning and the end of the refinement
    0.1097    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0716    0.0702
    2   -1   -3    0   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1054    0.0995
    3    0    3    1   -0.0290    0.0954   -0.0262    0.0895    0.0066    1    0.1036    0.0967
    4   -1   -2    1   -0.2017   -0.5853   -0.1957   -0.5833    0.0063    1    0.1103    0.1078
    5    0   -2    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0681    0.0654
    6   -1    2    1   -0.1121    0.1237   -0.1085    0.1216    0.0042    1    0.0819    0.0778
    7    0   -3    1    0.1150   -0.5998    0.1201   -0.5973    0.0057    1    0.1409    0.1302
    8    1   -3    0    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1094    0.1017
    9   -2    1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0833    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0488    0.0467
   11    1   -2    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1334    0.1248
   12   -3    0    1   -0.1841   -0.0379   -0.1829   -0.0381    0.0013    1    0.1067    0.0984
   13    3   -1    0    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1065    0.0927
   14    3   -2    1    0.5374   -0.1539    0.5293   -0.1451    0.0119    1    0.1589    0.1473
   15   -2   -1    1   -0.3386   -0.2359   -0.3362   -0.2357    0.0024    1    0.0936    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0659    0.0679
   17    2   -1    1    0.7460   -0.0857    0.7293   -0.0807    0.0174    1    0.1238    0.1198
   18    2   -2    2    1.0824   -0.5407    1.0696   -0.4972    0.0454    1    0.2780    0.2483
   19    3    1    0    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1027    0.0994
   20    3    0    1    0.4544    0.1697    0.4423    0.1634    0.0136    1    0.1262    0.1178
   21   -1   -1    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0459    0.0568
   22    2    1    1    0.3042    0.3456    0.3053    0.3413    0.0044    1    0.0959    0.0899
   23    1    2    1    0.0332    0.2815    0.0347    0.2716    0.0100    1    0.0857    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2   -1   -3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0    3    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -1   -2    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0   -2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1    2    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0   -3    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8    1   -3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9   -2    1    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    1   -2    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12   -3    0    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    3   -1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14    3   -2    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -2   -1    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    2   -1    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18    2   -2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    3    1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    3    0    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1   -1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    2    1    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23    1    2    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.17                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2709    1.2726    1.2366   90.3407   89.6312   89.9364      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2610    1.2610    1.2579   90.0000   90.0000   90.0000      0.4475         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0471    0.0000    0.0000    0.0000      0.0335         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1860    0.7426    0.1817)
 a2 = (   -0.7503   -0.2125    0.0967)
 a3 = (    0.1410   -0.1610    0.7798)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1896    0.7492    0.1780) (    0.0042    0.0015    0.0050)
 a2 = (   -0.7562   -0.2157    0.1026) (    0.0015    0.0044    0.0041)
 a3 = (    0.1457   -0.1455    0.7679) (    0.0095    0.0089    0.0276)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   60.0248   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
            400             62
# Figure of merit at the beginning and the end of the refinement
         6.3733        32.7285
# Chi-squares at the beginning and the end of the refinement
    0.1686    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2    3   -1    0   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3   -3    0    1   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    2   -1    1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5    2    0    0    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6   -2   -1    1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7    3    0    1    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8    3    1    0    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9   -1   -2    1   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    2    1    1    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    0   -3    1   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    1    3    0    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    2    3    1    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15    1   -2    1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0    2    0    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1    2    1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    2    2    2    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19   -1    3    0    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    0    3    1    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    1   -1    0   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22   -1    2    1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23   -2    1    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2    3   -1    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3   -3    0    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4    2   -1    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    2    0    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -2   -1    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    3    0    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8    3    1    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9   -1   -2    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    2    1    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    0   -3    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    1    3    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14    2    3    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1   -2    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0    2    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    1    2    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18    2    2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19   -1    3    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    0    3    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1   -1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1    2    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23   -2    1    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.18                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2515    1.2752    1.2539   89.0386   91.0908   91.2081      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2616    1.2616    1.2566   90.0000   90.0000   90.0000      0.4456         1.0040    1.0040    2.8313    2.8313    2.8201
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0475    0.0000    0.0000    0.0000      0.0339         0.0379    0.0379    0.2153    0.2153    0.2394
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1893    0.7556    0.1794)
 a2 = (    0.7445    0.2270   -0.0982)
 a3 = (   -0.1625    0.1567   -0.7651)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1895    0.7486    0.1787) (    0.0043    0.0015    0.0051)
 a2 = (    0.7558    0.2158   -0.1023) (    0.0016    0.0045    0.0042)
 a3 = (   -0.1459    0.1465   -0.7685) (    0.0097    0.0092    0.0279)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  119.7956  164.9394 -135.1280    0.9814    0.4205    1.0904
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0002    0.0045      0.0022    0.0022    0.0382

# Number of computed bands
            400             57
# Figure of merit at the beginning and the end of the refinement
         8.6014        32.6714
# Chi-squares at the beginning and the end of the refinement
    0.0443    0.0268
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    3    1    0   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3   -3    0   -1   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    2    1   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -2    1   -1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    3    0   -1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    3   -1    0    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9   -1    2   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    2   -1   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    0    3   -1   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    1   -3    0    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    2   -3   -1    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    1    2   -1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0   -2    0    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    1   -2   -1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    2   -2   -2    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19   -1   -3    0    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    0   -3   -1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    1    1    0   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22   -1   -2   -1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -2   -1   -1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7307   -0.0563   -0.7310   -0.0567    0.0005    1          0.0666          0.0702
    2    3    1    0   -0.0129   -0.1746   -0.0130   -0.1762    0.0016    1          0.0995          0.0995
    3   -3    0   -1   -0.0261    0.0885   -0.0262    0.0895    0.0009    1          0.0973          0.0967
    4    2    1   -1   -0.1949   -0.5855   -0.1957   -0.5833    0.0023    1          0.1035          0.1078
    5    2    0    0    0.0569   -0.2235    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6   -2    1   -1   -0.1066    0.1191   -0.1085    0.1216    0.0031    1          0.0767          0.0778
    7    3    0   -1    0.1201   -0.5947    0.1201   -0.5973    0.0026    1          0.1324          0.1302
    8    3   -1    0    0.1436   -0.2198    0.1454   -0.2240    0.0045    1          0.1032          0.1017
    9   -1    2   -1   -0.1949    0.0488   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1   -1    0    0.2250   -0.1268    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11    2   -1   -1    0.5340   -0.6126    0.5303   -0.6130    0.0036    1          0.1246          0.1248
   12    0    3   -1   -0.1821   -0.0380   -0.1829   -0.0381    0.0007    1          0.0999          0.0984
   13    1   -3    0    0.1968   -0.0083    0.1990   -0.0092    0.0023    1          0.1002          0.0927
   14    2   -3   -1    0.5290   -0.1489    0.5293   -0.1451    0.0038    1          0.1491          0.1473
   15    1    2   -1   -0.3363   -0.2372   -0.3362   -0.2357    0.0015    1          0.0875          0.0881
   16    0   -2    0    0.1250    0.0354    0.1275    0.0362    0.0026    1          0.0620          0.0679
   17    1   -2   -1    0.7289   -0.0801    0.7293   -0.0807    0.0008    1          0.1153          0.1198
   18    2   -2   -2    1.0598   -0.5122    1.0696   -0.4972    0.0179    1          0.2547          0.2483
   19   -1   -3    0    0.0427    0.0283    0.0442    0.0295    0.0019    1          0.0967          0.0994
   20    0   -3   -1    0.4430    0.1654    0.4423    0.1634    0.0021    1          0.1183          0.1178
   21    1    1    0   -0.0341   -0.0588   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -1   -2   -1    0.2963    0.3335    0.3053    0.3413    0.0119    1          0.0898          0.0899
   23   -2   -1   -1    0.0340    0.2704    0.0347    0.2716    0.0014    1          0.0804          0.0816

###            No.20                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2620    1.2807    1.2381   91.7366   90.0058   90.8403      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2610    1.2610    1.2579   90.0000   90.0000   90.0000      0.4475         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0471    0.0000    0.0000    0.0000      0.0335         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1993   -0.7460   -0.1784)
 a2 = (    0.7451    0.2113   -0.1023)
 a3 = (    0.1722   -0.1402    0.7769)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1896   -0.7492   -0.1780) (    0.0042    0.0015    0.0050)
 a2 = (    0.7562    0.2157   -0.1026) (    0.0015    0.0044    0.0041)
 a3 = (    0.1457   -0.1455    0.7679) (    0.0095    0.0089    0.0276)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -119.9752   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
            400             63
# Figure of merit at the beginning and the end of the refinement
         7.5123        32.5544
# Chi-squares at the beginning and the end of the refinement
    0.2287    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2   -3    1    0   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    3    0    1   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4   -2    1    1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5   -2    0    0    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    2    1    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7   -3    0    1    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8   -3   -1    0    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    1    2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2   -1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    0    3    1   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13   -1   -3    0    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14   -2   -3    1    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15   -1    2    1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0   -2    0    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17   -1   -2    1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18   -2   -2    2    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    1   -3    0    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    0   -3    1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21   -1    1    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    1   -2    1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23    2   -1    1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2   -3    1    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    3    0    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -2    1    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5   -2    0    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    2    1    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7   -3    0    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8   -3   -1    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9    1    2    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10   -1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -2   -1    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    0    3    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13   -1   -3    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14   -2   -3    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1    2    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17   -1   -2    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -2   -2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    1   -3    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    0   -3    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1    1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1   -2    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23    2   -1    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.25                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2576    1.2601    1.2622   89.8700   90.3813   89.1239      0.5875
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8281
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1345   -0.1450    0.7703)
 a2 = (    0.7569    0.2147   -0.1043)
 a3 = (   -0.1894    0.7481    0.1794)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1458   -0.1455    0.7683) (    0.0036    0.0036    0.0009)
 a2 = (    0.7586    0.2161   -0.1030) (    0.0014    0.0044    0.0034)
 a3 = (   -0.1886    0.7466    0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.6388   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
             91             73
# Figure of merit at the beginning and the end of the refinement
         4.5071        31.9901
# Chi-squares at the beginning and the end of the refinement
    0.6460    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7426   -0.0580   -0.7310   -0.0567    0.0117    1    0.0875    0.0702
    2    0    1    3   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    1    0   -3   -0.0263    0.0894   -0.0262    0.0895    0.0001    1    0.1276    0.0967
    4    1    1    2   -0.1935   -0.5912   -0.1957   -0.5833    0.0082    1    0.1361    0.1078
    5    0    0    2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1    1   -2   -0.1070    0.1201   -0.1085    0.1216    0.0021    1    0.1003    0.0778
    7    1    0    3    0.1236   -0.5978    0.1201   -0.5973    0.0034    1    0.1745    0.1302
    8    0   -1    3    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1    2   -1   -0.1956    0.0494   -0.1952    0.0486    0.0008    1    0.1017    0.0726
   10    0   -1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1   -1    2    0.5384   -0.6110    0.5303   -0.6130    0.0083    1    0.1644    0.1248
   12    1    3    0   -0.1824   -0.0378   -0.1829   -0.0381    0.0006    1    0.1307    0.0984
   13    0   -3    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    1   -3    2    0.5313   -0.1493    0.5293   -0.1451    0.0047    1    0.1973    0.1473
   15    1    2    1   -0.3385   -0.2395   -0.3362   -0.2357    0.0045    1    0.1146    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1   -2    1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1524    0.1198
   18    2   -2    2    1.0565   -0.5053    1.0696   -0.4972    0.0154    1    0.3347    0.2483
   19    0   -3   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    1   -3    0    0.4461    0.1648    0.4423    0.1634    0.0040    1    0.1565    0.1178
   21    0    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1   -2   -1    0.3006    0.3340    0.3053    0.3413    0.0087    1    0.1185    0.0899
   23    1   -1   -2    0.0359    0.2732    0.0347    0.2716    0.0019    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0    1    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    1    0   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    1    1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    1    1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    1    0    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0   -1    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1    2   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1   -1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    1    3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0   -3    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    1   -3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    2    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0   -2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    1   -2    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2   -2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0   -3   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    1   -3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0    1    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    1   -2   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.26                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2426    1.2687    1.2688   89.9900   90.5231   90.2671      0.5055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1422    0.1417   -0.7794)
 a2 = (    0.7519    0.2133   -0.1022)
 a3 = (    0.1871   -0.7449   -0.1770)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1458    0.1455   -0.7683) (    0.0036    0.0036    0.0009)
 a2 = (    0.7586    0.2161   -0.1030) (    0.0014    0.0044    0.0034)
 a3 = (    0.1886   -0.7466   -0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.6388  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
             75             73
# Figure of merit at the beginning and the end of the refinement
         9.3876        31.9892
# Chi-squares at the beginning and the end of the refinement
    0.2183    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7526   -0.0603   -0.7310   -0.0567    0.0219    1    0.0767    0.0702
    2    0    1   -3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1117    0.0995
    3   -1    0    3   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.1094    0.0967
    4   -1    1   -2   -0.1979   -0.5945   -0.1957   -0.5833    0.0114    1    0.1176    0.1078
    5    0    0   -2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0721    0.0654
    6   -1    1    2   -0.1133    0.1267   -0.1085    0.1216    0.0070    1    0.0863    0.0778
    7   -1    0   -3    0.1206   -0.6019    0.1201   -0.5973    0.0046    1    0.1501    0.1302
    8    0   -1   -3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1159    0.1017
    9   -1    2    1   -0.2043    0.0513   -0.1952    0.0486    0.0095    1    0.0877    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0516    0.0467
   11   -1   -1   -2    0.5388   -0.6214    0.5303   -0.6130    0.0120    1    0.1419    0.1248
   12   -1    3    0   -0.1891   -0.0393   -0.1829   -0.0381    0.0063    1    0.1125    0.0984
   13    0   -3   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1126    0.0927
   14   -1   -3   -2    0.5353   -0.1524    0.5293   -0.1451    0.0095    1    0.1689    0.1473
   15   -1    2   -1   -0.3440   -0.2429   -0.3362   -0.2357    0.0106    1    0.0992    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0697    0.0679
   17   -1   -2   -1    0.7398   -0.0844    0.7293   -0.0807    0.0111    1    0.1314    0.1198
   18   -2   -2   -2    1.0717   -0.5244    1.0696   -0.4972    0.0274    1    0.2927    0.2483
   19    0   -3    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1087    0.0994
   20   -1   -3    0    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1341    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0486    0.0568
   22   -1   -2    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1019    0.0899
   23   -1   -1    2    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0908    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0    1   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3   -1    0    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1    1   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1    1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7   -1    0   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0   -1   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -1    2    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -1   -1   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -1    3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0   -3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -1   -3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1    2   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0   -2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1   -2   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -2   -2   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0   -3    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -1   -3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0    1   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -1   -2    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -1    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.30                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2572    1.2653    1.2574   90.7433   90.0147   89.4518      0.5849
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7588   -0.2152    0.1031)
 a2 = (   -0.1352    0.1373   -0.7666)
 a3 = (    0.1888   -0.7517   -0.1786)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7586   -0.2161    0.1030) (    0.0014    0.0044    0.0034)
 a2 = (   -0.1458    0.1455   -0.7683) (    0.0036    0.0036    0.0009)
 a3 = (    0.1886   -0.7466   -0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  172.3612  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
             91             73
# Figure of merit at the beginning and the end of the refinement
         4.5957        31.9891
# Chi-squares at the beginning and the end of the refinement
    0.5895    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7366   -0.0642   -0.7310   -0.0567    0.0094    1    0.0868    0.0702
    2   -1    0   -3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1305    0.0995
    3    0   -1    3   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4   -1   -1   -2   -0.1904   -0.5832   -0.1957   -0.5833    0.0053    1    0.1352    0.1078
    5    0    0   -2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0842    0.0654
    6   -1   -1    2   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7    0   -1   -3    0.1203   -0.5904    0.1201   -0.5973    0.0069    1    0.1734    0.1302
    8    1    0   -3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1354    0.1017
    9   -2   -1    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0603    0.0467
   11    1   -1   -2    0.5278   -0.6067    0.5303   -0.6130    0.0067    1    0.1624    0.1248
   12   -3   -1    0   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13    3    0   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1316    0.0927
   14    3   -1   -2    0.5259   -0.1504    0.5293   -0.1451    0.0063    1    0.1958    0.1473
   15   -2   -1   -1   -0.3344   -0.2387   -0.3362   -0.2357    0.0035    1    0.1144    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0814    0.0679
   17    2   -1   -1    0.7228   -0.0846    0.7293   -0.0807    0.0076    1    0.1507    0.1198
   18    2   -2   -2    1.0393   -0.5107    1.0696   -0.4972    0.0331    1    0.3287    0.2483
   19    3    0    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1270    0.0994
   20    3   -1    0    0.4432    0.1621    0.4423    0.1634    0.0016    1    0.1553    0.1178
   21   -1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2   -1    1    0.2994    0.3310    0.3053    0.3413    0.0118    1    0.1176    0.0899
   23    1   -1    2    0.0360    0.2714    0.0347    0.2716    0.0013    1    0.1050    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2   -1    0   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    0   -1    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1   -1   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1   -1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    0   -1   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    1    0   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -2   -1    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1    0   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1   -1   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -3   -1    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    3    0   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    3   -1   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2   -1   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    2    0    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    2   -1   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2   -2   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    3    0    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    3   -1    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21   -1    0   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    2   -1    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -1    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.31                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2564    1.2669    1.2565   90.2048   89.9926   89.9570      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7593   -0.2154    0.1032)
 a2 = (    0.1445   -0.1419    0.7629)
 a3 = (   -0.1890    0.7522    0.1787)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7586   -0.2161    0.1030) (    0.0014    0.0044    0.0034)
 a2 = (    0.1458   -0.1455    0.7683) (    0.0036    0.0036    0.0009)
 a3 = (   -0.1886    0.7466    0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.6388   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
             91             73
# Figure of merit at the beginning and the end of the refinement
        11.9806        31.9891
# Chi-squares at the beginning and the end of the refinement
    0.1013    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2   -1    0    3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    0    1   -3   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4   -1    1    2   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0    0    2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6   -1    1   -2   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    0    1    3    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8    1    0    3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9   -2    1   -1   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10    1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11    1    1    2    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12   -3    1    0   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13    3    0    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14    3    1    2    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15   -2    1    1   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17    2    1    1    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18    2    2    2    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19    3    0   -1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20    3    1    0    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22    2    1   -1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23    1    1   -2    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2   -1    0    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    0    1   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1    1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1    1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    0    1    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    1    0    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -2    1   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1    0    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1    1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -3    1    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    3    0    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    3    1    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2    1    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    2    0    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    2    1    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2    2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    3    0   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    3    1    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21   -1    0    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    2    1   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.32                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2595    1.2601    1.2602   90.0865   89.9508   90.1316      0.4144
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1436   -0.1454    0.7672)
 a2 = (   -0.7569   -0.2152    0.1027)
 a3 = (    0.1879   -0.7501   -0.1781)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1458   -0.1455    0.7683) (    0.0036    0.0036    0.0009)
 a2 = (   -0.7586   -0.2161    0.1030) (    0.0014    0.0044    0.0034)
 a3 = (    0.1886   -0.7466   -0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.3612  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
             75             73
# Figure of merit at the beginning and the end of the refinement
        16.2101        31.9891
# Chi-squares at the beginning and the end of the refinement
    0.0648    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0615    0.0702
    2    0   -1   -3   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0922    0.0995
    3    1    0    3   -0.0264    0.0894   -0.0262    0.0895    0.0002    1    0.0902    0.0967
    4    1   -1   -2   -0.1954   -0.5847   -0.1957   -0.5833    0.0014    1    0.0956    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0595    0.0654
    6    1   -1    2   -0.1071    0.1200   -0.1085    0.1216    0.0021    1    0.0709    0.0778
    7    1    0   -3    0.1187   -0.5946    0.1201   -0.5973    0.0031    1    0.1224    0.1302
    8    0    1   -3    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0955    0.1017
    9    1   -2    1   -0.1955    0.0493   -0.1952    0.0486    0.0007    1    0.0720    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0426    0.0467
   11    1    1   -2    0.5326   -0.6136    0.5303   -0.6130    0.0023    1    0.1150    0.1248
   12    1   -3    0   -0.1823   -0.0378   -0.1829   -0.0381    0.0006    1    0.0925    0.0984
   13    0    3   -1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0929    0.0927
   14    1    3   -2    0.5294   -0.1500    0.5293   -0.1451    0.0049    1    0.1380    0.1473
   15    1   -2   -1   -0.3365   -0.2370   -0.3362   -0.2357    0.0013    1    0.0810    0.0881
   16    0    2    0    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0575    0.0679
   17    1    2   -1    0.7294   -0.0815    0.7293   -0.0807    0.0008    1    0.1066    0.1198
   18    2    2   -2    1.0580   -0.5142    1.0696   -0.4972    0.0206    1    0.2345    0.2483
   19    0    3    1    0.0431    0.0289    0.0442    0.0295    0.0013    1    0.0897    0.0994
   20    1    3    0    0.4441    0.1652    0.4423    0.1634    0.0025    1    0.1096    0.1178
   21    0   -1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0402    0.0568
   22    1    2    1    0.2976    0.3338    0.3053    0.3413    0.0107    1    0.0832    0.0899
   23    1    1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0745    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0   -1   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    1    0    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    1   -1   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    1   -1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    1    0   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0    1   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1   -2    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1    1   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    1   -3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0    3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    1    3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -2   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0    2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    1    2   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2    2   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0    3    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    1    3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0   -1   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    1    2    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    1    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.37                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2381    1.2807    1.2620   90.8403   90.0058   91.7366      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1722    0.1402   -0.7769)
 a2 = (   -0.7451   -0.2113    0.1023)
 a3 = (   -0.1993    0.7460    0.1784)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1458    0.1455   -0.7683) (    0.0036    0.0036    0.0009)
 a2 = (   -0.7586   -0.2161    0.1030) (    0.0014    0.0044    0.0034)
 a3 = (   -0.1886    0.7466    0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.3612   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            400             74
# Figure of merit at the beginning and the end of the refinement
         7.5123        31.8445
# Chi-squares at the beginning and the end of the refinement
    1.0267    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0   -1    3   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -1    0   -3   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4   -1   -1    2   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    0    0    2    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -1   -1   -2   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7   -1    0    3    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    0    1    3    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9   -1   -2   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    1    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -1   -3    0   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    0    3    1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14   -1    3    2    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15   -1   -2    1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0    2    0    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17   -1    2    1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18   -2    2    2    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    0    3   -1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -1    3    0    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0   -1    1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -1    2   -1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -1    1   -2    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0   -1    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3   -1    0   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1   -1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1   -1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7   -1    0    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0    1    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -1   -2   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -1    1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -1   -3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0    3    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -1    3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1   -2    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0    2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1    2    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -2    2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0    3   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -1    3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0   -1    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -1    2   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.53                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2539    1.2700    1.2560   89.8246   89.8670   90.9219      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2571    1.2571    1.2656   90.0000   90.0000   90.0000      0.4475         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0165    0.0000    0.0000    0.0000      0.0283         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7607    0.2158   -0.1048)
 a2 = (   -0.1332    0.1465   -0.7622)
 a3 = (   -0.1904    0.7518    0.1803)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7586    0.2161   -0.1030) (    0.0014    0.0044    0.0034)
 a2 = (   -0.1458    0.1455   -0.7683) (    0.0036    0.0036    0.0009)
 a3 = (   -0.1886    0.7466    0.1772) (    0.0052    0.0097    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -172.3612   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
             95             78
# Figure of merit at the beginning and the end of the refinement
         4.1659        31.2904
# Chi-squares at the beginning and the end of the refinement
    0.4282    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2    1    0    3   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3    0   -1   -3   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4    2   -2    4   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5    0    0    2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6    1   -1   -2   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7    0   -1    3    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8   -1    0    3    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9    2   -1   -1   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10   -1    0    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11   -1   -1    2    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12    3   -1    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13   -3    0    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14   -3   -1    2    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15    2   -1    1   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16   -4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17   -4   -2    2    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18   -2   -2    2    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19   -3    0   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20   -3   -1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21    2    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22   -2   -1   -1    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23   -1   -1   -2    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    1    0    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    0   -1   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    1   -1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    1   -1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    0   -1    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8   -1    0    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    2   -1   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    0    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -1   -1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    3   -1    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13   -3    0    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -3   -1    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    2   -1    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16   -2    0    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -2   -1    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -2   -2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19   -3    0   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -3   -1    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    1    0    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -2   -1   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.57                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2578    1.2621    1.2599   90.1363   89.4779   90.0519      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2630    1.2630    1.2539   90.0000   90.0000   90.0000      0.4508         1.0072    1.0072    2.8014    2.8014    2.7813
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0174    0.0000    0.0000    0.0000      0.0286         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1406   -0.1494    0.7682)
 a2 = (    0.1895   -0.7481   -0.1794)
 a3 = (    0.7570    0.2147   -0.1043)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1445   -0.1444    0.7650) (    0.0036    0.0037    0.0010)
 a2 = (    0.1890   -0.7483   -0.1769) (    0.0043    0.0013    0.0036)
 a3 = (    0.7607    0.2165   -0.1029) (    0.0109    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0211   97.4109  105.8842    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
             91             83
# Figure of merit at the beginning and the end of the refinement
         7.8810        30.1244
# Chi-squares at the beginning and the end of the refinement
    0.2288    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2    0   -3    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3    1    3    0   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4    1   -2    1   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5    0   -2    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6    1    2    1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7    1   -3    0    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8    0   -3   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9    1    1    2   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10    0   -1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11    1   -2   -1    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12    1    0    3   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13    0   -1   -3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14    1   -2   -3    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15    1   -1    2   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16    0    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17    1   -1   -2    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18    2   -2   -2    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19    0    1   -3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20    1    0   -3    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22    1    1   -2    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23    1    2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0   -3    1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1    3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4    1   -2    1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0   -2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6    1    2    1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7    1   -3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0   -3   -1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9    1    1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0   -1   -1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -2   -1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12    1    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0   -1   -3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14    1   -2   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15    1   -1    2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17    1   -1   -2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18    2   -2   -2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0    1   -3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20    1    0   -3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1    1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22    1    1   -2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    2   -1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.58                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2590    1.2619    1.2589   90.1249   90.0858   89.9863      0.4543
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2630    1.2630    1.2539   90.0000   90.0000   90.0000      0.4508         1.0072    1.0072    2.8014    2.8014    2.7813
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0174    0.0000    0.0000    0.0000      0.0286         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1881   -0.7509   -0.1782)
 a2 = (    0.1435   -0.1456    0.7656)
 a3 = (   -0.7576   -0.2154    0.1029)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1890   -0.7483   -0.1769) (    0.0043    0.0013    0.0036)
 a2 = (    0.1445   -0.1444    0.7650) (    0.0036    0.0037    0.0010)
 a3 = (   -0.7607   -0.2165    0.1029) (    0.0109    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.0211   82.5891  -74.1158    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
             83             83
# Figure of merit at the beginning and the end of the refinement
        28.7743        30.1231
# Chi-squares at the beginning and the end of the refinement
    0.0414    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0673    0.0702
    2   -3    0   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1012    0.0995
    3    3    1    0   -0.0261    0.0886   -0.0262    0.0895    0.0009    1    0.0989    0.0967
    4   -2    1   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1048    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0653    0.0654
    6    2    1   -1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0778    0.0778
    7   -3    1    0    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.1342    0.1302
    8   -3    0    1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1049    0.1017
    9    1    1   -2   -0.1943    0.0490   -0.1952    0.0486    0.0010    1    0.0789    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2    1    1    0.5316   -0.6124    0.5303   -0.6130    0.0014    1    0.1260    0.1248
   12    0    1   -3   -0.1813   -0.0376   -0.1829   -0.0381    0.0016    1    0.1014    0.0984
   13   -1    0    3    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1019    0.0927
   14   -2    1    3    0.5286   -0.1497    0.5293   -0.1451    0.0047    1    0.1513    0.1473
   15   -1    1   -2   -0.3354   -0.2363   -0.3362   -0.2357    0.0010    1    0.0887    0.0881
   16    0    0    2    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0631    0.0679
   17   -1    1    2    0.7279   -0.0814    0.7293   -0.0807    0.0016    1    0.1168    0.1198
   18   -2    2    2    1.0556   -0.5129    1.0696   -0.4972    0.0211    1    0.2565    0.2483
   19    1    0    3    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0984    0.0994
   20    0    1    3    0.4432    0.1648    0.4423    0.1634    0.0016    1    0.1202    0.1178
   21   -1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0441    0.0568
   22    1    1    2    0.2968    0.3328    0.3053    0.3413    0.0120    1    0.0912    0.0899
   23    2    1    1    0.0345    0.2704    0.0347    0.2716    0.0012    1    0.0817    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2   -3    0   -1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    3    1    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4   -2    1   -1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5   -2    0    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6    2    1   -1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7   -3    1    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8   -3    0    1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9    1    1   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10   -1    0    1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2    1    1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12    0    1   -3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13   -1    0    3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14   -2    1    3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15   -1    1   -2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17   -1    1    2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18   -2    2    2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    1    0    3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20    0    1    3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21   -1    0   -1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22    1    1    2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    2    1    1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.59                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2460    1.2670    1.2671   89.9144   89.0386   90.0137      0.4564
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2630    1.2630    1.2539   90.0000   90.0000   90.0000      0.4508         1.0072    1.0072    2.8014    2.8014    2.7812
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0174    0.0000    0.0000    0.0000      0.0286         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1599   -0.1433    0.7734)
 a2 = (   -0.1869    0.7461    0.1771)
 a3 = (   -0.7528   -0.2141    0.1022)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1445   -0.1444    0.7650) (    0.0036    0.0037    0.0010)
 a2 = (   -0.1890    0.7483    0.1769) (    0.0043    0.0013    0.0036)
 a3 = (   -0.7607   -0.2165    0.1029) (    0.0109    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   76.9789   82.5891  -74.1158    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
             57             83
# Figure of merit at the beginning and the end of the refinement
        19.8589        30.1231
# Chi-squares at the beginning and the end of the refinement
    0.3663    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0    3   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    1   -3    0   -0.0282    0.0931   -0.0262    0.0895    0.0042    1    0.0990    0.0967
    4    1    2   -1   -0.2022   -0.5864   -0.1957   -0.5833    0.0072    1    0.1057    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    1   -2   -1   -0.1110    0.1226   -0.1085    0.1216    0.0027    1    0.0783    0.0778
    7    1    3    0    0.1149   -0.6008    0.1201   -0.5973    0.0063    1    0.1350    0.1302
    8    0    3    1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    1   -1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    2    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    1    0   -3   -0.1851   -0.0382   -0.1829   -0.0381    0.0023    1    0.1022    0.0984
   13    0    1    3    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    1    2    3    0.5363   -0.1533    0.5293   -0.1451    0.0108    1    0.1517    0.1473
   15    1    1   -2   -0.3395   -0.2367   -0.3362   -0.2357    0.0035    1    0.0897    0.0881
   16    0    0    2    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    1    1    2    0.7439   -0.0847    0.7293   -0.0807    0.0151    1    0.1181    0.1198
   18    2    2    2    1.0814   -0.5390    1.0696   -0.4972    0.0434    1    0.2650    0.2483
   19    0   -1    3    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    1    0    3    0.4514    0.1690    0.4423    0.1634    0.0106    1    0.1204    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    1   -1    2    0.3014    0.3427    0.3053    0.3413    0.0041    1    0.0914    0.0899
   23    1   -2    1    0.0329    0.2780    0.0347    0.2716    0.0066    1    0.0818    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0    3   -1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1   -3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4    1    2   -1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0    2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6    1   -2   -1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7    1    3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0    3    1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9    1   -1   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0    1    1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1    2    1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12    1    0   -3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0    1    3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14    1    2    3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15    1    1   -2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17    1    1    2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18    2    2    2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0   -1    3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20    1    0    3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1   -1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22    1   -1    2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -2    1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.63                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2439    1.2684    1.2677   89.9984   89.1120   90.0220      0.4773
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2630    1.2630    1.2539   90.0000   90.0000   90.0000      0.4508         1.0072    1.0072    2.8014    2.8014    2.7812
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0174    0.0000    0.0000    0.0000      0.0286         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1603    0.1427   -0.7748)
 a2 = (   -0.1873    0.7454    0.1757)
 a3 = (    0.7524    0.2134   -0.1036)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1445    0.1444   -0.7650) (    0.0036    0.0037    0.0010)
 a2 = (   -0.1890    0.7483    0.1769) (    0.0043    0.0013    0.0036)
 a3 = (    0.7607    0.2165   -0.1029) (    0.0109    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -76.9789   97.4109  105.8842    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
             57             84
# Figure of merit at the beginning and the end of the refinement
        14.8418        30.0030
# Chi-squares at the beginning and the end of the refinement
    0.4018    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0716    0.0702
    2    0    3    1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1054    0.0995
    3   -1   -3    0   -0.0290    0.0954   -0.0262    0.0895    0.0066    1    0.1036    0.0967
    4   -1    2    1   -0.2017   -0.5853   -0.1957   -0.5833    0.0063    1    0.1103    0.1078
    5    0    2    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0681    0.0654
    6   -1   -2    1   -0.1121    0.1237   -0.1085    0.1216    0.0042    1    0.0819    0.0778
    7   -1    3    0    0.1150   -0.5998    0.1201   -0.5973    0.0057    1    0.1409    0.1302
    8    0    3   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1094    0.1017
    9   -1   -1    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0833    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0488    0.0467
   11   -1    2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1334    0.1248
   12   -1    0    3   -0.1841   -0.0379   -0.1829   -0.0381    0.0013    1    0.1067    0.0984
   13    0    1   -3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1065    0.0927
   14   -1    2   -3    0.5374   -0.1539    0.5293   -0.1451    0.0119    1    0.1589    0.1473
   15   -1    1    2   -0.3386   -0.2359   -0.3362   -0.2357    0.0024    1    0.0936    0.0881
   16    0    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0659    0.0679
   17   -1    1   -2    0.7460   -0.0857    0.7293   -0.0807    0.0174    1    0.1238    0.1198
   18   -2    2   -2    1.0824   -0.5407    1.0696   -0.4972    0.0454    1    0.2780    0.2483
   19    0   -1   -3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1027    0.0994
   20   -1    0   -3    0.4544    0.1697    0.4423    0.1634    0.0136    1    0.1262    0.1178
   21    0    1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0459    0.0568
   22   -1   -1   -2    0.3042    0.3456    0.3053    0.3413    0.0044    1    0.0959    0.0899
   23   -1   -2   -1    0.0332    0.2815    0.0347    0.2716    0.0100    1    0.0857    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0    3    1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1   -3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4   -1    2    1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0    2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6   -1   -2    1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7   -1    3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0    3   -1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9   -1   -1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0    1   -1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    2   -1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12   -1    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0    1   -3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14   -1    2   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15   -1    1    2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17   -1    1   -2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18   -2    2   -2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0   -1   -3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20   -1    0   -3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1    1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22   -1   -1   -2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -2   -1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.66                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2480    1.2850    1.2478   91.9203   90.0027   89.9780      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2617    1.2617    1.2564   90.0000   90.0000   90.0000      0.4497         1.0042    1.0042    2.8058    2.8058    2.7939
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0190    0.0000    0.0000    0.0000      0.0301         0.0152    0.0152    0.1879    0.1879    0.1918
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1903   -0.7576   -0.1785)
 a2 = (   -0.1188    0.1484   -0.7551)
 a3 = (    0.7647    0.2169   -0.1053)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1888   -0.7490   -0.1776) (    0.0044    0.0014    0.0038)
 a2 = (   -0.1447    0.1451   -0.7656) (    0.0038    0.0039    0.0010)
 a3 = (    0.7593    0.2157   -0.1027) (    0.0119    0.0051    0.0036)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.9400   97.4103  105.8585    0.2857    0.2587    0.3493
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0026      0.0021    0.0020    0.0148

# Number of computed bands
            400             90
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.9187
# Chi-squares at the beginning and the end of the refinement
    1.0172    0.0183
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -3    0    1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    3   -1    0   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -2   -1    1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5   -2    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    2   -1    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -3   -1    0    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8   -3    0   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    1   -1    2   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -2   -1   -1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    0   -1    3   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -1    0   -3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -2   -1   -3    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1   -1    2   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1   -1   -2    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -2   -2   -2    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    1    0   -3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    0   -1   -3    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1    0    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    1   -1   -2    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    2   -1   -1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7306   -0.0574   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -3    0    1   -0.0133   -0.1743   -0.0130   -0.1762    0.0019    1          0.0996          0.0995
    3    3   -1    0   -0.0263    0.0894   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -2   -1    1   -0.1960   -0.5852   -0.1957   -0.5833    0.0019    1          0.1033          0.1078
    5   -2    0    0    0.0566   -0.2238    0.0560   -0.2234    0.0008    1          0.0643          0.0654
    6    2   -1    1   -0.1072    0.1194   -0.1085    0.1216    0.0025    1          0.0768          0.0778
    7   -3   -1    0    0.1197   -0.5957    0.1201   -0.5973    0.0017    1          0.1322          0.1302
    8   -3    0   -1    0.1439   -0.2203    0.1454   -0.2240    0.0040    1          0.1034          0.1017
    9    1   -1    2   -0.1947    0.0484   -0.1952    0.0486    0.0005    1          0.0781          0.0726
   10   -1    0   -1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0462          0.0467
   11   -2   -1   -1    0.5346   -0.6128    0.5303   -0.6130    0.0043    1          0.1242          0.1248
   12    0   -1    3   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.1004          0.0984
   13   -1    0   -3    0.1973   -0.0084    0.1990   -0.0092    0.0018    1          0.1008          0.0927
   14   -2   -1   -3    0.5291   -0.1490    0.5293   -0.1451    0.0039    1          0.1493          0.1473
   15   -1   -1    2   -0.3358   -0.2363   -0.3362   -0.2357    0.0007    1          0.0877          0.0881
   16    0    0   -2    0.1257    0.0353    0.1275    0.0362    0.0019    1          0.0624          0.0679
   17   -1   -1   -2    0.7284   -0.0807    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -2   -2   -2    1.0585   -0.5118    1.0696   -0.4972    0.0183    1          0.2528          0.2483
   19    1    0   -3    0.0436    0.0286    0.0442    0.0295    0.0011    1          0.0973          0.0994
   20    0   -1   -3    0.4438    0.1644    0.4423    0.1634    0.0018    1          0.1187          0.1178
   21   -1    0    1   -0.0338   -0.0580   -0.0341   -0.0579    0.0003    1          0.0435          0.0568
   22    1   -1   -2    0.2985    0.3332    0.3053    0.3413    0.0106    1          0.0900          0.0899
   23    2   -1   -1    0.0350    0.2720    0.0347    0.2716    0.0005    1          0.0805          0.0816

###            No.73                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2594    1.2610    1.2593   89.9684   90.0865   90.2492      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2629    1.2629    1.2539   90.0000   90.0000   90.0000      0.4420         1.0072    1.0072    2.8574    2.8574    2.8370
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0174    0.0000    0.0000    0.0000      0.0281         0.0140    0.0140    0.1815    0.1815    0.1844
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1880    0.7506    0.1782)
 a2 = (    0.1441   -0.1423    0.7667)
 a3 = (    0.7574    0.2154   -0.1028)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1890    0.7483    0.1769) (    0.0043    0.0013    0.0036)
 a2 = (    0.1445   -0.1444    0.7650) (    0.0036    0.0037    0.0010)
 a3 = (    0.7606    0.2165   -0.1029) (    0.0110    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.0213   97.4109  105.8844    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
            195             88
# Figure of merit at the beginning and the end of the refinement
         3.3663        29.4706
# Chi-squares at the beginning and the end of the refinement
    0.4663    0.0465
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    2   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    3    0    1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3   -3    1    0   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4    4    2    2   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6   -2    1    1   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7    3    1    0    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8    3    0   -1    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9   -1    1    2   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    2    1   -1    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12    0    1    3   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13    1    0   -3    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14    2    1   -3    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15    1    1    2   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16    0    0   -4    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17    2    2   -4    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18    2    2   -2    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19   -1    0   -5    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20    0    1   -3    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    2    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22   -1    1   -2    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -2    1   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0650          0.0702
    2    3    0    1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0975          0.0995
    3   -3    1    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0954          0.0967
    4    2    1    1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1010          0.1078
    5    2    0    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0629          0.0654
    6   -2    1    1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0752          0.0778
    7    3    1    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1293          0.1302
    8    3    0   -1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1011          0.1017
    9   -1    1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0765          0.0726
   10    1    0   -1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0452          0.0467
   11    2    1   -1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1214          0.1248
   12    0    1    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.0984          0.0984
   13    1    0   -3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.0989          0.0927
   14    2    1   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1462          0.1473
   15    1    1    2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0858          0.0881
   16    0    0   -2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0612          0.0679
   17    1    1   -2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1127          0.1198
   18    2    2   -2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2468          0.2483
   19   -1    0   -3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0954          0.0994
   20    0    1   -3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1163          0.1178
   21    1    0    1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0426          0.0568
   22   -1    1   -2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0882          0.0899
   23   -2    1   -1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0788          0.0816

###            No.75                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2482    1.2663    1.2655   89.9930   90.9100   90.3198      0.4717
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2630    1.2630    1.2539   90.0000   90.0000   90.0000      0.4508         1.0072    1.0072    2.8014    2.8014    2.7812
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0174    0.0000    0.0000    0.0000      0.0286         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1589    0.1376   -0.7732)
 a2 = (    0.1876   -0.7467   -0.1760)
 a3 = (   -0.7537   -0.2138    0.1038)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1445    0.1444   -0.7650) (    0.0036    0.0037    0.0010)
 a2 = (    0.1890   -0.7483   -0.1769) (    0.0043    0.0013    0.0036)
 a3 = (   -0.7607   -0.2165    0.1029) (    0.0109    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.0211   82.5891  -74.1158    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
             65             89
# Figure of merit at the beginning and the end of the refinement
        15.9837        29.4303
# Chi-squares at the beginning and the end of the refinement
    0.4262    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7284   -0.0608   -0.7310   -0.0567    0.0049    1    0.0705    0.0702
    2    0   -3   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1043    0.0995
    3   -1    3    0   -0.0287    0.0945   -0.0262    0.0895    0.0056    1    0.1023    0.0967
    4   -1   -2   -1   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1090    0.1078
    5    0   -2    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0674    0.0654
    6   -1    2   -1   -0.1115    0.1227   -0.1085    0.1216    0.0032    1    0.0809    0.0778
    7   -1   -3    0    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1393    0.1302
    8    0   -3    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1082    0.1017
    9   -1    1   -2   -0.1981    0.0488   -0.1952    0.0486    0.0029    1    0.0823    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0483    0.0467
   11   -1   -2    1    0.5310   -0.6252    0.5303   -0.6130    0.0122    1    0.1316    0.1248
   12   -1    0   -3   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1056    0.0984
   13    0   -1    3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1054    0.0927
   14   -1   -2    3    0.5354   -0.1544    0.5293   -0.1451    0.0111    1    0.1571    0.1473
   15   -1   -1   -2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    0    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0652    0.0679
   17   -1   -1    2    0.7427   -0.0878    0.7293   -0.0807    0.0151    1    0.1222    0.1198
   18   -2   -2    2    1.0721   -0.5417    1.0696   -0.4972    0.0446    1    0.2728    0.2483
   19    0    1    3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1017    0.0994
   20   -1    0    3    0.4537    0.1681    0.4423    0.1634    0.0123    1    0.1247    0.1178
   21    0   -1   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0455    0.0568
   22   -1    1    2    0.3045    0.3441    0.3053    0.3413    0.0029    1    0.0947    0.0899
   23   -1    2    1    0.0334    0.2807    0.0347    0.2716    0.0091    1    0.0845    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0   -3   -1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1    3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4   -1   -2   -1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0   -2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6   -1    2   -1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7   -1   -3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0   -3    1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9   -1    1   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0   -1    1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -2    1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12   -1    0   -3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0   -1    3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14   -1   -2    3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15   -1   -1   -2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17   -1   -1    2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18   -2   -2    2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0    1    3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20   -1    0    3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1   -1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22   -1    1    2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    2    1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.84                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8717    0.8755    2.6216   89.6659   91.4692   89.7937      0.4426
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8742    0.8742    2.6171   90.0000   90.0000   90.0000      0.3296         0.3340    0.3340    2.6522    2.6522    7.9399
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0980    0.0000    0.0000    0.0000      0.0249         0.0125    0.0125    0.2003    0.2003    0.6694
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.0944   -0.3112    0.1497)
 a2 = (    0.2757   -1.0779   -0.2581)
 a3 = (    0.0605   -0.0708    0.3701)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.0908   -0.3112    0.1480) (    0.0022    0.0064    0.0059)
 a2 = (    0.2735   -1.0807   -0.2567) (    0.0061    0.0021    0.0071)
 a3 = (    0.0700   -0.0699    0.3691) (    0.0046    0.0043    0.0133)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  150.0244   15.0115   45.0444    0.9407    0.4106    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0003      0.0022    0.0022    0.0378

# Number of computed bands
            225            199
# Figure of merit at the beginning and the end of the refinement
         2.3526         5.8142
# Chi-squares at the beginning and the end of the refinement
    0.6247    0.1229
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    3   -0.7483   -0.0580   -0.7310   -0.0567    0.0173    1    0.0952    0.0702
    2   -1   -3    0   -0.0132   -0.1752   -0.0130   -0.1762    0.0010    1    0.1418    0.0995
    3    0    2    2   -0.0263    0.0897   -0.0262    0.0895    0.0003    1    0.0923    0.0967
    4   -1   -2    3   -0.1908   -0.5936   -0.1957   -0.5833    0.0114    1    0.1477    0.1078
    5    0   -2    0    0.0575   -0.2248    0.0560   -0.2234    0.0021    1    0.0916    0.0654
    6   -1    2    3   -0.1072    0.1207   -0.1085    0.1216    0.0015    1    0.1089    0.0778
    7    0   -2    2    0.1274   -0.5965    0.1201   -0.5973    0.0073    1    0.1261    0.1302
    8    1   -3    0    0.1452   -0.2208    0.1454   -0.2240    0.0032    1    0.1475    0.1017
    9   -2    1    3   -0.1963    0.0496   -0.1952    0.0486    0.0015    1    0.1103    0.0726
   10    1   -1    0    0.2267   -0.1269    0.2251   -0.1274    0.0017    1    0.0659    0.0467
   11    1   -2    3    0.5409   -0.6029    0.5303   -0.6130    0.0146    1    0.1782    0.1248
   12   -2    0    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0945    0.0984
   13    3   -1    0    0.1984   -0.0080    0.1990   -0.0092    0.0012    1    0.1439    0.0927
   14    3   -2    3    0.5278   -0.1459    0.5293   -0.1451    0.0017    1    0.2147    0.1473
   15   -2   -1    3   -0.3391   -0.2409   -0.3362   -0.2357    0.0060    1    0.1243    0.0881
   16    2    0    0    0.1266    0.0360    0.1275    0.0362    0.0009    1    0.0888    0.0679
   17    2   -1    3    0.7223   -0.0770    0.7293   -0.0807    0.0080    1    0.1653    0.1198
   18    2   -2    6    1.0489   -0.4893    1.0696   -0.4972    0.0221    1    0.3607    0.2483
   19    3    1    0    0.0439    0.0294    0.0442    0.0295    0.0003    1    0.1384    0.0994
   20    2    0    2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1134    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0617    0.0568
   22    2    1    3    0.2996    0.3308    0.3053    0.3413    0.0120    1    0.1291    0.0899
   23    1    2    3    0.0368    0.2726    0.0347    0.2716    0.0023    1    0.1148    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    3   -0.7322   -0.0572   -0.7310   -0.0567    0.0013    1          0.0707          0.0702
    2   -1   -3    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.1057          0.0995
    3    0    3    3   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.1035          0.0967
    4   -1   -2    3   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1098          0.1078
    5    0   -2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0683          0.0654
    6   -1    2    3   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0815          0.0778
    7    0   -3    3    0.1201   -0.5949    0.1201   -0.5973    0.0025    1          0.1405          0.1302
    8    1   -3    0    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1097          0.1017
    9   -2    1    3   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0827          0.0726
   10    1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0489          0.0467
   11    1   -2    3    0.5341   -0.6134    0.5303   -0.6130    0.0038    1          0.1321          0.1248
   12   -3    0    3   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.1062          0.0984
   13    3   -1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1066          0.0927
   14    3   -2    3    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1584          0.1473
   15   -2   -1    3   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0929          0.0881
   16    2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0659          0.0679
   17    2   -1    3    0.7306   -0.0809    0.7293   -0.0807    0.0013    1          0.1224          0.1198
   18    2   -2    6    1.0606   -0.5143    1.0696   -0.4972    0.0193    1          0.2699          0.2483
   19    3    1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.1028          0.0994
   20    3    0    3    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1258          0.1178
   21   -1   -1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0460          0.0568
   22    2    1    3    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0954          0.0899
   23    1    2    3    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0854          0.0816

###            No.86                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8724    0.8750    2.6201   89.9717   90.3972   90.0380      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8742    0.8742    2.6168   90.0000   90.0000   90.0000      0.3295         0.3341    0.3341    2.6530    2.6530    7.9412
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0980    0.0000    0.0000    0.0000      0.0249         0.0125    0.0125    0.2004    0.2004    0.6695
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.0942    0.3079   -0.1475)
 a2 = (    0.2699   -1.0802   -0.2580)
 a3 = (   -0.0671    0.0715   -0.3689)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.0907    0.3111   -0.1480) (    0.0022    0.0064    0.0059)
 a2 = (    0.2734   -1.0806   -0.2567) (    0.0061    0.0021    0.0071)
 a3 = (   -0.0700    0.0699   -0.3691) (    0.0046    0.0043    0.0133)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -150.0302  164.9871 -134.9620    0.9406    0.4106    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0005      0.0022    0.0022    0.0377

# Number of computed bands
            223            205
# Figure of merit at the beginning and the end of the refinement
         2.5635         5.7633
# Chi-squares at the beginning and the end of the refinement
    0.5181    0.1229
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -3   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2    1   -3    0   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3    0    2   -2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4    1   -2   -3   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5    0   -2    0    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6    1    2   -3   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7    0   -2   -2    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8   -1   -3    0    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9    2    1   -3   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11   -1   -2   -3    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12    2    0   -2   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13   -3   -1    0    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14   -3   -2   -3    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15    2   -1   -3   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16   -2    0    0    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17   -2   -1   -3    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18   -2   -2   -6    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19   -3    1    0    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20   -2    0   -2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21    1   -1    0   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22   -2    1   -3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23   -1    2   -3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -3   -0.7322   -0.0571   -0.7310   -0.0567    0.0013    1          0.0707          0.0702
    2    1   -3    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.1057          0.0995
    3    0    3   -3   -0.0263    0.0896   -0.0262    0.0895    0.0002    1          0.1035          0.0967
    4    1   -2   -3   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1098          0.1078
    5    0   -2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0683          0.0654
    6    1    2   -3   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0815          0.0778
    7    0   -3   -3    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1405          0.1302
    8   -1   -3    0    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1096          0.1017
    9    2    1   -3   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0827          0.0726
   10   -1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0489          0.0467
   11   -1   -2   -3    0.5341   -0.6134    0.5303   -0.6130    0.0038    1          0.1321          0.1248
   12    3    0   -3   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.1062          0.0984
   13   -3   -1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1066          0.0927
   14   -3   -2   -3    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1584          0.1473
   15    2   -1   -3   -0.3363   -0.2374   -0.3362   -0.2357    0.0017    1          0.0929          0.0881
   16   -2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0659          0.0679
   17   -2   -1   -3    0.7306   -0.0809    0.7293   -0.0807    0.0013    1          0.1224          0.1198
   18   -2   -2   -6    1.0607   -0.5142    1.0696   -0.4972    0.0193    1          0.2699          0.2483
   19   -3    1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.1028          0.0994
   20   -3    0   -3    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1258          0.1178
   21    1   -1    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0460          0.0568
   22   -2    1   -3    0.2979    0.3350    0.3053    0.3413    0.0097    1          0.0954          0.0899
   23   -1    2   -3    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0854          0.0816

###            No.87                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8745    0.8746    2.6152   90.5562   89.7326   90.1283      0.9229
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8760    0.8760    2.6063   90.0000   90.0000   90.0000      0.3196         0.3361    0.3361    2.7405    2.7405    8.1535
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.1226    0.0000    0.0000    0.0000      0.0287         0.0158    0.0158    0.2461    0.2461    0.8266
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2700    1.0808    0.2583)
 a2 = (    1.0902    0.3107   -0.1493)
 a3 = (   -0.0667    0.0699   -0.3700)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2744    1.0775    0.2586) (    0.0106    0.0033    0.0107)
 a2 = (    1.0877    0.3128   -0.1489) (    0.0041    0.0113    0.0087)
 a3 = (   -0.0710    0.0708   -0.3703) (    0.0064    0.0061    0.0166)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  119.9268  164.8458 -134.9003    1.3781    0.6127    1.7740
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0001    0.0004    0.0098      0.0035    0.0028    0.0503

# Number of computed bands
            146            285
# Figure of merit at the beginning and the end of the refinement
         0.9444         5.5569
# Chi-squares at the beginning and the end of the refinement
   18.9639    0.0968
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -3   -0.7400   -0.0580   -0.7310   -0.0567    0.0091    1    0.1990    0.0702
    2    1    1    0   -0.0343   -0.0581   -0.0130   -0.1762    0.1200    1    0.1292    0.0995
    3   -1    0   -1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0964    0.0967
    4    2    1   -3   -0.1950   -0.5882   -0.1957   -0.5833    0.0049    1    0.3111    0.1078
    5    2    0    0    0.0562   -0.2249    0.0560   -0.2234    0.0016    1    0.1919    0.0654
    6   -1    1   -2   -0.1623    0.0989   -0.1085    0.1216    0.0585    1    0.1466    0.0778
    7    1    0   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1315    0.1302
    8    2    0    0    0.0562   -0.2249    0.1454   -0.2240    0.0892    1    0.1919    0.1017
    9    0    1   -1   -0.1829   -0.0381   -0.1952    0.0486    0.0875    1    0.0987    0.0726
   10    1   -1    0    0.2269   -0.1285    0.2251   -0.1274    0.0021    1    0.1371    0.0467
   11    2   -1   -3    0.5359   -0.6150    0.5303   -0.6130    0.0059    1    0.3763    0.1248
   12    0    1   -1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0987    0.0984
   13    0   -2    0    0.1267    0.0361    0.1990   -0.0092    0.0853    1    0.1852    0.0927
   14    1   -2   -1    0.3787   -0.0619    0.5293   -0.1451    0.1721    0    0.2369    0.1473
   15    1    2   -3   -0.3379   -0.2389   -0.3362   -0.2357    0.0036    1    0.2619    0.0881
   16    0   -2    0    0.1267    0.0361    0.1275    0.0362    0.0008    1    0.1852    0.0679
   17    1   -2   -3    0.7317   -0.0812    0.7293   -0.0807    0.0024    1    0.3481    0.1198
   18    1   -1   -2    0.7400   -0.3802    1.0696   -0.4972    0.3497    0    0.2421    0.2483
   19   -1    0   -1   -0.0262    0.0895    0.0442    0.0295    0.0924    1    0.0964    0.0994
   20    0   -1   -1    0.4457    0.1657    0.4423    0.1634    0.0041    1    0.1177    0.1178
   21    1    1    0   -0.0343   -0.0581   -0.0341   -0.0579    0.0002    1    0.1292    0.0568
   22   -1   -1   -2    0.1539    0.3431    0.3053    0.3413    0.1514    1    0.1627    0.0899
   23   -2   -1   -3    0.0355    0.2723    0.0347    0.2716    0.0011    1    0.2408    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -3   -0.7282   -0.0566   -0.7310   -0.0567    0.0028    1          0.0694          0.0702
    2    3    1    0   -0.0131   -0.1746   -0.0130   -0.1762    0.0016    1          0.1033          0.0995
    3   -4   -1   -3   -0.0023    0.0457   -0.0262    0.0895    0.0499    1          0.1349          0.0967
    4    2    1   -3   -0.1951   -0.5850   -0.1957   -0.5833    0.0018    1          0.1078          0.1078
    5    2    0    0    0.0567   -0.2236    0.0560   -0.2234    0.0008    1          0.0668          0.0654
    6   -2    1   -3   -0.1068    0.1180   -0.1085    0.1216    0.0039    1          0.0797          0.0778
    7    3    0   -3    0.1199   -0.5949    0.1201   -0.5973    0.0025    1          0.1380          0.1302
    8    3   -1    0    0.1436   -0.2200    0.1454   -0.2240    0.0044    1          0.1073          0.1017
    9   -1    2   -3   -0.1943    0.0480   -0.1952    0.0486    0.0011    1          0.0809          0.0726
   10    1   -1    0    0.2251   -0.1269    0.2251   -0.1274    0.0006    1          0.0478          0.0467
   11    2   -1   -3    0.5348   -0.6130    0.5303   -0.6130    0.0045    1          0.1302          0.1248
   12   -1    3   -4   -0.1988    0.0215   -0.1829   -0.0381    0.0617    1          0.1133          0.0984
   13    1   -3    0    0.1970   -0.0082    0.1990   -0.0092    0.0022    1          0.1042          0.0927
   14    2   -3   -3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1555          0.1473
   15    1    2   -3   -0.3355   -0.2368   -0.3362   -0.2357    0.0013    1          0.0910          0.0881
   16    0   -2    0    0.1250    0.0356    0.1275    0.0362    0.0025    1          0.0644          0.0679
   17    1   -2   -3    0.7297   -0.0786    0.7293   -0.0807    0.0022    1          0.1205          0.1198
   18    2   -2   -6    1.0629   -0.5114    1.0696   -0.4972    0.0157    1          0.2674          0.2483
   19   -1   -3    0    0.0427    0.0285    0.0442    0.0295    0.0019    1          0.1005          0.0994
   20    0   -3   -3    0.4426    0.1666    0.4423    0.1634    0.0032    1          0.1232          0.1178
   21    1    1    0   -0.0342   -0.0586   -0.0341   -0.0579    0.0007    1          0.0450          0.0568
   22   -1   -2   -3    0.2948    0.3343    0.3053    0.3413    0.0126    1          0.0935          0.0899
   23   -2   -1   -3    0.0327    0.2700    0.0347    0.2716    0.0026    1          0.0836          0.0816

###            No.88                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2563    1.2622    1.2613   89.9973   90.1855   90.2275      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2725    1.2725    1.2351   90.0000   90.0000   90.0000      0.3026         1.0303    1.0303    4.2056    4.2056    4.0820
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0172    0.0000    0.0000    0.0000      0.0200         0.0144    0.0144    0.2782    0.2782    0.2759
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1451    0.1480   -0.7686)
 a2 = (   -0.1882    0.7491    0.1765)
 a3 = (    0.7561    0.2145   -0.1042)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1434    0.1445   -0.7590) (    0.0036    0.0037    0.0010)
 a2 = (   -0.1814    0.7441    0.1759) (    0.0042    0.0012    0.0036)
 a3 = (    0.7738    0.2136   -0.1055) (    0.0112    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -76.9496   97.4901  105.4293    0.2702    0.2423    0.3338
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0079    0.0003   -0.0186      0.0021    0.0020    0.0139

# Number of computed bands
            173            202
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.2561
# Chi-squares at the beginning and the end of the refinement
    1.2220    0.8626
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    2   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    0    5    1    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3   -1   -3    0   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4   -2    4    2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    4    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -2   -4    2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7   -1    3    0    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    0    3   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -1   -1    2   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    0    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -2    4   -2    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12   -1    0    3   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    0    1   -3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -1    2   -3    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15   -2    2    4   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    0   -4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17   -2    2   -4    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18   -2    2   -2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    0   -1   -5    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -1    0   -3    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    0    2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -1   -1   -2    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23   -2   -4   -2    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    2   -0.7295   -0.0547   -0.7310   -0.0567    0.0025    1          0.0867          0.0702
    2    0    5    1   -0.0011   -0.2005   -0.0130   -0.1762    0.0271    1          0.1064          0.0995
    3   -1   -3    0   -0.0343    0.0911   -0.0262    0.0895    0.0083    1          0.0640          0.0967
    4   -2    4    2   -0.2157   -0.5839   -0.1957   -0.5833    0.0200    1          0.1355          0.1078
    5    0    2    0    0.0475   -0.2277    0.0560   -0.2234    0.0095    1          0.0422          0.0654
    6   -1   -2    1   -0.1155    0.1190   -0.1085    0.1216    0.0075    1          0.0506          0.0778
    7   -1    3    0    0.1083   -0.6058    0.1201   -0.5973    0.0146    1          0.0867          0.1302
    8    0    3   -1    0.1384   -0.2244    0.1454   -0.2240    0.0070    1          0.0680          0.1017
    9   -1   -1    2   -0.1987    0.0467   -0.1952    0.0486    0.0040    1          0.0520          0.0726
   10    0    1   -1    0.2215   -0.1278    0.2251   -0.1274    0.0036    1          0.0307          0.0467
   11   -1    2   -1    0.5357   -0.6190    0.5303   -0.6130    0.0081    1          0.0817          0.1248
   12   -1    0    3   -0.1836   -0.0357   -0.1829   -0.0381    0.0025    1          0.0672          0.0984
   13    0    1   -3    0.1922   -0.0086    0.1990   -0.0092    0.0067    1          0.0677          0.0927
   14   -1    2   -3    0.5237   -0.1474    0.5293   -0.1451    0.0061    1          0.0990          0.1473
   15   -1    1    2   -0.3418   -0.2275   -0.3362   -0.2357    0.0100    1          0.0580          0.0881
   16    0    0   -4    0.1212    0.0353    0.1275    0.0362    0.0063    1          0.0841          0.0679
   17   -2    2   -4    0.7197   -0.0795    0.7293   -0.0807    0.0097    1          0.1523          0.1198
   18   -2    2   -2    1.0569   -0.5067    1.0696   -0.4972    0.0159    1          0.1645          0.2483
   19    0   -1   -5    0.0704    0.0381    0.0442    0.0295    0.0276    1          0.1061          0.0994
   20   -1    0   -3    0.4373    0.1602    0.4423    0.1634    0.0060    1          0.0792          0.1178
   21    0    2    2   -0.0414   -0.0545   -0.0341   -0.0579    0.0080    1          0.0578          0.0568
   22   -1   -1   -2    0.2987    0.3295    0.3053    0.3413    0.0135    1          0.0599          0.0899
   23   -1   -2   -1    0.0323    0.2767    0.0347    0.2716    0.0056    1          0.0531          0.0816

###            No.89                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2588    1.2609    1.2600   89.9980   90.0189   90.3272      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2725    1.2725    1.2351   90.0000   90.0000   90.0000      0.3026         1.0303    1.0303    4.2056    4.2056    4.0820
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0172    0.0000    0.0000    0.0000      0.0200         0.0144    0.0144    0.2782    0.2782    0.2759
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1457    0.1397   -0.7683)
 a2 = (    0.1884   -0.7498   -0.1767)
 a3 = (   -0.7569   -0.2147    0.1043)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1434    0.1445   -0.7590) (    0.0036    0.0037    0.0010)
 a2 = (    0.1814   -0.7441   -0.1759) (    0.0042    0.0012    0.0036)
 a3 = (   -0.7738   -0.2136    0.1055) (    0.0112    0.0049    0.0035)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.0504   82.5099  -74.5707    0.2702    0.2423    0.3338
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0079    0.0003   -0.0186      0.0021    0.0020    0.0139

# Number of computed bands
            179            207
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.2297
# Chi-squares at the beginning and the end of the refinement
    1.2570    0.8626
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0   -2   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2    0   -5   -1    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3   -1    3    0   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4   -2   -4   -2   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    0   -4    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -2    4   -2   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7   -1   -3    0    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    0   -3    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -1    1   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    0   -2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -2   -4    2    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12   -1    0   -3   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13    0   -1    3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -1   -2    3    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15   -2   -2   -4   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    0    0    4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -2   -2    4    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18   -2   -2    2    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    0    1    5    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -1    0    3    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21    0   -2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -1    1    2    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23   -2    4    2    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0   -2   -0.7295   -0.0547   -0.7310   -0.0567    0.0025    1          0.0867          0.0702
    2    0   -5   -1   -0.0011   -0.2005   -0.0130   -0.1762    0.0271    1          0.1064          0.0995
    3   -1    3    0   -0.0343    0.0911   -0.0262    0.0895    0.0083    1          0.0640          0.0967
    4   -2   -4   -2   -0.2157   -0.5839   -0.1957   -0.5833    0.0200    1          0.1355          0.1078
    5    0   -2    0    0.0475   -0.2277    0.0560   -0.2234    0.0095    1          0.0422          0.0654
    6   -1    2   -1   -0.1155    0.1190   -0.1085    0.1216    0.0075    1          0.0506          0.0778
    7   -1   -3    0    0.1083   -0.6058    0.1201   -0.5973    0.0146    1          0.0867          0.1302
    8    0   -3    1    0.1384   -0.2244    0.1454   -0.2240    0.0070    1          0.0680          0.1017
    9   -1    1   -2   -0.1987    0.0467   -0.1952    0.0486    0.0040    1          0.0520          0.0726
   10    0   -1    1    0.2215   -0.1278    0.2251   -0.1274    0.0036    1          0.0307          0.0467
   11   -1   -2    1    0.5357   -0.6190    0.5303   -0.6130    0.0081    1          0.0817          0.1248
   12   -1    0   -3   -0.1836   -0.0357   -0.1829   -0.0381    0.0025    1          0.0672          0.0984
   13    0   -1    3    0.1922   -0.0086    0.1990   -0.0092    0.0067    1          0.0677          0.0927
   14   -1   -2    3    0.5237   -0.1474    0.5293   -0.1451    0.0061    1          0.0990          0.1473
   15   -1   -1   -2   -0.3418   -0.2275   -0.3362   -0.2357    0.0100    1          0.0580          0.0881
   16    0    0    4    0.1212    0.0353    0.1275    0.0362    0.0063    1          0.0841          0.0679
   17   -2   -2    4    0.7197   -0.0795    0.7293   -0.0807    0.0097    1          0.1523          0.1198
   18   -2   -2    2    1.0569   -0.5067    1.0696   -0.4972    0.0159    1          0.1645          0.2483
   19    0    1    5    0.0704    0.0381    0.0442    0.0295    0.0276    1          0.1061          0.0994
   20   -1    0    3    0.4373    0.1602    0.4423    0.1634    0.0060    1          0.0792          0.1178
   21    0   -2   -2   -0.0414   -0.0545   -0.0341   -0.0579    0.0080    1          0.0578          0.0568
   22   -1    1    2    0.2987    0.3295    0.3053    0.3413    0.0135    1          0.0599          0.0899
   23   -1    2    1    0.0323    0.2767    0.0347    0.2716    0.0056    1          0.0531          0.0816

###            No.90                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2563    1.2613    1.2622   89.9973   90.2275   90.1855      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2511    1.2511    1.2777   90.0000   90.0000   90.0000      0.2941         0.9792    0.9792    4.2536    4.2536    4.3439
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0166    0.0000    0.0000    0.0000      0.0194         0.0127    0.0127    0.2808    0.2808    0.2923
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1451   -0.1480    0.7686)
 a2 = (   -0.7561   -0.2145    0.1042)
 a3 = (    0.1882   -0.7491   -0.1765)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1482   -0.1489    0.7712) (    0.0036    0.0037    0.0010)
 a2 = (   -0.7634   -0.2119    0.1058) (    0.0014    0.0044    0.0034)
 a3 = (    0.1809   -0.7405   -0.1777) (    0.0051    0.0096    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.1881  103.1221   13.7269    0.2533    0.2625    0.3242
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0073    0.0007    0.0074      0.0021    0.0021    0.0114

# Number of computed bands
            173            187
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.1025
# Chi-squares at the beginning and the end of the refinement
    1.2041    0.8925
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    0   -1   -5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    1    0    3   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2   -2   -4   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    0   -4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2   -2    4   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    1    0   -3    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    0    1   -3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1   -2    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    0    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2    2   -4    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    1   -3    0   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    0    3   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1    3   -2    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    2   -4   -2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    2    4   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    2    2   -2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    0    5    1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    1    3    0    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    0   -2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1    2    1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    2    2    4    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7284   -0.0505   -0.7310   -0.0567    0.0067    1          0.0881          0.0702
    2    0   -1   -5   -0.0002   -0.1989   -0.0130   -0.1762    0.0261    1          0.1058          0.0995
    3    2    0    6   -0.0341    0.0913   -0.0262    0.0895    0.0081    1          0.1277          0.0967
    4    2   -2   -4   -0.2147   -0.5830   -0.1957   -0.5833    0.0190    1          0.1367          0.1078
    5    0    0   -4    0.0476   -0.2254    0.0560   -0.2234    0.0086    1          0.0841          0.0654
    6    2   -2    4   -0.1152    0.1195   -0.1085    0.1216    0.0071    1          0.1010          0.0778
    7    2    0   -6    0.1074   -0.6035    0.1201   -0.5973    0.0141    1          0.1751          0.1302
    8    0    2   -4    0.1717   -0.2026    0.1454   -0.2240    0.0339    1          0.0962          0.1017
    9    1   -2    1   -0.1995    0.0475   -0.1952    0.0486    0.0044    1          0.0516          0.0726
   10    0    2   -2    0.2196   -0.1277    0.2251   -0.1274    0.0055    1          0.0609          0.0467
   11    2    2   -4    0.5336   -0.6209    0.5303   -0.6130    0.0086    1          0.1663          0.1248
   12    2   -6    0   -0.1850   -0.0361   -0.1829   -0.0381    0.0029    1          0.1332          0.0984
   13    0    3   -1    0.1912   -0.0091    0.1990   -0.0092    0.0078    1          0.0668          0.0927
   14    2    6   -4    0.5240   -0.1485    0.5293   -0.1451    0.0063    1          0.1989          0.1473
   15    2   -4   -2   -0.3424   -0.2284   -0.3362   -0.2357    0.0096    1          0.1160          0.0881
   16    0    4    0    0.1204    0.0348    0.1275    0.0362    0.0072    1          0.0829          0.0679
   17    2    4   -2    0.7229   -0.0793    0.7293   -0.0807    0.0067    1          0.1541          0.1198
   18    2    2   -2    1.0640   -0.5117    1.0696   -0.4972    0.0156    1          0.1704          0.2483
   19    0    5    1    0.0697    0.0375    0.0442    0.0295    0.0267    1          0.1046          0.0994
   20    2    6    0    0.4375    0.1622    0.4423    0.1634    0.0050    1          0.1584          0.1178
   21    0   -2   -2   -0.0407   -0.0552   -0.0341   -0.0579    0.0071    1          0.0572          0.0568
   22    2    4    2    0.2957    0.3315    0.3053    0.3413    0.0137    1          0.1199          0.0899
   23    2    2    4    0.0306    0.2752    0.0347    0.2716    0.0054    1          0.1062          0.0816

###            No.91                ###
# Bravais type
   Tetragonal(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2588    1.2600    1.2609   89.9980   90.3272   90.0189      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2511    1.2511    1.2777   90.0000   90.0000   90.0000      0.2941         0.9792    0.9792    4.2536    4.2536    4.3439
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0166    0.0000    0.0000    0.0000      0.0194         0.0127    0.0127    0.2808    0.2808    0.2923
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1457   -0.1397    0.7683)
 a2 = (    0.7569    0.2147   -0.1043)
 a3 = (   -0.1884    0.7498    0.1767)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1482   -0.1489    0.7712) (    0.0036    0.0037    0.0010)
 a2 = (    0.7634    0.2119   -0.1058) (    0.0014    0.0044    0.0034)
 a3 = (   -0.1809    0.7405    0.1777) (    0.0051    0.0096    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.8119   76.8779 -166.2731    0.2533    0.2625    0.3242
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0073    0.0007    0.0074      0.0021    0.0021    0.0114

# Number of computed bands
            179            188
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.0969
# Chi-squares at the beginning and the end of the refinement
    1.2517    0.8925
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2    0    1    5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    1    0   -3   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4    2    2    4   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    0    0    4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2    2   -4   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    1    0    3    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    0   -1    3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    0   -2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -2    4    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12    1    3    0   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13    0   -3    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1   -3    2    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15    2    4    2   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    0   -4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    2   -4    2    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18    2   -2    2    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    0   -5   -1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    1   -3    0    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21    0    2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1   -2   -1    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23    2   -2   -4    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7284   -0.0505   -0.7310   -0.0567    0.0067    1          0.0881          0.0702
    2    0    1    5   -0.0002   -0.1989   -0.0130   -0.1762    0.0261    1          0.1058          0.0995
    3    2    0   -6   -0.0341    0.0913   -0.0262    0.0895    0.0081    1          0.1277          0.0967
    4    2    2    4   -0.2147   -0.5830   -0.1957   -0.5833    0.0190    1          0.1367          0.1078
    5    0    0    4    0.0476   -0.2254    0.0560   -0.2234    0.0086    1          0.0841          0.0654
    6    2    2   -4   -0.1152    0.1195   -0.1085    0.1216    0.0071    1          0.1010          0.0778
    7    2    0    6    0.1074   -0.6035    0.1201   -0.5973    0.0141    1          0.1751          0.1302
    8    0   -2    4    0.1717   -0.2026    0.1454   -0.2240    0.0339    1          0.0962          0.1017
    9    1    2   -1   -0.1995    0.0475   -0.1952    0.0486    0.0044    1          0.0516          0.0726
   10    0   -2    2    0.2196   -0.1277    0.2251   -0.1274    0.0055    1          0.0609          0.0467
   11    2   -2    4    0.5336   -0.6209    0.5303   -0.6130    0.0086    1          0.1663          0.1248
   12    2    6    0   -0.1850   -0.0361   -0.1829   -0.0381    0.0029    1          0.1332          0.0984
   13    0   -3    1    0.1912   -0.0091    0.1990   -0.0092    0.0078    1          0.0668          0.0927
   14    2   -6    4    0.5240   -0.1485    0.5293   -0.1451    0.0063    1          0.1989          0.1473
   15    2    4    2   -0.3424   -0.2284   -0.3362   -0.2357    0.0096    1          0.1160          0.0881
   16    0   -4    0    0.1204    0.0348    0.1275    0.0362    0.0072    1          0.0829          0.0679
   17    2   -4    2    0.7229   -0.0793    0.7293   -0.0807    0.0067    1          0.1541          0.1198
   18    2   -2    2    1.0640   -0.5117    1.0696   -0.4972    0.0156    1          0.1704          0.2483
   19    0   -5   -1    0.0697    0.0375    0.0442    0.0295    0.0267    1          0.1046          0.0994
   20    2   -6    0    0.4375    0.1622    0.4423    0.1634    0.0050    1          0.1584          0.1178
   21    0    2    2   -0.0407   -0.0552   -0.0341   -0.0579    0.0071    1          0.0572          0.0568
   22    2   -4   -2    0.2957    0.3315    0.3053    0.3413    0.0137    1          0.1199          0.0899
   23    2   -2   -4    0.0306    0.2752    0.0347    0.2716    0.0054    1          0.1062          0.0816

###                                ###
### Candidates for   Tetragonal(P) ###
###                                ###

###            No.1                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0008    1.0022    0.9971   90.0865   90.2460   90.0369      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0008    1.0008    0.9984   90.0000   90.0000   90.0000      0.3551         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0374    0.0000    0.0000    0.0000      0.0266         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9530   -0.2703    0.1313)
 a2 = (    0.2364   -0.9436   -0.2222)
 a3 = (    0.1813   -0.1844    0.9691)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9528   -0.2718    0.1293) (    0.0019    0.0056    0.0052)
 a2 = (    0.2389   -0.9439   -0.2242) (    0.0053    0.0019    0.0062)
 a3 = (    0.1836   -0.1833    0.9674) (    0.0120    0.0113    0.0348)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  150.0248   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
            155            133
# Figure of merit at the beginning and the end of the refinement
         3.5160        10.1636
# Chi-squares at the beginning and the end of the refinement
    1.8154    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2   -1   -3    0   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3    0    3    1   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4   -1   -2    1   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0   -2    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6   -1    2    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    0   -3    1    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    1   -3    0    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9   -2    1    1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    1   -2    1    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12   -3    0    1   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13    2   -1    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14    3   -2    1    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15   -2   -1    1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    2   -1    1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    1   -1    1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19    3    1    0    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20    3    0    1    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21   -1   -1    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22    2    1    1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23    1    2    1    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2   -1   -3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0    3    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -1   -2    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0   -2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1    2    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0   -3    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8    1   -3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9   -2    1    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    1   -2    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12   -3    0    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    3   -1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14    3   -2    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -2   -1    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    2   -1    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18    2   -2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    3    1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    3    0    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1   -1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    2    1    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23    1    2    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.2                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0009    1.0016    0.9976   90.1505   90.5950   90.0451      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0008    1.0008    0.9985   90.0000   90.0000   90.0000      0.3552         1.0023    1.0023    2.8173    2.8173    2.8109
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0374    0.0000    0.0000    0.0000      0.0266         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9532    0.2704   -0.1295)
 a2 = (   -0.2364    0.9438    0.2241)
 a3 = (    0.1930   -0.1785    0.9674)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9528    0.2718   -0.1293) (    0.0019    0.0056    0.0052)
 a2 = (   -0.2389    0.9440    0.2242) (    0.0053    0.0019    0.0062)
 a3 = (    0.1836   -0.1833    0.9673) (    0.0120    0.0113    0.0348)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -29.9742   15.0131   45.0428    0.9407    0.4106    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0005      0.0022    0.0022    0.0377

# Number of computed bands
            139            134
# Figure of merit at the beginning and the end of the refinement
         4.5109        10.1410
# Chi-squares at the beginning and the end of the refinement
    0.2925    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    1    3    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    0   -3    1   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    1    2    1   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1   -2    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    0    3    1    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8   -1    3    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    2   -1    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    2    1    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    3    0    1   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13   -3    1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -3    2    1    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    2    1    1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17   -2    1    1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18   -2    2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19   -3   -1    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20   -3    0    1    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    1    1    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -2   -1    1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23   -1   -2    1    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7322   -0.0572   -0.7310   -0.0567    0.0013    1          0.0666          0.0702
    2    1    3    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3    0   -3    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4    1    2    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0    2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1   -2    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0    3    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8   -1    3    0    0.1437   -0.2198    0.1454   -0.2240    0.0045    1          0.1032          0.1017
    9    2   -1    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10   -1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -1    2    1    0.5341   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    3    0    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -3    1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14   -3    2    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2    1    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17   -2    1    1    0.7306   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -2    2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2540          0.2483
   19   -3   -1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20   -3    0    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1    1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -2   -1    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0899          0.0899
   23   -1   -2    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.3                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0078    1.0085    0.9839   89.6990   89.4065   89.9502      0.4460
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0008    1.0008    0.9984   90.0000   90.0000   90.0000      0.3551         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0374    0.0000    0.0000    0.0000      0.0266         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9466   -0.2685    0.1286)
 a2 = (   -0.2348    0.9373    0.2225)
 a3 = (   -0.1750    0.1842   -0.9842)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9528   -0.2718    0.1293) (    0.0019    0.0056    0.0052)
 a2 = (   -0.2389    0.9439    0.2242) (    0.0053    0.0019    0.0062)
 a3 = (   -0.1836    0.1833   -0.9674) (    0.0120    0.0113    0.0348)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   29.9752  164.9853 -134.9558    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
            151            135
# Figure of merit at the beginning and the end of the refinement
         4.0522        10.1132
# Chi-squares at the beginning and the end of the refinement
    0.3952    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0855    0.0702
    2   -1    3    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    0   -3   -1   -0.0286    0.0973   -0.0262    0.0895    0.0082    1    0.1217    0.0967
    4   -1    2   -1   -0.1989   -0.5977   -0.1957   -0.5833    0.0147    1    0.1308    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1   -2   -1   -0.1139    0.1281   -0.1085    0.1216    0.0085    1    0.0959    0.0778
    7    0    3   -1    0.1217   -0.6040    0.1201   -0.5973    0.0069    1    0.1669    0.1302
    8    1    3    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -2   -1   -1   -0.2058    0.0522   -0.1952    0.0486    0.0112    1    0.0973    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1    2   -1    0.5428   -0.6218    0.5303   -0.6130    0.0152    1    0.1580    0.1248
   12   -3    0   -1   -0.1904   -0.0392   -0.1829   -0.0381    0.0076    1    0.1249    0.0984
   13    3    1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    3    2   -1    0.5364   -0.1514    0.5293   -0.1451    0.0095    1    0.1879    0.1473
   15   -2    1   -1   -0.3463   -0.2437   -0.3362   -0.2357    0.0129    1    0.1101    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17    2    1   -1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1463    0.1198
   18    2    2   -2    1.0771   -0.5187    1.0696   -0.4972    0.0228    1    0.3268    0.2483
   19    3   -1    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    3    0   -1    0.4518    0.1678    0.4423    0.1634    0.0105    1    0.1493    0.1178
   21   -1    1    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    2   -1   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1136    0.0899
   23    1   -2   -1    0.0366    0.2822    0.0347    0.2716    0.0107    1    0.1012    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2   -1    3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0   -3   -1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -1    2   -1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0    2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -1   -2   -1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0    3   -1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8    1    3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9   -2   -1   -1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    1    2   -1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12   -3    0   -1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    3    1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14    3    2   -1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -2    1   -1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    2    1   -1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18    2    2   -2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    3   -1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    3    0   -1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1    1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    2   -1   -1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23    1   -2   -1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.4                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0057    1.0070    0.9875   89.9780   89.1504   89.9624      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0008    1.0008    0.9984   90.0000   90.0000   90.0000      0.3552         1.0023    1.0023    2.8174    2.8174    2.8108
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0374    0.0000    0.0000    0.0000      0.0266         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9484    0.2690   -0.1306)
 a2 = (    0.2352   -0.9391   -0.2212)
 a3 = (   -0.2012    0.1799   -0.9761)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9528    0.2718   -0.1293) (    0.0019    0.0056    0.0052)
 a2 = (    0.2389   -0.9440   -0.2242) (    0.0053    0.0019    0.0062)
 a3 = (   -0.1836    0.1833   -0.9674) (    0.0120    0.0113    0.0348)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -150.0225  164.9866 -134.9535    0.9407    0.4106    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0005      0.0022    0.0022    0.0377

# Number of computed bands
            133            139
# Figure of merit at the beginning and the end of the refinement
         2.7728        10.0171
# Chi-squares at the beginning and the end of the refinement
    2.9733    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    1   -2    0   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3    0    3   -1   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    1   -2   -1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0   -1    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6    1    2   -1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    0   -3   -1    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8   -1   -2    0    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9    2    1   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -1   -2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    3    0   -1   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13   -2   -1    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -3   -2   -1    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    2   -1   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16   -1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -2   -1   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18   -1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19   -2    1    0    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -3    0   -1    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    1   -1    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -2    1   -1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -1    2   -1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7322   -0.0572   -0.7310   -0.0567    0.0013    1          0.0666          0.0702
    2    1   -3    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    0    3   -1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4    1   -2   -1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    0   -2    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    1    2   -1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    0   -3   -1    0.1201   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8   -1   -3    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9    2    1   -1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10   -1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -1   -2   -1    0.5341   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    3    0   -1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.1000          0.0984
   13   -3   -1    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14   -3   -2   -1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    2   -1   -1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16   -2    0    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17   -2   -1   -1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -2   -2   -2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19   -3    1    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20   -3    0   -1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1   -1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -2    1   -1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0899          0.0899
   23   -1    2   -1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.5                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0081    1.0088    0.9834   89.2557   89.6978   89.9488      0.3878
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0008    1.0008    0.9984   90.0000   90.0000   90.0000      0.3551         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0374    0.0000    0.0000    0.0000      0.0266         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2349   -0.9377   -0.2226)
 a2 = (    0.9457    0.2682   -0.1285)
 a3 = (    0.1724   -0.1850    0.9850)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2389   -0.9439   -0.2242) (    0.0053    0.0019    0.0062)
 a2 = (    0.9528    0.2718   -0.1293) (    0.0019    0.0056    0.0052)
 a3 = (    0.1836   -0.1833    0.9674) (    0.0120    0.0113    0.0348)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -119.9752   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
            400            139
# Figure of merit at the beginning and the end of the refinement
         4.3518        10.0152
# Chi-squares at the beginning and the end of the refinement
    0.1607    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7618   -0.0567   -0.7310   -0.0567    0.0308    0    0.0745    0.0702
    2   -3    1    0   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1078    0.0995
    3    3    0    1   -0.0285    0.0975   -0.0262    0.0895    0.0084    1    0.1058    0.0967
    4   -2    1    1   -0.1983   -0.5990   -0.1957   -0.5833    0.0159    1    0.1138    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0696    0.0654
    6    2    1    1   -0.1139    0.1286   -0.1085    0.1216    0.0089    1    0.0834    0.0778
    7   -3    0    1    0.1223   -0.6041    0.1201   -0.5973    0.0072    1    0.1451    0.1302
    8   -3   -1    0    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1118    0.1017
    9    1    2    1   -0.2065    0.0527   -0.1952    0.0486    0.0120    1    0.0845    0.0726
   10   -1   -1    0    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0498    0.0467
   11   -2   -1    1    0.5431   -0.6214    0.5303   -0.6130    0.0152    1    0.1374    0.1248
   12    0    3    1   -0.1911   -0.0394   -0.1829   -0.0381    0.0084    1    0.1084    0.0984
   13   -1   -3    0    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1086    0.0927
   14   -2   -3    1    0.5364   -0.1516    0.5293   -0.1451    0.0096    1    0.1633    0.1473
   15   -1    2    1   -0.3473   -0.2448   -0.3362   -0.2357    0.0143    1    0.0957    0.0881
   16    0   -2    0    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0672    0.0679
   17   -1   -2    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1272    0.1198
   18   -2   -2    2    1.0767   -0.5174    1.0696   -0.4972    0.0215    1    0.2835    0.2483
   19    1   -3    0    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1049    0.0994
   20    0   -3    1    0.4520    0.1679    0.4423    0.1634    0.0106    1    0.1298    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0469    0.0568
   22    1   -2    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0988    0.0899
   23    2   -1    1    0.0368    0.2822    0.0347    0.2716    0.0108    1    0.0880    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2   -3    1    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    3    0    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -2    1    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5   -2    0    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6    2    1    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7   -3    0    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8   -3   -1    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9    1    2    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10   -1   -1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -2   -1    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    0    3    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13   -1   -3    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14   -2   -3    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15   -1    2    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0   -2    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17   -1   -2    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18   -2   -2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    1   -3    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    0   -3    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21   -1    1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1   -2    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23    2   -1    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.6                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0042    1.0073   92.0664   90.3187   90.8309      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0008    1.0008    0.9984   90.0000   90.0000   90.0000      0.3551         1.0025    1.0025    2.8181    2.8181    2.8112
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0374    0.0000    0.0000    0.0000      0.0266         0.0375    0.0375    0.2112    0.2112    0.2355
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2542    0.9516    0.2272)
 a2 = (   -0.9505   -0.2696    0.1309)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2389    0.9439    0.2242) (    0.0053    0.0019    0.0062)
 a2 = (   -0.9528   -0.2718    0.1293) (    0.0019    0.0056    0.0052)
 a3 = (    0.1836   -0.1833    0.9674) (    0.0120    0.0113    0.0348)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   60.0248   15.0147   45.0442    0.9406    0.4105    1.0486
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0001    0.0007      0.0022    0.0022    0.0377

# Number of computed bands
            400            139
# Figure of merit at the beginning and the end of the refinement
         4.1190        10.0152
# Chi-squares at the beginning and the end of the refinement
    0.2079    0.0331
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3   -1    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    0    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3    0    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    1    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -1   -2    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    2    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    3    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    2    3    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1   -2    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    2    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1    3    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1   -1    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -1    2    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    1    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7322   -0.0571   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2    3   -1    0   -0.0128   -0.1740   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3   -3    0    1   -0.0264    0.0896   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4    2   -1    1   -0.1947   -0.5856   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5    2    0    0    0.0569   -0.2232    0.0560   -0.2234    0.0009    1          0.0643          0.0654
    6   -2   -1    1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0767          0.0778
    7    3    0    1    0.1201   -0.5949    0.1201   -0.5973    0.0024    1          0.1323          0.1302
    8    3    1    0    0.1437   -0.2198    0.1454   -0.2240    0.0046    1          0.1032          0.1017
    9   -1   -2    1   -0.1953    0.0490   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11    2    1    1    0.5342   -0.6134    0.5303   -0.6130    0.0038    1          0.1244          0.1248
   12    0   -3    1   -0.1821   -0.0380   -0.1829   -0.0381    0.0008    1          0.0999          0.0984
   13    1    3    0    0.1976   -0.0083    0.1990   -0.0092    0.0016    1          0.1003          0.0927
   14    2    3    1    0.5301   -0.1495    0.5293   -0.1451    0.0045    1          0.1491          0.1473
   15    1   -2    1   -0.3362   -0.2374   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0    2    0    0.1259    0.0357    0.1275    0.0362    0.0017    1          0.0621          0.0679
   17    1    2    1    0.7307   -0.0809    0.7293   -0.0807    0.0013    1          0.1153          0.1198
   18    2    2    2    1.0607   -0.5143    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19   -1    3    0    0.0435    0.0288    0.0442    0.0295    0.0010    1          0.0968          0.0994
   20    0    3    1    0.4449    0.1659    0.4423    0.1634    0.0035    1          0.1184          0.1178
   21    1   -1    0   -0.0336   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1    2    1    0.2979    0.3351    0.3053    0.3413    0.0097    1          0.0898          0.0899
   23   -2    1    1    0.0343    0.2722    0.0347    0.2716    0.0007    1          0.0804          0.0816

###            No.9                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0009    1.0016   90.0451   90.1505   90.5950      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    0.9978    1.0045   90.0000   90.0000   90.0000      0.3552         0.9933    0.9933    2.8093    2.8093    2.8281
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0131    0.0000    0.0000    0.0000      0.0225         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1930   -0.1785    0.9674)
 a2 = (    0.9532    0.2704   -0.1295)
 a3 = (   -0.2364    0.9438    0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1837   -0.1834    0.9680) (    0.0045    0.0046    0.0012)
 a2 = (    0.9558    0.2723   -0.1298) (    0.0018    0.0055    0.0043)
 a3 = (   -0.2376    0.9406    0.2233) (    0.0066    0.0122    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.6388   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            139            149
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.7880
# Chi-squares at the beginning and the end of the refinement
    0.4127    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0    1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    1    0   -3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    1    1    2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    1    0    3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -1    2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    1    3    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1   -3    2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    1    2    1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -2    1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0   -3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    1   -3    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -2   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    1   -1   -2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0    1    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    1    0   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    1    1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    1    1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    1    0    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0   -1    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1    2   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1   -1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    1    3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0   -3    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    1   -3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    2    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0   -2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    1   -2    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2   -2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0   -3   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    1   -3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0    1    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    1   -2   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.10                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0042    1.0073    0.9894   90.3187   90.8309   92.0664      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    0.9978    1.0045   90.0000   90.0000   90.0000      0.3552         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0131    0.0000    0.0000    0.0000      0.0225         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9505   -0.2696    0.1309)
 a2 = (    0.1476   -0.1845    0.9649)
 a3 = (   -0.2542    0.9516    0.2272)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9558   -0.2723    0.1298) (    0.0018    0.0055    0.0043)
 a2 = (    0.1837   -0.1834    0.9680) (    0.0045    0.0046    0.0012)
 a3 = (   -0.2376    0.9406    0.2233) (    0.0066    0.0122    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.6388   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            400            149
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.7879
# Chi-squares at the beginning and the end of the refinement
    0.1525    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2   -1    0    3   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3    0    1   -3   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4   -1    1    2   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    0    0    2    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -1    1   -2   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    0    1    3    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    1    0    3    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -2    1   -1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    1    1    2    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12   -3    1    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    3    0    1    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    3    1    2    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15   -2    1    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    2    1    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19    3    0   -1    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    3    1    0    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21   -1    0    1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    2    1   -1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23    1    1   -2    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2   -1    0    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    0    1   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1    1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1    1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    0    1    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    1    0    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -2    1   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1    0    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1    1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -3    1    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    3    0    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    3    1    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2    1    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    2    0    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    2    1    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2    2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    3    0   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    3    1    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21   -1    0    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    2    1   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.11                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9834    1.0088    1.0081   89.9488   89.6978   89.2557      0.3878
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    0.9978    1.0045   90.0000   90.0000   90.0000      0.3552         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0131    0.0000    0.0000    0.0000      0.0225         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1724    0.1850   -0.9850)
 a2 = (   -0.9457   -0.2682    0.1285)
 a3 = (   -0.2349    0.9377    0.2226)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1837    0.1834   -0.9680) (    0.0045    0.0046    0.0012)
 a2 = (   -0.9558   -0.2723    0.1298) (    0.0018    0.0055    0.0043)
 a3 = (   -0.2376    0.9406    0.2233) (    0.0066    0.0122    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.3612   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            400            149
# Figure of merit at the beginning and the end of the refinement
         4.3518         9.7878
# Chi-squares at the beginning and the end of the refinement
    0.2916    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7618   -0.0567   -0.7310   -0.0567    0.0308    0    0.0745    0.0702
    2    0   -1    3   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1078    0.0995
    3   -1    0   -3   -0.0285    0.0975   -0.0262    0.0895    0.0084    1    0.1058    0.0967
    4   -1   -1    2   -0.1983   -0.5990   -0.1957   -0.5833    0.0159    1    0.1138    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0696    0.0654
    6   -1   -1   -2   -0.1139    0.1286   -0.1085    0.1216    0.0089    1    0.0834    0.0778
    7   -1    0    3    0.1223   -0.6041    0.1201   -0.5973    0.0072    1    0.1451    0.1302
    8    0    1    3    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1118    0.1017
    9   -1   -2   -1   -0.2065    0.0527   -0.1952    0.0486    0.0120    1    0.0845    0.0726
   10    0    1    1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0498    0.0467
   11   -1    1    2    0.5431   -0.6214    0.5303   -0.6130    0.0152    1    0.1374    0.1248
   12   -1   -3    0   -0.1911   -0.0394   -0.1829   -0.0381    0.0084    1    0.1084    0.0984
   13    0    3    1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1086    0.0927
   14   -1    3    2    0.5364   -0.1516    0.5293   -0.1451    0.0096    1    0.1633    0.1473
   15   -1   -2    1   -0.3473   -0.2448   -0.3362   -0.2357    0.0143    1    0.0957    0.0881
   16    0    2    0    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0672    0.0679
   17   -1    2    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1272    0.1198
   18   -2    2    2    1.0767   -0.5174    1.0696   -0.4972    0.0215    1    0.2835    0.2483
   19    0    3   -1    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1049    0.0994
   20   -1    3    0    0.4520    0.1679    0.4423    0.1634    0.0106    1    0.1298    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0469    0.0568
   22   -1    2   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0988    0.0899
   23   -1    1   -2    0.0368    0.2822    0.0347    0.2716    0.0108    1    0.0880    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0   -1    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3   -1    0   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1   -1    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1   -1   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7   -1    0    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0    1    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -1   -2   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -1    1    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -1   -3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0    3    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -1    3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1   -2    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0    2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1    2    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -2    2    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0    3   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -1    3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0   -1    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -1    2   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    1   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.12                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9996    1.0001    1.0003   89.9471   89.9533   89.9836      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    0.9978    1.0045   90.0000   90.0000   90.0000      0.3552         0.9933    0.9933    2.8093    2.8093    2.8281
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0131    0.0000    0.0000    0.0000      0.0225         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9543    0.2707   -0.1297)
 a2 = (    0.1828   -0.1826    0.9659)
 a3 = (    0.2367   -0.9450   -0.2243)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9558    0.2723   -0.1298) (    0.0018    0.0055    0.0043)
 a2 = (    0.1837   -0.1834    0.9680) (    0.0045    0.0046    0.0012)
 a3 = (    0.2376   -0.9406   -0.2233) (    0.0066    0.0122    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6388  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            151            150
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.7661
# Chi-squares at the beginning and the end of the refinement
    0.2893    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    1    0   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    0    1    3   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    1    1   -2   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    1    1    2   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    0    1   -3    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8   -1    0   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    2    1    1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1   -2    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    3    1    0   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13   -3    0   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -3    1   -2    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    2    1   -1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -2    1   -1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18   -2    2   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19   -3    0    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -3    1    0    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    1    0   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -2    1    1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23   -1    1    2    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    1    0   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    0    1    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    1    1   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    1    1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    0    1   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8   -1    0   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    2    1    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    0   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -1    1   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    3    1    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13   -3    0   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -3    1   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    2    1   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16   -2    0    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -2    1   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -2    2   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19   -3    0    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -3    1    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    1    0   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -2    1    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    1    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.14                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9971    1.0008    1.0022   90.0369   90.0865   90.2460      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    0.9978    1.0045   90.0000   90.0000   90.0000      0.3552         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0131    0.0000    0.0000    0.0000      0.0225         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1813   -0.1844    0.9691)
 a2 = (   -0.9530   -0.2703    0.1313)
 a3 = (    0.2364   -0.9436   -0.2222)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1837   -0.1834    0.9680) (    0.0045    0.0046    0.0012)
 a2 = (   -0.9558   -0.2723    0.1298) (    0.0018    0.0055    0.0043)
 a3 = (    0.2376   -0.9406   -0.2233) (    0.0066    0.0122    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.3612  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            155            151
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.7445
# Chi-squares at the beginning and the end of the refinement
    1.7406    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    0   -1   -3   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3    1    0    3   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    1   -1   -2   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0    0   -2    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6    1   -1    2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    1    0   -3    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    0    1   -3    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    1   -2    1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    1    1   -2    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    1   -3    0   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13    0    2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14    1    3   -2    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    1   -2   -1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    1    2   -1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    1    1   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19    0    3    1    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20    1    3    0    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    0   -1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22    1    2    1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23    1    1    2    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0   -1   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    1    0    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    1   -1   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    1   -1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    1    0   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0    1   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1   -2    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    1    1   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    1   -3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0    3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    1    3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -2   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0    2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    1    2   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    2    2   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0    3    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    1    3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0   -1   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    1    2    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    1    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.16                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9875    1.0057    1.0070   89.9624   89.9780   89.1504      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    0.9978    1.0045   90.0000   90.0000   90.0000      0.3552         0.9933    0.9933    2.8093    2.8093    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0131    0.0000    0.0000    0.0000      0.0225         0.0130    0.0130    0.1779    0.1779    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2012    0.1799   -0.9761)
 a2 = (    0.9484    0.2690   -0.1306)
 a3 = (    0.2352   -0.9391   -0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1837    0.1834   -0.9680) (    0.0045    0.0046    0.0012)
 a2 = (    0.9558    0.2723   -0.1298) (    0.0018    0.0055    0.0043)
 a3 = (    0.2376   -0.9406   -0.2233) (    0.0066    0.0122    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.6388  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            133            153
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.7018
# Chi-squares at the beginning and the end of the refinement
    3.2622    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    0    1   -2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -1    0    3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4   -1    1   -2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0   -1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -1    1    2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7   -1    0   -3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    0   -1   -2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -1    2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -1   -1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -1    3    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    0   -2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -1   -3   -2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15   -1    2   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0   -1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -1   -2   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18   -1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    0   -2    1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -1   -3    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    0    1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -1   -2    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -1   -1    2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    0    1   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3   -1    0    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4   -1    1   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6   -1    1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7   -1    0   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    0   -1   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -1    2    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -1   -1   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -1    3    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    0   -3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -1   -3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1    2   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0   -2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1   -2   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -2   -2   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    0   -3    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -1   -3    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    0    1   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -1   -2    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -1    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.17                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0001    1.0003    0.9996   89.9533   89.9836   89.9471      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0024    1.0024    0.9952   90.0000   90.0000   90.0000      0.3578         1.0072    1.0072    2.8013    2.8013    2.7812
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0138    0.0000    0.0000    0.0000      0.0227         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1828   -0.1826    0.9659)
 a2 = (    0.2367   -0.9450   -0.2243)
 a3 = (    0.9543    0.2707   -0.1297)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1821   -0.1819    0.9638) (    0.0046    0.0046    0.0012)
 a2 = (    0.2381   -0.9428   -0.2229) (    0.0054    0.0016    0.0045)
 a3 = (    0.9584    0.2727   -0.1296) (    0.0138    0.0061    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0211   97.4106  105.8841    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
            151            159
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.5469
# Chi-squares at the beginning and the end of the refinement
    0.2908    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    0   -3    1   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    1    3    0   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    1   -2    1   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    1    2    1   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    1   -3    0    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8    0   -3   -1    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    1    1    2   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -2   -1    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    1    0    3   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13    0   -1   -3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1   -2   -3    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    1   -1    2   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16    0    0   -2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17    1   -1   -2    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18    2   -2   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19    0    1   -3    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    1    0   -3    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    0   -1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1    1   -2    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23    1    2   -1    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0   -3    1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1    3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4    1   -2    1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0   -2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6    1    2    1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7    1   -3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0   -3   -1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9    1    1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0   -1   -1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -2   -1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12    1    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0   -1   -3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14    1   -2   -3    0.5299   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15    1   -1    2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17    1   -1   -2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18    2   -2   -2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0    1   -3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20    1    0   -3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1    1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22    1    1   -2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    2   -1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.18                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0016    1.0009   90.0451   90.5950   90.1505      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0024    1.0024    0.9952   90.0000   90.0000   90.0000      0.3578         1.0072    1.0072    2.8014    2.8014    2.7813
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0138    0.0000    0.0000    0.0000      0.0227         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1930    0.1785   -0.9674)
 a2 = (    0.2364   -0.9438   -0.2241)
 a3 = (   -0.9532   -0.2704    0.1295)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1821    0.1819   -0.9638) (    0.0046    0.0046    0.0012)
 a2 = (    0.2381   -0.9428   -0.2229) (    0.0054    0.0016    0.0045)
 a3 = (   -0.9584   -0.2727    0.1296) (    0.0138    0.0061    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.0211   82.5891  -74.1158    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
            139            159
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.5464
# Chi-squares at the beginning and the end of the refinement
    0.4250    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0   -3   -1   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1    3    0   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4   -1   -2   -1   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1    2   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7   -1   -3    0    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -3    1    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -1    1   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1   -2    1    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12   -1    0   -3   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -1    3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -1   -2    3    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15   -1   -1   -2   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0    0    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17   -1   -1    2    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18   -2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0    1    3    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20   -1    0    3    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0   -1   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1    1    2    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23   -1    2    1    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0   -3   -1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1    3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4   -1   -2   -1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0   -2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6   -1    2   -1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7   -1   -3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0   -3    1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9   -1    1   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0   -1    1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -2    1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12   -1    0   -3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0   -1    3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14   -1   -2    3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15   -1   -1   -2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17   -1   -1    2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18   -2   -2    2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0    1    3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20   -1    0    3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1   -1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22   -1    1    2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    2    1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.20                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9875    1.0070    1.0057   89.9624   89.1504   89.9780      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0023    1.0023    0.9954   90.0000   90.0000   90.0000      0.3580         1.0069    1.0069    2.7994    2.7994    2.7802
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0139    0.0000    0.0000    0.0000      0.0234         0.0141    0.0141    0.1826    0.1826    0.1855
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2012   -0.1799    0.9761)
 a2 = (   -0.2352    0.9391    0.2212)
 a3 = (   -0.9484   -0.2690    0.1306)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1820   -0.1817    0.9640) (    0.0046    0.0047    0.0012)
 a2 = (   -0.2382    0.9429    0.2227) (    0.0054    0.0017    0.0046)
 a3 = (   -0.9582   -0.2726    0.1295) (    0.0139    0.0062    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   76.9935   82.5923  -74.1166    0.2752    0.2450    0.3368
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0058      0.0021    0.0020    0.0138

# Number of computed bands
            133            160
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.5284
# Chi-squares at the beginning and the end of the refinement
    3.4525    0.0289
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    0    2   -1   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3    1   -3    0   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    1    2   -1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    1    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6    1   -2   -1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    1    3    0    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    0    2    1    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9    1   -1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    1    2    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    1    0   -3   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    0    1    2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    1    2    3    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    1    1   -2   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0    0    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    1    1    2    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    1    1    1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    0   -1    2    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20    1    0    3    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    0    1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22    1   -1    2    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23    1   -2    1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7312   -0.0586   -0.7310   -0.0567    0.0019    1          0.0664          0.0702
    2    0    3   -1   -0.0133   -0.1738   -0.0130   -0.1762    0.0024    1          0.0995          0.0995
    3    1   -3    0   -0.0267    0.0906   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1    2   -1   -0.1962   -0.5854   -0.1957   -0.5833    0.0021    1          0.1031          0.1078
    5    0    2    0    0.0567   -0.2235    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6    1   -2   -1   -0.1081    0.1202   -0.1085    0.1216    0.0014    1          0.0768          0.0778
    7    1    3    0    0.1202   -0.5962    0.1201   -0.5973    0.0011    1          0.1320          0.1302
    8    0    3    1    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1032          0.1017
    9    1   -1   -2   -0.1953    0.0483   -0.1952    0.0486    0.0003    1          0.0781          0.0726
   10    0    1    1    0.2257   -0.1265    0.2251   -0.1274    0.0011    1          0.0462          0.0467
   11    1    2    1    0.5361   -0.6126    0.5303   -0.6130    0.0058    1          0.1240          0.1248
   12    1    0   -3   -0.1812   -0.0380   -0.1829   -0.0381    0.0017    1          0.1005          0.0984
   13    0    1    3    0.1975   -0.0081    0.1990   -0.0092    0.0018    1          0.1009          0.0927
   14    1    2    3    0.5296   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    1    1   -2   -0.3356   -0.2361   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    0    0    2    0.1261    0.0356    0.1275    0.0362    0.0015    1          0.0625          0.0679
   17    1    1    2    0.7288   -0.0800    0.7293   -0.0807    0.0010    1          0.1151          0.1198
   18    2    2    2    1.0596   -0.5105    1.0696   -0.4972    0.0166    1          0.2520          0.2483
   19    0   -1    3    0.0441    0.0290    0.0442    0.0295    0.0005    1          0.0974          0.0994
   20    1    0    3    0.4444    0.1647    0.4423    0.1634    0.0024    1          0.1188          0.1178
   21    0    1   -1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0435          0.0568
   22    1   -1    2    0.2998    0.3340    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1   -2    1    0.0354    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.21                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0073    1.0042   92.0664   90.8309   90.3187      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0015    1.0015    0.9970   90.0000   90.0000   90.0000      0.3578         1.0046    1.0046    2.7988    2.7988    2.7861
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0145    0.0000    0.0000    0.0000      0.0235         0.0147    0.0147    0.1836    0.1836    0.1872
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2542   -0.9516   -0.2272)
 a2 = (   -0.1476    0.1845   -0.9649)
 a3 = (    0.9505    0.2696   -0.1309)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2378   -0.9438   -0.2229) (    0.0055    0.0017    0.0046)
 a2 = (   -0.1826    0.1819   -0.9647) (    0.0047    0.0046    0.0012)
 a3 = (    0.9568    0.2717   -0.1299) (    0.0144    0.0064    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.9864   97.4385  105.8553    0.2707    0.2517    0.3394
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0052      0.0021    0.0020    0.0139

# Number of computed bands
            400            163
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.5017
# Chi-squares at the beginning and the end of the refinement
    1.6190    0.0234
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2   -3    0    1   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3    3   -1    0   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4   -2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5   -2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6    2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7   -3   -1    0    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8   -3    0   -1    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    1   -1    2   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11   -2   -1   -1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -1    3   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13   -1    0   -3    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14   -2   -1   -3    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15   -1   -1    2   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1   -1   -2    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18   -2   -2   -2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19    1    0   -3    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0   -1   -3    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21   -1    0    1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    1   -1   -2    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23    2   -1   -1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7316   -0.0580   -0.7310   -0.0567    0.0014    1          0.0664          0.0702
    2   -3    0    1   -0.0133   -0.1738   -0.0130   -0.1762    0.0024    1          0.0996          0.0995
    3    3   -1    0   -0.0266    0.0904   -0.0262    0.0895    0.0011    1          0.0975          0.0967
    4   -2   -1    1   -0.1961   -0.5853   -0.1957   -0.5833    0.0020    1          0.1032          0.1078
    5   -2    0    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6    2   -1    1   -0.1078    0.1201   -0.1085    0.1216    0.0016    1          0.0768          0.0778
    7   -3   -1    0    0.1197   -0.5961    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -3    0   -1    0.1439   -0.2202    0.1454   -0.2240    0.0040    1          0.1033          0.1017
    9    1   -1    2   -0.1951    0.0485   -0.1952    0.0486    0.0002    1          0.0781          0.0726
   10   -1    0   -1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11   -2   -1   -1    0.5352   -0.6139    0.5303   -0.6130    0.0049    1          0.1241          0.1248
   12    0   -1    3   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1004          0.0984
   13   -1    0   -3    0.1981   -0.0084    0.1990   -0.0092    0.0011    1          0.1008          0.0927
   14   -2   -1   -3    0.5303   -0.1495    0.5293   -0.1451    0.0045    1          0.1493          0.1473
   15   -1   -1    2   -0.3357   -0.2363   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    0    0   -2    0.1266    0.0356    0.1275    0.0362    0.0011    1          0.0624          0.0679
   17   -1   -1   -2    0.7303   -0.0812    0.7293   -0.0807    0.0011    1          0.1152          0.1198
   18   -2   -2   -2    1.0603   -0.5137    1.0696   -0.4972    0.0189    1          0.2527          0.2483
   19    1    0   -3    0.0443    0.0291    0.0442    0.0295    0.0004    1          0.0973          0.0994
   20    0   -1   -3    0.4455    0.1649    0.4423    0.1634    0.0035    1          0.1188          0.1178
   21   -1    0    1   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0435          0.0568
   22    1   -1   -2    0.3000    0.3347    0.3053    0.3413    0.0084    1          0.0901          0.0899
   23    2   -1   -1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0806          0.0816

###            No.23                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9971    1.0022    1.0008   90.0369   90.2460   90.0865      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0024    1.0024    0.9952   90.0000   90.0000   90.0000      0.3578         1.0072    1.0072    2.8014    2.8014    2.7813
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0138    0.0000    0.0000    0.0000      0.0227         0.0140    0.0140    0.1775    0.1775    0.1804
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1813    0.1844   -0.9691)
 a2 = (   -0.2364    0.9436    0.2222)
 a3 = (    0.9530    0.2703   -0.1313)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1821    0.1819   -0.9638) (    0.0046    0.0046    0.0012)
 a2 = (   -0.2381    0.9428    0.2229) (    0.0054    0.0016    0.0045)
 a3 = (    0.9584    0.2727   -0.1296) (    0.0138    0.0061    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -76.9789   97.4109  105.8842    0.2691    0.2444    0.3361
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002   -0.0062      0.0021    0.0020    0.0137

# Number of computed bands
            155            163
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.4677
# Chi-squares at the beginning and the end of the refinement
    1.7994    0.0287
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    0    3    1   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3   -1   -3    0   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4   -1    2    1   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0    2    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6   -1   -2    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7   -1    3    0    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    0    3   -1    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9   -1   -1    2   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -1    2   -1    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12   -1    0    3   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13    0    1   -2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14   -1    2   -3    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15   -1    1    2   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    0    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -1    1   -2    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18   -1    1   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19    0   -1   -3    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20   -1    0   -3    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    0    1    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22   -1   -1   -2    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23   -1   -2   -1    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0585   -0.7310   -0.0567    0.0018    1          0.0663          0.0702
    2    0    3    1   -0.0133   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1   -3    0   -0.0267    0.0904   -0.0262    0.0895    0.0010    1          0.0973          0.0967
    4   -1    2    1   -0.1964   -0.5858   -0.1957   -0.5833    0.0025    1          0.1030          0.1078
    5    0    2    0    0.0568   -0.2239    0.0560   -0.2234    0.0010    1          0.0642          0.0654
    6   -1   -2    1   -0.1080    0.1200   -0.1085    0.1216    0.0017    1          0.0767          0.0778
    7   -1    3    0    0.1203   -0.5968    0.1201   -0.5973    0.0006    1          0.1319          0.1302
    8    0    3   -1    0.1444   -0.2203    0.1454   -0.2240    0.0039    1          0.1031          0.1017
    9   -1   -1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    0    1   -1    0.2260   -0.1266    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    2   -1    0.5367   -0.6130    0.5303   -0.6130    0.0064    1          0.1239          0.1248
   12   -1    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    0    1   -3    0.1977   -0.0081    0.1990   -0.0092    0.0016    1          0.1008          0.0927
   14   -1    2   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1491          0.1473
   15   -1    1    2   -0.3356   -0.2361   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1262    0.0356    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17   -1    1   -2    0.7291   -0.0798    0.7293   -0.0807    0.0009    1          0.1150          0.1198
   18   -2    2   -2    1.0605   -0.5104    1.0696   -0.4972    0.0161    1          0.2518          0.2483
   19    0   -1   -3    0.0441    0.0290    0.0442    0.0295    0.0006    1          0.0974          0.0994
   20   -1    0   -3    0.4445    0.1647    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1    1   -0.0335   -0.0574   -0.0341   -0.0579    0.0008    1          0.0434          0.0568
   22   -1   -1   -2    0.2998    0.3340    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -2   -1    0.0355    0.2737    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.25                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1212    1.1255    0.7925   90.1662   90.1315   90.5251      0.5719
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1254    1.1254    0.7896   90.0000   90.0000   90.0000      0.2844         1.4253    1.4253    3.9577    3.9577    2.7767
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0109    0.0000    0.0000    0.0000      0.0180         0.0197    0.0197    0.2507    0.2507    0.1800
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0342   -0.4783   -0.7521)
 a2 = (   -0.2625    0.7063   -0.4708)
 a3 = (    1.2034    0.3413   -0.1658)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0360   -0.4803   -0.7467) (    0.0037    0.0032    0.0021)
 a2 = (   -0.2633    0.7079   -0.4681) (    0.0051    0.0027    0.0033)
 a3 = (    1.2085    0.3424   -0.1620) (    0.0173    0.0078    0.0056)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -122.0832   97.3494  105.8190    0.2524    0.2450    0.3400
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0008   -0.0004   -0.0092      0.0021    0.0020    0.0135

# Number of computed bands
            181            296
# Figure of merit at the beginning and the end of the refinement
         2.3105         3.9059
# Chi-squares at the beginning and the end of the refinement
    4.6991    0.1570
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7338   -0.0581   -0.7310   -0.0567    0.0031    1    0.1353    0.0702
    2   -2    2    1   -0.0313   -0.1393   -0.0130   -0.1762    0.0412    1    0.1410    0.0995
    3    1   -2    0   -0.0273    0.0922   -0.0262    0.0895    0.0030    1    0.0983    0.0967
    4   -3    1    1   -0.1977   -0.5856   -0.1957   -0.5833    0.0030    1    0.2102    0.1078
    5   -1    1    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0648    0.0654
    6    1   -3    1   -0.1090    0.1214   -0.1085    0.1216    0.0006    1    0.1554    0.0778
    7   -2    1    0    0.1190   -0.5977    0.1201   -0.5973    0.0012    1    0.1340    0.1302
    8   -2    2   -1    0.1782   -0.2012    0.1454   -0.2240    0.0400    1    0.1482    0.1017
    9    0   -1    1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0788    0.0726
   10   -1    1   -1    0.2264   -0.1273    0.2251   -0.1274    0.0013    1    0.0933    0.0467
   11   -3    1   -1    0.5369   -0.6161    0.5303   -0.6130    0.0073    1    0.2543    0.1248
   12   -1    0    2   -0.1430   -0.0700   -0.1829   -0.0381    0.0511    1    0.1350    0.0984
   13   -1    1   -2    0.2191   -0.0407    0.1990   -0.0092    0.0374    1    0.1456    0.0927
   14   -2    1   -2    0.4419   -0.1582    0.5293   -0.1451    0.0884    1    0.1934    0.1473
   15   -1    0    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0887    0.0881
   16    0    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0631    0.0679
   17   -1    0   -1    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1174    0.1198
   18   -2    0   -1    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.2589    0.2483
   19    1   -1   -2    0.0134    0.0118    0.0442    0.0295    0.0355    1    0.1388    0.0994
   20   -1   -1   -3    0.4473    0.1656    0.4423    0.1634    0.0055    1    0.2426    0.1178
   21   -1    1    1   -0.0332   -0.0559   -0.0341   -0.0579    0.0022    1    0.0878    0.0568
   22    0   -1   -1    0.3021    0.3363    0.3053    0.3413    0.0059    1    0.0915    0.0899
   23    1   -3   -1    0.0359    0.2765    0.0347    0.2716    0.0050    1    0.1634    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7343   -0.0585   -0.7310   -0.0567    0.0038    1          0.0663          0.0702
    2   -3    3    1   -0.0129   -0.1726   -0.0130   -0.1762    0.0036    1          0.0992          0.0995
    3    2   -4    1   -0.0286    0.0439   -0.0262    0.0895    0.0456    1          0.1013          0.0967
    4   -3    1    1   -0.1961   -0.5856   -0.1957   -0.5833    0.0023    1          0.1027          0.1078
    5   -2    2    0    0.0569   -0.2221    0.0560   -0.2234    0.0016    1          0.0640          0.0654
    6    1   -3    1   -0.1091    0.1226   -0.1085    0.1216    0.0012    1          0.0766          0.0778
    7   -4    2    0    0.1206   -0.5957    0.1201   -0.5973    0.0017    1          0.1313          0.1302
    8   -3    3   -1    0.1440   -0.2186    0.1454   -0.2240    0.0056    1          0.1028          0.1017
    9    0   -2    2   -0.1968    0.0494   -0.1952    0.0486    0.0018    1          0.0780          0.0726
   10   -1    1   -1    0.2251   -0.1255    0.2251   -0.1274    0.0020    1          0.0460          0.0467
   11   -3    1   -1    0.5362   -0.6118    0.5303   -0.6130    0.0060    1          0.1232          0.1248
   12   -1   -1    3   -0.1821   -0.0376   -0.1829   -0.0381    0.0008    1          0.1003          0.0984
   13   -1    1   -3    0.1971   -0.0077    0.1990   -0.0092    0.0023    1          0.1006          0.0927
   14   -3    1   -3    0.5293   -0.1480    0.5293   -0.1451    0.0028    1          0.1486          0.1473
   15   -2    0    2   -0.3363   -0.2362   -0.3362   -0.2357    0.0005    1          0.0874          0.0881
   16    0    0   -2    0.1261    0.0358    0.1275    0.0362    0.0015    1          0.0623          0.0679
   17   -2    0   -2    0.7287   -0.0803    0.7293   -0.0807    0.0007    1          0.1145          0.1198
   18   -4    0   -2    1.0588   -0.5104    1.0696   -0.4972    0.0171    1          0.2501          0.2483
   19    1   -1   -3    0.0444    0.0294    0.0442    0.0295    0.0003    1          0.0972          0.0994
   20   -1   -1   -3    0.4453    0.1645    0.4423    0.1634    0.0032    1          0.1184          0.1178
   21   -1    1    1   -0.0329   -0.0565   -0.0341   -0.0579    0.0019    1          0.0434          0.0568
   22    0   -2   -2    0.3019    0.3349    0.3053    0.3413    0.0073    1          0.0899          0.0899
   23    1   -3   -1    0.0367    0.2764    0.0347    0.2716    0.0052    1          0.0803          0.0816

###            No.26                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1185    1.1228    0.7964   90.4131   90.4455   90.5251      0.5948
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1254    1.1254    0.7896   90.0000   90.0000   90.0000      0.2844         1.4253    1.4253    3.9577    3.9577    2.7767
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0109    0.0000    0.0000    0.0000      0.0180         0.0197    0.0197    0.2507    0.2507    0.1800
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0257    0.4819    0.7527)
 a2 = (    0.2718   -0.7056    0.4708)
 a3 = (    1.1976    0.3397   -0.1650)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0360    0.4803    0.7467) (    0.0037    0.0032    0.0021)
 a2 = (    0.2633   -0.7079    0.4681) (    0.0051    0.0027    0.0033)
 a3 = (    1.2085    0.3424   -0.1620) (    0.0173    0.0078    0.0056)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   57.9168   97.3494  105.8190    0.2524    0.2450    0.3400
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0008   -0.0004   -0.0092      0.0021    0.0020    0.0135

# Number of computed bands
            171            297
# Figure of merit at the beginning and the end of the refinement
         2.1182         3.9015
# Chi-squares at the beginning and the end of the refinement
    5.0429    0.1570
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7285   -0.0585   -0.7310   -0.0567    0.0032    1    0.1409    0.0702
    2    2   -2    1   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1468    0.0995
    3   -1    2    0   -0.0275    0.0915   -0.0262    0.0895    0.0024    1    0.1025    0.0967
    4    3   -1    1   -0.1988   -0.5835   -0.1957   -0.5833    0.0031    1    0.2191    0.1078
    5    1   -1    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0676    0.0654
    6   -1    3    1   -0.1089    0.1207   -0.1085    0.1216    0.0010    1    0.1622    0.0778
    7    2   -1    0    0.1156   -0.5974    0.1201   -0.5973    0.0045    1    0.1396    0.1302
    8    2   -2   -1    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1543    0.1017
    9    0    1    1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0822    0.0726
   10    1   -1   -1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0970    0.0467
   11    3   -1   -1    0.5321   -0.6234    0.5303   -0.6130    0.0106    1    0.2649    0.1248
   12    1    0    2   -0.1439   -0.0705   -0.1829   -0.0381    0.0507    1    0.1404    0.0984
   13    1   -1   -2    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1510    0.0927
   14    2   -1   -2    0.4432   -0.1614    0.5293   -0.1451    0.0877    1    0.2007    0.1473
   15    1    0    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    0    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0653    0.0679
   17    1    0   -1    0.7402   -0.0861    0.7293   -0.0807    0.0120    1    0.1222    0.1198
   18    2    0   -1    1.0701   -0.5348    1.0696   -0.4972    0.0376    1    0.2720    0.2483
   19   -1    1   -2    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1439    0.0994
   20    1    1   -3    0.4512    0.1676    0.4423    0.1634    0.0098    1    0.2512    0.1178
   21    1   -1    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0912    0.0568
   22    0    1   -1    0.3019    0.3408    0.3053    0.3413    0.0035    1    0.0947    0.0899
   23   -1    3   -1    0.0336    0.2766    0.0347    0.2716    0.0050    1    0.1697    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7343   -0.0585   -0.7310   -0.0567    0.0038    1          0.0663          0.0702
    2    3   -3    1   -0.0129   -0.1726   -0.0130   -0.1762    0.0036    1          0.0992          0.0995
    3   -2    4    1   -0.0286    0.0439   -0.0262    0.0895    0.0456    1          0.1013          0.0967
    4    3   -1    1   -0.1961   -0.5856   -0.1957   -0.5833    0.0023    1          0.1027          0.1078
    5    2   -2    0    0.0569   -0.2221    0.0560   -0.2234    0.0016    1          0.0640          0.0654
    6   -1    3    1   -0.1091    0.1226   -0.1085    0.1216    0.0012    1          0.0766          0.0778
    7    4   -2    0    0.1206   -0.5957    0.1201   -0.5973    0.0017    1          0.1313          0.1302
    8    3   -3   -1    0.1440   -0.2186    0.1454   -0.2240    0.0056    1          0.1028          0.1017
    9    0    2    2   -0.1968    0.0494   -0.1952    0.0486    0.0018    1          0.0780          0.0726
   10    1   -1   -1    0.2251   -0.1255    0.2251   -0.1274    0.0020    1          0.0460          0.0467
   11    3   -1   -1    0.5362   -0.6118    0.5303   -0.6130    0.0060    1          0.1232          0.1248
   12    1    1    3   -0.1821   -0.0376   -0.1829   -0.0381    0.0008    1          0.1003          0.0984
   13    1   -1   -3    0.1971   -0.0077    0.1990   -0.0092    0.0023    1          0.1006          0.0927
   14    3   -1   -3    0.5293   -0.1480    0.5293   -0.1451    0.0028    1          0.1486          0.1473
   15    2    0    2   -0.3363   -0.2362   -0.3362   -0.2357    0.0005    1          0.0874          0.0881
   16    0    0   -2    0.1261    0.0358    0.1275    0.0362    0.0015    1          0.0623          0.0679
   17    2    0   -2    0.7287   -0.0803    0.7293   -0.0807    0.0007    1          0.1145          0.1198
   18    4    0   -2    1.0588   -0.5104    1.0696   -0.4972    0.0171    1          0.2501          0.2483
   19   -1    1   -3    0.0444    0.0294    0.0442    0.0295    0.0003    1          0.0972          0.0994
   20    1    1   -3    0.4453    0.1645    0.4423    0.1634    0.0032    1          0.1184          0.1178
   21    1   -1    1   -0.0329   -0.0565   -0.0341   -0.0579    0.0019    1          0.0434          0.0568
   22    0    2   -2    0.3019    0.3349    0.3053    0.3413    0.0073    1          0.0899          0.0899
   23   -1    3   -1    0.0367    0.2764    0.0347    0.2716    0.0052    1          0.0803          0.0816

###            No.27                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1163    1.1344    0.7898   90.4012   90.0331   90.7307      0.3914
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1200    1.1200    0.7972   90.0000   90.0000   90.0000      0.2819         1.4048    1.4048    3.9730    3.9730    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0104    0.0000    0.0000    0.0000      0.0178         0.0183    0.0183    0.2516    0.2516    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4975    0.2872   -0.6875)
 a2 = (    0.7088    0.0549    0.5213)
 a3 = (    0.3081   -1.1963   -0.2779)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4864    0.2870   -0.6916) (    0.0037    0.0038    0.0024)
 a2 = (    0.7178    0.0560    0.5280) (    0.0023    0.0051    0.0031)
 a3 = (    0.2994   -1.1851   -0.2813) (    0.0083    0.0154    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -52.6388  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            179            178
# Figure of merit at the beginning and the end of the refinement
         3.1429         3.8427
# Chi-squares at the beginning and the end of the refinement
    2.2078    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0912    0.0702
    2    1    1   -3   -0.0121   -0.1689   -0.0130   -0.1762    0.0073    1    0.1385    0.0995
    3   -1    1    3   -0.0268    0.0902   -0.0262    0.0895    0.0010    1    0.1361    0.0967
    4    0    2   -2   -0.1855   -0.5793   -0.1957   -0.5833    0.0110    1    0.1420    0.1078
    5    0    0   -1    0.0561   -0.2179    0.0560   -0.2234    0.0055    1    0.0447    0.0654
    6    0    1    1   -0.1059    0.1189   -0.1085    0.1216    0.0037    1    0.0534    0.0778
    7   -1    1   -3    0.1237   -0.5822    0.1201   -0.5973    0.0155    1    0.1825    0.1302
    8   -1   -1   -2    0.1749   -0.1967    0.1454   -0.2240    0.0401    1    0.1021    0.1017
    9    1    3    1   -0.1918    0.0487   -0.1952    0.0486    0.0034    1    0.1079    0.0726
   10   -1   -1   -1    0.2225   -0.1255    0.2251   -0.1274    0.0033    1    0.0643    0.0467
   11   -1    0   -1    0.5271   -0.5948    0.5303   -0.6130    0.0185    1    0.0852    0.1248
   12    1    2    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0691    0.0984
   13   -2   -2   -1    0.2166   -0.0408    0.1990   -0.0092    0.0362    1    0.1000    0.0927
   14   -2   -1   -1    0.5210   -0.1468    0.5293   -0.1451    0.0084    1    0.1034    0.1473
   15    1    3   -1   -0.3308   -0.2355   -0.3362   -0.2357    0.0054    1    0.1203    0.0881
   16   -2   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0866    0.0679
   17   -3   -1   -1    0.7159   -0.0798    0.7293   -0.0807    0.0134    1    0.1593    0.1198
   18   -2    0   -1    1.0331   -0.4929    1.0696   -0.4972    0.0367    1    0.1709    0.2483
   19   -2   -2    1    0.0144    0.0129    0.0442    0.0295    0.0341    1    0.0950    0.0994
   20   -2   -1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0824    0.1178
   21    1    1   -1   -0.0316   -0.0542   -0.0341   -0.0579    0.0045    1    0.0603    0.0568
   22   -3   -1    1    0.2971    0.3316    0.3053    0.3413    0.0127    1    0.1253    0.0899
   23   -1    0    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0561    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    1    1   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3   -1    1    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    0    2   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    0    2    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7   -1    1   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8   -1   -1   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1    3    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1   -1   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    2    4    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13   -3   -3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -4   -2   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    3   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16   -2   -2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -3   -1   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -4    0   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19   -3   -3    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -4   -2    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    1    1   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -3   -1    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2    0    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.28                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1160    1.1342    0.7901   89.9292   89.9637   89.2690      0.3805
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1200    1.1200    0.7972   90.0000   90.0000   90.0000      0.2819         1.4048    1.4048    3.9730    3.9730    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0104    0.0000    0.0000    0.0000      0.0178         0.0183    0.0183    0.2516    0.2516    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4976    0.2873   -0.6876)
 a2 = (   -0.7090   -0.0550   -0.5214)
 a3 = (   -0.2997    1.1964    0.2840)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4864    0.2870   -0.6916) (    0.0037    0.0038    0.0024)
 a2 = (   -0.7178   -0.0560   -0.5280) (    0.0023    0.0051    0.0031)
 a3 = (   -0.2994    1.1851    0.2813) (    0.0083    0.0154    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -127.3612   77.0392 -165.8232    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            183            178
# Figure of merit at the beginning and the end of the refinement
         3.2106         3.8427
# Chi-squares at the beginning and the end of the refinement
    1.8682    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0887    0.0702
    2    1   -1    3   -0.0136   -0.1734   -0.0130   -0.1762    0.0029    1    0.1351    0.0995
    3   -1   -1   -3   -0.0250    0.0861   -0.0262    0.0895    0.0035    1    0.1319    0.0967
    4    0   -2    2   -0.1902   -0.5814   -0.1957   -0.5833    0.0059    1    0.1389    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0872    0.0654
    6    0   -2   -2   -0.1032    0.1168   -0.1085    0.1216    0.0071    1    0.1034    0.0778
    7   -1   -1    3    0.1207   -0.5892    0.1201   -0.5973    0.0081    1    0.1786    0.1302
    8   -1    1    3    0.1432   -0.2208    0.1454   -0.2240    0.0039    1    0.1402    0.1017
    9    1   -3   -1   -0.1903    0.0484   -0.1952    0.0486    0.0049    1    0.1045    0.0726
   10   -1    1    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0625    0.0467
   11   -1    0    1    0.5298   -0.6041    0.5303   -0.6130    0.0089    1    0.0835    0.1248
   12    1   -2    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0672    0.0984
   13   -2    2    1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.0972    0.0927
   14   -2    1    1    0.5257   -0.1487    0.5293   -0.1451    0.0051    1    0.1008    0.1473
   15    1   -3    1   -0.3322   -0.2355   -0.3362   -0.2357    0.0040    1    0.1174    0.0881
   16   -2    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0842    0.0679
   17   -3    1    1    0.7207   -0.0806    0.7293   -0.0807    0.0086    1    0.1555    0.1198
   18   -2    0    1    1.0412   -0.5000    1.0696   -0.4972    0.0285    1    0.1678    0.2483
   19   -3    3   -1    0.0446    0.0299    0.0442    0.0295    0.0006    1    0.1314    0.0994
   20   -2    1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0802    0.1178
   21    1   -1    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0588    0.0568
   22   -3    1   -1    0.2959    0.3287    0.3053    0.3413    0.0158    1    0.1217    0.0899
   23   -2    0   -2    0.0357    0.2673    0.0347    0.2716    0.0045    1    0.1089    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2    1   -1    3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3   -1   -1   -3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    0   -2    2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0    2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    0   -2   -2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7   -1   -1    3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8   -1    1    3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1   -3   -1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    1    1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0    2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12    2   -4    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13   -3    3    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -4    2    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -3    1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16   -2    2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -3    1    1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18   -4    0    2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19   -3    3   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20   -4    2    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21    1   -1    1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -3    1   -1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2    0   -2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###            No.31                ###
# Bravais type
   Tetragonal(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1092    1.1473    0.7863   91.2094   90.1241   91.6814      0.6102
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1200    1.1200    0.7972   90.0000   90.0000   90.0000      0.2819         1.4048    1.4048    3.9730    3.9730    2.8282
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0000    0.0104    0.0000    0.0000    0.0000      0.0178         0.0183    0.0183    0.2516    0.2516    0.1828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5128   -0.2900    0.6830)
 a2 = (   -0.7013   -0.0544   -0.5157)
 a3 = (    0.2788   -1.2049   -0.2976)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4864   -0.2870    0.6916) (    0.0037    0.0038    0.0024)
 a2 = (   -0.7178   -0.0560   -0.5280) (    0.0023    0.0051    0.0031)
 a3 = (    0.2994   -1.1851   -0.2813) (    0.0083    0.0154    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  127.3612  102.9608   14.1768    0.2526    0.2562    0.3253
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0004    0.0006      0.0021    0.0021    0.0115

# Number of computed bands
            400            179
# Figure of merit at the beginning and the end of the refinement
         1.6540         3.8355
# Chi-squares at the beginning and the end of the refinement
   10.1971    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -1   -1   -2   -0.0351   -0.1471   -0.0130   -0.1762    0.0365    1    0.1540    0.0995
    3    0   -1    1   -0.0936    0.1099   -0.0262    0.0895    0.0704    1    0.0818    0.0967
    4    0   -1   -1   -0.1948   -0.5806   -0.1957   -0.5833    0.0029    1    0.1124    0.1078
    5    0    0   -1    0.0542   -0.2345    0.0560   -0.2234    0.0112    1    0.0706    0.0654
    6    0   -1    1   -0.0936    0.1099   -0.1085    0.1216    0.0189    0    0.0818    0.0778
    7    1   -1   -3    0.1145   -0.5970    0.1201   -0.5973    0.0057    1    0.2918    0.1302
    8    1    1   -2    0.1824   -0.2127    0.1454   -0.2240    0.0387    1    0.1602    0.1017
    9   -1   -3    1   -0.1833    0.0476   -0.1952    0.0486    0.0119    1    0.1658    0.0726
   10    1    1   -1    0.2337   -0.1347    0.2251   -0.1274    0.0113    1    0.1005    0.0467
   11    1    0   -1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1355    0.1248
   12   -1   -2    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    2    2   -1    0.2253   -0.0430    0.1990   -0.0092    0.0429    1    0.1564    0.0927
   14    2    1   -1    0.5295   -0.1506    0.5293   -0.1451    0.0055    1    0.1631    0.1473
   15   -1   -3   -1   -0.3307   -0.2345   -0.3362   -0.2357    0.0057    1    0.1895    0.0881
   16    1    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    3    1   -1    0.7181   -0.0800    0.7293   -0.0807    0.0113    1    0.2511    0.1198
   18    2    0   -1    1.0373   -0.4970    1.0696   -0.4972    0.0322    1    0.2700    0.2483
   19    1    0    2   -0.0005    0.0325    0.0442    0.0295    0.0448    1    0.1421    0.0994
   20    2    1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1   -1   -1   -0.0372   -0.0617   -0.0341   -0.0579    0.0049    1    0.0957    0.0568
   22    3    1    1    0.2892    0.3140    0.3053    0.3413    0.0317    0    0.1959    0.0899
   23    1    0    1    0.0394    0.2516    0.0347    0.2716    0.0206    0    0.0872    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7302   -0.0574   -0.7310   -0.0567    0.0011    1          0.0666          0.0702
    2   -1   -1   -3   -0.0131   -0.1737   -0.0130   -0.1762    0.0024    1          0.0992          0.0995
    3    1   -1    3   -0.0267    0.0907   -0.0262    0.0895    0.0013    1          0.0971          0.0967
    4    0   -2   -2   -0.1968   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5    0    0   -2    0.0568   -0.2234    0.0560   -0.2234    0.0008    1          0.0640          0.0654
    6    0   -2    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0766          0.0778
    7    1   -1   -3    0.1201   -0.5968    0.1201   -0.5973    0.0005    1          0.1320          0.1302
    8    1    1   -3    0.1441   -0.2199    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9   -1   -3    1   -0.1953    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1    1   -1    0.2256   -0.1265    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    2    0   -2    0.5370   -0.6136    0.5303   -0.6130    0.0067    1          0.1244          0.1248
   12   -2   -4    0   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13    3    3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14    4    2   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1   -3   -1   -0.3357   -0.2359   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    2    2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    3    1   -1    0.7297   -0.0793    0.7293   -0.0807    0.0014    1          0.1153          0.1198
   18    4    0   -2    1.0630   -0.5108    1.0696   -0.4972    0.0152    1          0.2542          0.2483
   19    3    3    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0971          0.0994
   20    4    2    0    0.4444    0.1650    0.4423    0.1634    0.0026    1          0.1187          0.1178
   21   -1   -1   -1   -0.0333   -0.0574   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22    3    1    1    0.2993    0.3343    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    2    0    2    0.0353    0.2737    0.0347    0.2716    0.0021    1          0.0804          0.0816

###                                ###
### Candidates for Orthorhombic(F) ###
###                                ###

###            No.1                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2850    1.7648    1.7648   89.9919   88.6268   91.3421      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2595    1.7827    1.7814   90.0000   90.0000   90.0000      0.4483         0.7071    1.0008    2.8095    3.9765    3.9735
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0745    0.0752    0.0000    0.0000    0.0000      0.0300         0.0298    0.0143    0.1881    0.3138    0.3145
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1188    0.1484   -0.7551)
 a2 = (    0.4775   -0.2703   -0.1419)
 a3 = (   -0.2872   -0.4873   -0.0366)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1453    0.1456   -0.7668) (    0.0054    0.0050    0.0017)
 a2 = (    0.4728   -0.2672   -0.1403) (    0.0203    0.0126    0.0034)
 a3 = (   -0.2840   -0.4827   -0.0378) (    0.0127    0.0203    0.0028)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -104.5227   93.8651  -30.4694    0.4541    0.2751    0.3471
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0002    0.0004      0.0023    0.0022    0.0408

# Number of computed bands
            400             59
# Figure of merit at the beginning and the end of the refinement
         5.8773        33.3607
# Chi-squares at the beginning and the end of the refinement
    1.0286    0.0200
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    0   -2   -4   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -1    3    3   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -1   -1   -3   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0   -2   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -1    3    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -1   -3   -3    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    0   -4   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -1    3   -1   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -1   -3   -1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -1    3   -3   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    0   -4    2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -1   -5    1    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1    1   -3   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0   -2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1   -3    1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -2   -4    0    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    0   -2    4    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -1   -3    3    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    0    0   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -1   -1    3    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -1    1    3    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7313   -0.0569   -0.7310   -0.0567    0.0004    1          0.0666          0.0702
    2    0   -2   -4   -0.0131   -0.1743   -0.0130   -0.1762    0.0019    1          0.0998          0.0995
    3   -1    3    3   -0.0261    0.0889   -0.0262    0.0895    0.0006    1          0.0976          0.0967
    4   -1   -1   -3   -0.1950   -0.5849   -0.1957   -0.5833    0.0017    1          0.1035          0.1078
    5    0   -2   -2    0.0566   -0.2235    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -1    3    1   -0.1066    0.1193   -0.1085    0.1216    0.0029    1          0.0768          0.0778
    7   -1   -3   -3    0.1193   -0.5946    0.1201   -0.5973    0.0028    1          0.1325          0.1302
    8    0   -4   -2    0.1434   -0.2202    0.1454   -0.2240    0.0043    1          0.1034          0.1017
    9   -1    3   -1   -0.1949    0.0489   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -2    0    0.2252   -0.1273    0.2251   -0.1274    0.0002    1          0.0461          0.0467
   11   -1   -3   -1    0.5331   -0.6134    0.5303   -0.6130    0.0028    1          0.1245          0.1248
   12   -1    3   -3   -0.1819   -0.0380   -0.1829   -0.0381    0.0010    1          0.1001          0.0984
   13    0   -4    2    0.1974   -0.0085    0.1990   -0.0092    0.0017    1          0.1005          0.0927
   14   -1   -5    1    0.5295   -0.1498    0.5293   -0.1451    0.0047    1          0.1493          0.1473
   15   -1    1   -3   -0.3360   -0.2371   -0.3362   -0.2357    0.0014    1          0.0877          0.0881
   16    0   -2    2    0.1256    0.0355    0.1275    0.0362    0.0021    1          0.0622          0.0679
   17   -1   -3    1    0.7295   -0.0813    0.7293   -0.0807    0.0006    1          0.1154          0.1198
   18   -2   -4    0    1.0589   -0.5144    1.0696   -0.4972    0.0203    1          0.2540          0.2483
   19    0   -2    4    0.0432    0.0285    0.0442    0.0295    0.0014    1          0.0971          0.0994
   20   -1   -3    3    0.4440    0.1652    0.4423    0.1634    0.0024    1          0.1186          0.1178
   21    0    0   -2   -0.0339   -0.0584   -0.0341   -0.0579    0.0005    1          0.0435          0.0568
   22   -1   -1    3    0.2973    0.3338    0.3053    0.3413    0.0110    1          0.0900          0.0899
   23   -1    1    3    0.0344    0.2710    0.0347    0.2716    0.0007    1          0.0806          0.0816

###            No.2                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2539    1.7678    1.8054   88.9249   88.5648   90.0787      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2567    1.7837    1.7845   90.0000   90.0000   90.0000      0.4456         0.7042    0.9995    2.8203    4.0032    4.0050
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0701    0.0676    0.0000    0.0000    0.0000      0.0288         0.0267    0.0140    0.1821    0.3026    0.2998
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1625    0.1567   -0.7651)
 a2 = (    0.2776    0.4913    0.0406)
 a3 = (    0.4669   -0.2643   -0.1388)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1459    0.1466   -0.7684) (    0.0050    0.0047    0.0015)
 a2 = (    0.2832    0.4823    0.0382) (    0.0118    0.0189    0.0028)
 a3 = (    0.4726   -0.2664   -0.1405) (    0.0184    0.0113    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -85.9620  104.5217   60.5896    0.2787    0.4126    0.3379
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0002    0.0045      0.0023    0.0022    0.0382

# Number of computed bands
            400             58
# Figure of merit at the beginning and the end of the refinement
         8.6014        32.4721
# Chi-squares at the beginning and the end of the refinement
    0.9187    0.0273
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    0    4   -2   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3   -1   -3    3   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -1    3   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    0    2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -1   -1    3   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -1    3   -3    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    0    2   -4    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9   -1    1    3   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -1    1   -3    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12   -1    3    3   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    0   -2   -4    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -1   -1   -5    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1    3    1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0   -2   -2    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1   -1   -3    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    0   -4    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    0   -4   -2    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20   -1   -3   -3    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    0    2    0   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22   -1   -3   -1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -1   -3    1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7307   -0.0564   -0.7310   -0.0567    0.0004    1          0.0666          0.0702
    2    0    4   -2   -0.0129   -0.1746   -0.0130   -0.1762    0.0016    1          0.0995          0.0995
    3   -1   -3    3   -0.0261    0.0885   -0.0262    0.0895    0.0009    1          0.0973          0.0967
    4   -1    3   -1   -0.1950   -0.5853   -0.1957   -0.5833    0.0021    1          0.1035          0.1078
    5    0    2   -2    0.0569   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1   -1    3   -0.1066    0.1191   -0.1085    0.1216    0.0031    1          0.0767          0.0778
    7   -1    3   -3    0.1199   -0.5947    0.1201   -0.5973    0.0026    1          0.1324          0.1302
    8    0    2   -4    0.1436   -0.2199    0.1454   -0.2240    0.0045    1          0.1032          0.1017
    9   -1    1    3   -0.1949    0.0488   -0.1952    0.0486    0.0004    1          0.0778          0.0726
   10    0    0   -2    0.2250   -0.1268    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11   -1    1   -3    0.5339   -0.6127    0.5303   -0.6130    0.0036    1          0.1246          0.1248
   12   -1    3    3   -0.1821   -0.0381   -0.1829   -0.0381    0.0007    1          0.0999          0.0984
   13    0   -2   -4    0.1968   -0.0083    0.1990   -0.0092    0.0023    1          0.1002          0.0927
   14   -1   -1   -5    0.5290   -0.1489    0.5293   -0.1451    0.0037    1          0.1491          0.1473
   15   -1    3    1   -0.3362   -0.2372   -0.3362   -0.2357    0.0015    1          0.0876          0.0881
   16    0   -2   -2    0.1249    0.0354    0.1275    0.0362    0.0027    1          0.0620          0.0679
   17   -1   -1   -3    0.7289   -0.0800    0.7293   -0.0807    0.0009    1          0.1153          0.1198
   18   -2    0   -4    1.0600   -0.5122    1.0696   -0.4972    0.0178    1          0.2547          0.2483
   19    0   -4   -2    0.0427    0.0282    0.0442    0.0295    0.0020    1          0.0967          0.0994
   20   -1   -3   -3    0.4429    0.1655    0.4423    0.1634    0.0022    1          0.1183          0.1178
   21    0    2    0   -0.0341   -0.0588   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -1   -3   -1    0.2961    0.3334    0.3053    0.3413    0.0121    1          0.0898          0.0899
   23   -1   -3    1    0.0340    0.2703    0.0347    0.2716    0.0015    1          0.0804          0.0816

###            No.3                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2460    1.7905    1.7932   89.9965   89.3304   89.3100      0.4564
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2574    1.7854    1.7818   90.0000   90.0000   90.0000      0.4472         0.7057    1.0020    2.8117    3.9925    3.9845
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0696    0.0669    0.0000    0.0000    0.0000      0.0283         0.0265    0.0135    0.1782    0.2971    0.2935
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1599    0.1433   -0.7734)
 a2 = (    0.2830    0.4801    0.0375)
 a3 = (    0.4699   -0.2660   -0.1397)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1459    0.1456   -0.7682) (    0.0049    0.0045    0.0015)
 a2 = (    0.2829    0.4819    0.0376) (    0.0116    0.0188    0.0026)
 a3 = (    0.4733   -0.2669   -0.1405) (    0.0183    0.0112    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -86.0236  104.4937   60.5819    0.2621    0.4054    0.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
             57             73
# Figure of merit at the beginning and the end of the refinement
        19.8589        30.7603
# Chi-squares at the beginning and the end of the refinement
    0.3771    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0    4   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1   -3    3   -0.0282    0.0931   -0.0262    0.0895    0.0042    1    0.0990    0.0967
    4   -1    3   -1   -0.2022   -0.5864   -0.1957   -0.5833    0.0072    1    0.1057    0.1078
    5    0    2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -1   -1    3   -0.1110    0.1226   -0.1085    0.1216    0.0027    1    0.0783    0.0778
    7   -1    3   -3    0.1149   -0.6008    0.1201   -0.5973    0.0063    1    0.1350    0.1302
    8    0    2   -4    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -1    1    3   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    1   -3    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -1    3    3   -0.1851   -0.0382   -0.1829   -0.0381    0.0023    1    0.1022    0.0984
   13    0   -2   -4    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14   -1   -1   -5    0.5363   -0.1533    0.5293   -0.1451    0.0108    1    0.1517    0.1473
   15   -1    3    1   -0.3395   -0.2367   -0.3362   -0.2357    0.0035    1    0.0897    0.0881
   16    0   -2   -2    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17   -1   -1   -3    0.7439   -0.0847    0.7293   -0.0807    0.0151    1    0.1181    0.1198
   18   -2    0   -4    1.0814   -0.5390    1.0696   -0.4972    0.0434    1    0.2650    0.2483
   19    0   -4   -2    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -1   -3   -3    0.4514    0.1690    0.4423    0.1634    0.0106    1    0.1204    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1   -3   -1    0.3014    0.3427    0.3053    0.3413    0.0041    1    0.0914    0.0899
   23   -1   -3    1    0.0329    0.2780    0.0347    0.2716    0.0066    1    0.0818    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0    4   -2   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1   -3    3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -1    3   -1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0    2   -2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1   -1    3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7   -1    3   -3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0    2   -4    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9   -1    1    3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0   -2    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11   -1    1   -3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12   -1    3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0   -2   -4    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1   -1   -5    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1    3    1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0   -2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1   -1   -3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18   -2    0   -4    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0   -4   -2    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20   -1   -3   -3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1   -3   -1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -1   -3    1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.4                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2426    1.7941    1.7944   90.0058   89.4412   90.1811      0.5055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2574    1.7854    1.7818   90.0000   90.0000   90.0000      0.4472         0.7057    1.0020    2.8117    3.9925    3.9845
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0696    0.0669    0.0000    0.0000    0.0000      0.0283         0.0265    0.0135    0.1782    0.2971    0.2935
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1422    0.1417   -0.7794)
 a2 = (   -0.2824   -0.4791   -0.0374)
 a3 = (   -0.4695    0.2658    0.1396)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1459    0.1456   -0.7682) (    0.0049    0.0045    0.0015)
 a2 = (   -0.2829   -0.4819   -0.0376) (    0.0116    0.0188    0.0026)
 a3 = (   -0.4733    0.2669    0.1405) (    0.0183    0.0112    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -93.9764   75.5063 -119.4181    0.2621    0.4054    0.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
             75             73
# Figure of merit at the beginning and the end of the refinement
         9.3876        30.7603
# Chi-squares at the beginning and the end of the refinement
    0.2713    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7526   -0.0603   -0.7310   -0.0567    0.0219    1    0.0767    0.0702
    2    0   -4    2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1117    0.0995
    3   -1    3   -3   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.1094    0.0967
    4   -1   -3    1   -0.1979   -0.5945   -0.1957   -0.5833    0.0114    1    0.1176    0.1078
    5    0   -2    2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0721    0.0654
    6   -1    1   -3   -0.1133    0.1267   -0.1085    0.1216    0.0070    1    0.0863    0.0778
    7   -1   -3    3    0.1206   -0.6019    0.1201   -0.5973    0.0046    1    0.1501    0.1302
    8    0   -2    4    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1159    0.1017
    9   -1   -1   -3   -0.2043    0.0513   -0.1952    0.0486    0.0095    1    0.0877    0.0726
   10    0    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0516    0.0467
   11   -1   -1    3    0.5388   -0.6214    0.5303   -0.6130    0.0120    1    0.1419    0.1248
   12   -1   -3   -3   -0.1891   -0.0393   -0.1829   -0.0381    0.0063    1    0.1125    0.0984
   13    0    2    4    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1126    0.0927
   14   -1    1    5    0.5353   -0.1524    0.5293   -0.1451    0.0095    1    0.1689    0.1473
   15   -1   -3   -1   -0.3440   -0.2429   -0.3362   -0.2357    0.0106    1    0.0992    0.0881
   16    0    2    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0697    0.0679
   17   -1    1    3    0.7398   -0.0844    0.7293   -0.0807    0.0111    1    0.1314    0.1198
   18   -2    0    4    1.0717   -0.5244    1.0696   -0.4972    0.0274    1    0.2927    0.2483
   19    0    4    2    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1087    0.0994
   20   -1    3    3    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1341    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0486    0.0568
   22   -1    3    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1019    0.0899
   23   -1    3   -1    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0908    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0   -4    2   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1    3   -3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -1   -3    1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0   -2    2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1    1   -3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7   -1   -3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0   -2    4    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9   -1   -1   -3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0    2    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11   -1   -1    3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12   -1   -3   -3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0    2    4    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    1    5    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1   -3   -1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0    2    2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1    1    3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18   -2    0    4    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0    4    2    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20   -1    3    3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0   -2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1    3    1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -1    3   -1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.5                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2572    1.7816    1.7859   90.1012   89.7936   89.9845      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2574    1.7818    1.7854   90.0000   90.0000   90.0000      0.4472         0.7042    0.9980    2.8117    3.9845    3.9925
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0669    0.0696    0.0000    0.0000    0.0000      0.0283         0.0275    0.0135    0.1782    0.2935    0.2971
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1490   -0.1444    0.7679)
 a2 = (   -0.4731    0.2666    0.1418)
 a3 = (   -0.2837   -0.4813   -0.0376)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1459   -0.1456    0.7682) (    0.0049    0.0045    0.0015)
 a2 = (   -0.4733    0.2669    0.1405) (    0.0183    0.0112    0.0034)
 a3 = (   -0.2829   -0.4819   -0.0376) (    0.0116    0.0188    0.0026)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   75.4728   93.8497  -30.4148    0.4072    0.2522    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
             79             73
# Figure of merit at the beginning and the end of the refinement
         4.7313        30.7603
# Chi-squares at the beginning and the end of the refinement
    0.4748    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2    0    2   -4   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    1   -3    3   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4    1    1   -3   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5    0    2   -2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1   -3    1   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7    1    3   -3    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8    0    4   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1   -3   -1   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10    0    2    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1    3   -1    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12    1   -3   -3   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13    0    4    2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    1    5    1    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15    1   -1   -3   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    0    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1    3    1    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18    2    4    0    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19    0    2    4    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    1    3    3    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21    0    0   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1    1    3    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23    1   -1    3    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0    2   -4   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1   -3    3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1    1   -3   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0    2   -2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6    1   -3    1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    1    3   -3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0    4   -2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1   -3   -1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1    3   -1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    1   -3   -3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0    4    2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    5    1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    1   -1   -3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0    2    2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17    1    3    1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    2    4    0    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0    2    4    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20    1    3    3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    0   -2   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1    1    3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1   -1    3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.7                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2584    1.7827    1.7830   89.9960   90.0456   89.8782      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2574    1.7854    1.7818   90.0000   90.0000   90.0000      0.4472         0.7057    1.0020    2.8117    3.9925    3.9845
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0696    0.0669    0.0000    0.0000    0.0000      0.0283         0.0265    0.0135    0.1782    0.2971    0.2935
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1470   -0.1446    0.7674)
 a2 = (   -0.2842   -0.4821   -0.0376)
 a3 = (    0.4725   -0.2675   -0.1405)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1459   -0.1456    0.7682) (    0.0049    0.0045    0.0015)
 a2 = (   -0.2829   -0.4819   -0.0376) (    0.0116    0.0188    0.0026)
 a3 = (    0.4733   -0.2669   -0.1405) (    0.0183    0.0112    0.0034)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   93.9764  104.4937   60.5819    0.2621    0.4054    0.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            175             73
# Figure of merit at the beginning and the end of the refinement
         3.4923        30.7603
# Chi-squares at the beginning and the end of the refinement
    0.4924    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2    0   -4   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3    1    3    3   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4    2   -6   -2   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5    0   -2   -2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6    1    1    3   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7    1   -3   -3    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8    0   -2   -4    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9    1   -1    3   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    1   -1   -3    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12    1   -3    3   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13    0    2   -4    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14    1    1   -5    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15    1   -3    1   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16    0    4   -4    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17    2    2   -6    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18    2    0   -4    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19    0    6   -4    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20    1    3   -3    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21    0   -4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22    1    3   -1    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23    1    3    1    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0   -4   -2   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1    3    3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1   -3   -1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0   -2   -2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6    1    1    3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    1   -3   -3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0   -2   -4    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1   -1    3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0   -2    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1   -1   -3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    1   -3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0    2   -4    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    1   -5    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    1   -3    1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0    2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17    1    1   -3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    2    0   -4    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0    4   -2    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20    1    3   -3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0   -2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1    3   -1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1    3    1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.9                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2563    1.7844    1.7844   90.0404   89.7079   90.0299      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2574    1.7818    1.7854   90.0000   90.0000   90.0000      0.4472         0.7042    0.9980    2.8117    3.9845    3.9925
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0669    0.0696    0.0000    0.0000    0.0000      0.0283         0.0275    0.0135    0.1782    0.2935    0.2971
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1451   -0.1480    0.7686)
 a2 = (    0.4722   -0.2673   -0.1403)
 a3 = (    0.2840    0.4818    0.0362)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1459   -0.1456    0.7682) (    0.0049    0.0045    0.0015)
 a2 = (    0.4733   -0.2669   -0.1405) (    0.0183    0.0112    0.0034)
 a3 = (    0.2829    0.4819    0.0376) (    0.0116    0.0188    0.0026)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  104.5272   86.1503  149.5852    0.4072    0.2522    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            173             73
# Figure of merit at the beginning and the end of the refinement
         3.3422        30.7603
# Chi-squares at the beginning and the end of the refinement
    1.2407    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    2   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    0   -4    6    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    1    3   -3   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2   -2    6   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0   -4    4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2    6   -2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    1   -3    3    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    0   -4    2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1    3    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    0   -4    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -6    2    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    1    3    3   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    0   -4   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1   -5   -1    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    2    2    6   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0   -4   -4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    2   -6   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    2   -4    0    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    0   -4   -6    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    1   -3   -3    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    0    0    4   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1   -1   -3    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    2    2   -6    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0   -2    4   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1    3   -3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1   -1    3   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0   -2    2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6    1    3   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    1   -3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0   -4    2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1    3    1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1   -3    1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    1    3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0   -4   -2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -5   -1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    1    1    3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0   -2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17    1   -3   -1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    2   -4    0    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0   -2   -4    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20    1   -3   -3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    0    2   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1   -1   -3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1    1   -3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.11                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2621    1.7787    1.7824   89.9004   90.0673   88.6476      0.5864
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2574    1.7818    1.7854   90.0000   90.0000   90.0000      0.4472         0.7042    0.9980    2.8117    3.9845    3.9925
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0669    0.0696    0.0000    0.0000    0.0000      0.0283         0.0275    0.0135    0.1782    0.2935    0.2971
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1306    0.1381   -0.7694)
 a2 = (   -0.4740    0.2672    0.1421)
 a3 = (    0.2842    0.4822    0.0376)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1459    0.1456   -0.7682) (    0.0049    0.0045    0.0015)
 a2 = (   -0.4733    0.2669    0.1405) (    0.0183    0.0112    0.0034)
 a3 = (    0.2829    0.4819    0.0376) (    0.0116    0.0188    0.0026)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -75.4728   86.1503  149.5852    0.4072    0.2522    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
             93             73
# Figure of merit at the beginning and the end of the refinement
         4.4867        30.7603
# Chi-squares at the beginning and the end of the refinement
    0.8967    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7426   -0.0643   -0.7310   -0.0567    0.0138    1    0.0873    0.0702
    2    0    2    4   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3   -1   -3   -3   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4   -1    1    3   -0.1903   -0.5886   -0.1957   -0.5833    0.0076    1    0.1359    0.1078
    5    0    2    2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1   -3   -1   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7   -1    3    3    0.1236   -0.5945    0.1201   -0.5973    0.0045    1    0.1744    0.1302
    8    0    4    2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -1   -3    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10    0    2    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -1    3    1    0.5339   -0.6072    0.5303   -0.6130    0.0068    1    0.1638    0.1248
   12   -1   -3    3   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13    0    4   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -1    5   -1    0.5290   -0.1499    0.5293   -0.1451    0.0048    1    0.1972    0.1473
   15   -1   -1    3   -0.3363   -0.2403   -0.3362   -0.2357    0.0046    1    0.1145    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1    3   -1    0.7254   -0.0834    0.7293   -0.0807    0.0048    1    0.1520    0.1198
   18   -2    4    0    1.0437   -0.5058    1.0696   -0.4972    0.0272    1    0.3317    0.2483
   19    0    2   -4    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -1    3   -3    0.4455    0.1628    0.4423    0.1634    0.0032    1    0.1563    0.1178
   21    0    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1    1   -3    0.3016    0.3323    0.3053    0.3413    0.0098    1    0.1182    0.0899
   23   -1   -1   -3    0.0366    0.2729    0.0347    0.2716    0.0022    1    0.1052    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0    2    4   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -1   -3   -3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -1    1    3   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0    2    2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1   -3   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7   -1    3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0    4    2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9   -1   -3    1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11   -1    3    1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12   -1   -3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0    4   -2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    5   -1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1   -1    3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0    2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1    3   -1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18   -2    4    0    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0    2   -4    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20   -1    3   -3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    0    2   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1    1   -3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -1   -1   -3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.16                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2478    1.7910    1.7917   88.3247   88.6209   88.6241      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2564    1.7835    1.7851   90.0000   90.0000   90.0000      0.4498         0.7038    0.9991    2.7931    3.9652    3.9686
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0324    0.0330    0.0000    0.0000    0.0000      0.0312         0.0130    0.0206    0.1936    0.2841    0.2847
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7647   -0.2169    0.1053)
 a2 = (   -0.1545    0.4530   -0.2883)
 a3 = (    0.0358   -0.3046   -0.4668)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7593   -0.2157    0.1027) (    0.0015    0.0046    0.0036)
 a2 = (   -0.1668    0.4473   -0.2940) (    0.0051    0.0094    0.0043)
 a3 = (    0.0220   -0.3017   -0.4715) (    0.0026    0.0074    0.0083)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  166.1827  147.3142    4.1657    0.4998    0.4303    0.4767
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0028      0.0021    0.0024    0.0156

# Number of computed bands
            400             84
# Figure of merit at the beginning and the end of the refinement
         5.8773        30.7162
# Chi-squares at the beginning and the end of the refinement
    0.2476    0.0186
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -1    3   -3   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    0   -4    2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -1    1   -3   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0    2   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -1   -3    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    0    2   -4    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    1    3   -3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -2   -2    0   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    1    1   -3    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -3   -1   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    3    1   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    3    1   -3    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -2    0   -2   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    2    0   -2    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    2    0   -4    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    3   -1    1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    3   -1   -1    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1    1   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    2   -2    0    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    1   -3    1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7305   -0.0570   -0.7310   -0.0567    0.0006    1          0.0664          0.0702
    2   -1    3   -3   -0.0133   -0.1743   -0.0130   -0.1762    0.0020    1          0.0996          0.0995
    3    0   -4    2   -0.0264    0.0894   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4   -1    1   -3   -0.1961   -0.5853   -0.1957   -0.5833    0.0020    1          0.1033          0.1078
    5    0    2   -2    0.0566   -0.2237    0.0560   -0.2234    0.0008    1          0.0643          0.0654
    6   -1   -3    1   -0.1072    0.1194   -0.1085    0.1216    0.0025    1          0.0768          0.0778
    7    0    2   -4    0.1197   -0.5957    0.1201   -0.5973    0.0016    1          0.1322          0.1302
    8    1    3   -3    0.1438   -0.2202    0.1454   -0.2240    0.0041    1          0.1033          0.1017
    9   -2   -2    0   -0.1947    0.0484   -0.1952    0.0486    0.0005    1          0.0781          0.0726
   10    1    1   -1    0.2254   -0.1269    0.2251   -0.1274    0.0006    1          0.0462          0.0467
   11    1    1   -3    0.5348   -0.6129    0.5303   -0.6130    0.0045    1          0.1242          0.1248
   12   -3   -1   -1   -0.1813   -0.0379   -0.1829   -0.0381    0.0016    1          0.1004          0.0984
   13    3    1   -1    0.1973   -0.0085    0.1990   -0.0092    0.0018    1          0.1008          0.0927
   14    3    1   -3    0.5291   -0.1489    0.5293   -0.1451    0.0038    1          0.1493          0.1473
   15   -2    0   -2   -0.3358   -0.2362   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    2    0    0    0.1258    0.0353    0.1275    0.0362    0.0019    1          0.0624          0.0679
   17    2    0   -2    0.7285   -0.0805    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    2    0   -4    1.0591   -0.5114    1.0696   -0.4972    0.0177    1          0.2528          0.2483
   19    3   -1    1    0.0436    0.0286    0.0442    0.0295    0.0011    1          0.0973          0.0994
   20    3   -1   -1    0.4438    0.1645    0.4423    0.1634    0.0018    1          0.1187          0.1178
   21   -1    1   -1   -0.0338   -0.0580   -0.0341   -0.0579    0.0004    1          0.0435          0.0568
   22    2   -2    0    0.2984    0.3333    0.3053    0.3413    0.0106    1          0.0900          0.0899
   23    1   -3    1    0.0350    0.2721    0.0347    0.2716    0.0005    1          0.0805          0.0816

###            No.23                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2752    1.7546    1.7884   90.1128   88.4804   89.8254      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2545    1.7814    1.7899   90.0000   90.0000   90.0000      0.4502         0.7009    0.9952    2.7866    3.9569    3.9758
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0318    0.0301    0.0000    0.0000    0.0000      0.0301         0.0118    0.0190    0.1864    0.2739    0.2742
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7445    0.2270   -0.0982)
 a2 = (    0.1759   -0.4562    0.2929)
 a3 = (    0.0134   -0.2995   -0.4723)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7603    0.2165   -0.1025) (    0.0015    0.0046    0.0034)
 a2 = (    0.1672   -0.4482    0.2938) (    0.0050    0.0093    0.0041)
 a3 = (    0.0221   -0.3003   -0.4706) (    0.0026    0.0065    0.0078)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.8018  147.3889    4.2010    0.4854    0.4031    0.4642
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0006   -0.0045      0.0021    0.0023    0.0150

# Number of computed bands
            400             87
# Figure of merit at the beginning and the end of the refinement
         8.6014        30.5586
# Chi-squares at the beginning and the end of the refinement
    0.3086    0.0226
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    1   -3   -3   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    0    4    2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    1   -1   -3   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    0   -2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    1    3    1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    0   -2   -4    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -1   -3   -3    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    2    2    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -1   -1   -3    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    3    1   -1   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -3   -1   -1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -3   -1   -3    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    2    0   -2   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16   -2    0    0    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -2    0   -2    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    0   -4    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19   -3    1    1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20   -3    1   -1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    1   -1   -1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22   -2    2    0    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -1    3    1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7299   -0.0559   -0.7310   -0.0567    0.0014    1          0.0663          0.0702
    2    1   -3   -3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3    0    4    2   -0.0265    0.0896   -0.0262    0.0895    0.0004    1          0.0975          0.0967
    4    1   -1   -3   -0.1967   -0.5859   -0.1957   -0.5833    0.0027    1          0.1030          0.1078
    5    0   -2   -2    0.0567   -0.2236    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6    1    3    1   -0.1075    0.1194   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    0   -2   -4    0.1204   -0.5965    0.1201   -0.5973    0.0009    1          0.1318          0.1302
    8   -1   -3   -3    0.1439   -0.2199    0.1454   -0.2240    0.0043    1          0.1032          0.1017
    9    2    2    0   -0.1947    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10   -1   -1   -1    0.2252   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1   -1   -3    0.5370   -0.6123    0.5303   -0.6130    0.0067    1          0.1238          0.1248
   12    3    1   -1   -0.1811   -0.0381   -0.1829   -0.0381    0.0017    1          0.1004          0.0984
   13   -3   -1   -1    0.1969   -0.0085    0.1990   -0.0092    0.0021    1          0.1008          0.0927
   14   -3   -1   -3    0.5289   -0.1477    0.5293   -0.1451    0.0026    1          0.1490          0.1473
   15    2    0   -2   -0.3359   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16   -2    0    0    0.1256    0.0351    0.1275    0.0362    0.0022    1          0.0624          0.0679
   17   -2    0   -2    0.7278   -0.0785    0.7293   -0.0807    0.0027    1          0.1149          0.1198
   18   -2    0   -4    1.0617   -0.5074    1.0696   -0.4972    0.0129    1          0.2518          0.2483
   19   -3    1    1    0.0437    0.0284    0.0442    0.0295    0.0012    1          0.0973          0.0994
   20   -3    1   -1    0.4428    0.1646    0.4423    0.1634    0.0013    1          0.1186          0.1178
   21    1   -1   -1   -0.0336   -0.0579   -0.0341   -0.0579    0.0006    1          0.0435          0.0568
   22   -2    2    0    0.2979    0.3329    0.3053    0.3413    0.0112    1          0.0900          0.0899
   23   -1    3    1    0.0350    0.2721    0.0347    0.2716    0.0005    1          0.0805          0.0816

###            No.24                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2539    1.7835    1.7889   89.3631   89.4389   89.2498      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2540    1.7901    1.7819   90.0000   90.0000   90.0000      0.4426         0.7037    1.0046    2.8333    4.0447    4.0261
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0296    0.0304    0.0000    0.0000    0.0000      0.0290         0.0120    0.0190    0.1859    0.2737    0.2730
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7607    0.2158   -0.1048)
 a2 = (   -0.0286    0.3026    0.4712)
 a3 = (    0.1618   -0.4491    0.2909)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7606    0.2165   -0.1029) (    0.0014    0.0044    0.0034)
 a2 = (   -0.0220    0.3007    0.4703) (    0.0026    0.0065    0.0075)
 a3 = (    0.1672   -0.4477    0.2941) (    0.0047    0.0089    0.0041)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -8.7122   58.3902   20.4810    0.2861    0.3945    0.4027
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
             95             83
# Figure of merit at the beginning and the end of the refinement
         4.1659        30.5079
# Chi-squares at the beginning and the end of the refinement
    0.4488    0.0463
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2    1    3   -3   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3    0   -2    4   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4    2    6   -2   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5    0    2   -2    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6    1   -1    3   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7    0    4   -2    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8   -1    3   -3    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9    2    0    2   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10   -1    1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11   -1    3   -1    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12    3    1    1   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13   -3    1   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14   -3    3   -1    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15    2    2    0   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16   -4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17   -4    4    0    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18   -2    4    0    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19   -3   -1    1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20   -3    1    1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21    2    2   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22   -2    0    2    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23   -1   -1    3    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0649          0.0702
    2    1    3   -3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0975          0.0995
    3    0   -2    4   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0956          0.0967
    4    1    3   -1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1008          0.1078
    5    0    2   -2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0629          0.0654
    6    1   -1    3   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0754          0.0778
    7    0    4   -2    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1290          0.1302
    8   -1    3   -3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1011          0.1017
    9    2    0    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0766          0.0726
   10   -1    1   -1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0452          0.0467
   11   -1    3   -1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1213          0.1248
   12    3    1    1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.0984          0.0984
   13   -3    1   -1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.0989          0.0927
   14   -3    3   -1    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1461          0.1473
   15    2    2    0   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0858          0.0881
   16   -2    0    0    0.1264    0.0354    0.1275    0.0362    0.0014    1          0.0612          0.0679
   17   -2    2    0    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1126          0.1198
   18   -2    4    0    1.0632   -0.5090    1.0696   -0.4972    0.0135    1          0.2466          0.2483
   19   -3   -1    1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0955          0.0994
   20   -3    1    1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1164          0.1178
   21    1    1   -1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0426          0.0568
   22   -2    0    2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0883          0.0899
   23   -1   -1    3    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0790          0.0816

###            No.33                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2606    1.7805    1.7821   90.1047   89.9217   89.9110      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2540    1.7901    1.7819   90.0000   90.0000   90.0000      0.4426         0.7037    1.0046    2.8333    4.0447    4.0261
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0296    0.0304    0.0000    0.0000    0.0000      0.0290         0.0120    0.0190    0.1859    0.2737    0.2730
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7567    0.2146   -0.1028)
 a2 = (    0.0207   -0.3025   -0.4728)
 a3 = (   -0.1677    0.4471   -0.2947)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7606    0.2165   -0.1029) (    0.0014    0.0044    0.0034)
 a2 = (    0.0220   -0.3007   -0.4703) (    0.0026    0.0065    0.0075)
 a3 = (   -0.1672    0.4477   -0.2941) (    0.0047    0.0089    0.0041)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -171.2878  121.6098 -159.5190    0.2861    0.3945    0.4027
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            175             85
# Figure of merit at the beginning and the end of the refinement
         3.4923        30.2667
# Chi-squares at the beginning and the end of the refinement
    0.4762    0.0463
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2    1   -3    3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3    0    2   -4   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4    2   -6    2   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5    0   -2    2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6    1    1   -3   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7    0   -4    2    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8   -1   -3    3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9    2    0   -2   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1   -3    1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12    3   -1   -1   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13   -3   -1    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14   -3   -3    1    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15    2   -2    0   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16   -4    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17   -4   -4    0    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18   -2   -4    0    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19   -5    1   -1    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20   -3   -1   -1    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21    2   -2    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22   -2    0   -2    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23   -1    1   -3    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0649          0.0702
    2    1   -3    3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0975          0.0995
    3    0    2   -4   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0956          0.0967
    4    1   -3    1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1008          0.1078
    5    0   -2    2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0629          0.0654
    6    1    1   -3   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0754          0.0778
    7    0   -4    2    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1290          0.1302
    8   -1   -3    3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1011          0.1017
    9    2    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0766          0.0726
   10   -1   -1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0452          0.0467
   11   -1   -3    1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1213          0.1248
   12    3   -1   -1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.0984          0.0984
   13   -3   -1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.0989          0.0927
   14   -3   -3    1    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1461          0.1473
   15    2   -2    0   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0858          0.0881
   16   -2    0    0    0.1264    0.0354    0.1275    0.0362    0.0014    1          0.0612          0.0679
   17   -2   -2    0    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1126          0.1198
   18   -2   -4    0    1.0632   -0.5090    1.0696   -0.4972    0.0135    1          0.2466          0.2483
   19   -3    1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0955          0.0994
   20   -3   -1   -1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1164          0.1178
   21    1   -1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0426          0.0568
   22   -2    0   -2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0883          0.0899
   23   -1    1   -3    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0790          0.0816

###            No.35                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2564    1.7811    1.7875   90.4728   89.9748   90.0358      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2540    1.7902    1.7819   90.0000   90.0000   90.0000      0.4515         0.7037    1.0047    2.7776    3.9654    3.9470
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0296    0.0304    0.0000    0.0000    0.0000      0.0296         0.0120    0.0190    0.1819    0.2678    0.2671
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7593   -0.2154    0.1032)
 a2 = (    0.0222   -0.3051   -0.4708)
 a3 = (    0.1667   -0.4471    0.2921)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7606   -0.2165    0.1029) (    0.0014    0.0044    0.0034)
 a2 = (    0.0220   -0.3007   -0.4702) (    0.0026    0.0065    0.0075)
 a3 = (    0.1672   -0.4477    0.2941) (    0.0047    0.0089    0.0041)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  171.2879   58.3909   20.4807    0.2861    0.3945    0.4026
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
             91             83
# Figure of merit at the beginning and the end of the refinement
        11.9806        30.1599
# Chi-squares at the beginning and the end of the refinement
    0.0985    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2   -1   -3   -3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    0    2    4   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4   -1   -3   -1   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0   -2   -2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6   -1    1    3   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    0   -4   -2    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8    1   -3   -3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9   -2    0    2   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11    1   -3   -1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12   -3   -1    1   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13    3   -1   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14    3   -3   -1    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15   -2   -2    0   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17    2   -2    0    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18    2   -4    0    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19    3    1    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20    3   -1    1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21   -1   -1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22    2    0    2    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23    1    1    3    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -1   -3   -3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0    2    4   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1   -3   -1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    0   -2   -2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1    1    3   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0   -4   -2    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1   -3   -3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    0    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1   -1   -1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -3   -1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -3   -1    1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    3   -1   -1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3   -3   -1    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2   -2    0   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2   -2    0    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    2   -4    0    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    3    1    1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    3   -1    1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1   -1   -1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    0    2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1    1    3    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.36                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2807    1.7678    1.7680   88.9083   90.6163   88.1838      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2540    1.7819    1.7902   90.0000   90.0000   90.0000      0.4515         0.7005    0.9954    2.7776    3.9470    3.9653
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0304    0.0296    0.0000    0.0000    0.0000      0.0296         0.0116    0.0188    0.1819    0.2671    0.2678
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7451    0.2113   -0.1023)
 a2 = (   -0.1857    0.4431   -0.2993)
 a3 = (   -0.0136    0.3029    0.4777)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7606    0.2165   -0.1029) (    0.0014    0.0044    0.0034)
 a2 = (   -0.1672    0.4477   -0.2941) (    0.0047    0.0089    0.0041)
 a3 = (   -0.0220    0.3007    0.4702) (    0.0026    0.0065    0.0075)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.1731   32.6675 -175.8166    0.4749    0.3864    0.4622
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            400             83
# Figure of merit at the beginning and the end of the refinement
         7.5123        30.1593
# Chi-squares at the beginning and the end of the refinement
    0.2227    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    1    3    3   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    0   -4   -2   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1    1    3   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    0    2    2    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    1   -3   -1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    0    2    4    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8   -1    3    3    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    2   -2    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    1    3    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    3   -1    1   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13   -3    1    1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14   -3    1    3    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    2    0    2   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16   -2    0    0    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17   -2    0    2    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18   -2    0    4    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19   -3   -1   -1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -3   -1    1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    1    1    1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -2   -2    0    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -1   -3   -1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2    1    3    3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0   -4   -2   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4    1    1    3   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    0    2    2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1   -3   -1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0    2    4    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8   -1    3    3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    2   -2    0   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10   -1    1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    1    3    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12    3   -1    1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13   -3    1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14   -3    1    3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15    2    0    2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16   -2    0    0    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17   -2    0    2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18   -2    0    4    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19   -3   -1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20   -3   -1    1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21    1    1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22   -2   -2    0    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23   -1   -3   -1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.37                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2572    1.7722    1.7954   90.3618   89.6033   90.3810      0.5849
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2540    1.7902    1.7819   90.0000   90.0000   90.0000      0.4515         0.7037    1.0047    2.7776    3.9653    3.9469
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0296    0.0304    0.0000    0.0000    0.0000      0.0296         0.0120    0.0190    0.1819    0.2678    0.2671
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7588   -0.2152    0.1031)
 a2 = (   -0.0268    0.3072    0.4726)
 a3 = (   -0.1620    0.4445   -0.2940)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7606   -0.2165    0.1029) (    0.0014    0.0044    0.0034)
 a2 = (   -0.0220    0.3007    0.4702) (    0.0026    0.0065    0.0075)
 a3 = (   -0.1672    0.4477   -0.2941) (    0.0047    0.0089    0.0041)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    8.7121  121.6091 -159.5193    0.2861    0.3945    0.4026
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
             91             83
# Figure of merit at the beginning and the end of the refinement
         4.5957        30.1593
# Chi-squares at the beginning and the end of the refinement
    0.4728    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7366   -0.0642   -0.7310   -0.0567    0.0094    1    0.0868    0.0702
    2   -1    3    3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1305    0.0995
    3    0   -2   -4   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4   -1    3    1   -0.1904   -0.5832   -0.1957   -0.5833    0.0053    1    0.1352    0.1078
    5    0    2    2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0842    0.0654
    6   -1   -1   -3   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7    0    4    2    0.1203   -0.5904    0.1201   -0.5973    0.0069    1    0.1734    0.1302
    8    1    3    3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1354    0.1017
    9   -2    0   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10    1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0603    0.0467
   11    1    3    1    0.5278   -0.6067    0.5303   -0.6130    0.0067    1    0.1624    0.1248
   12   -3    1   -1   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13    3    1    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1316    0.0927
   14    3    3    1    0.5259   -0.1504    0.5293   -0.1451    0.0063    1    0.1958    0.1473
   15   -2    2    0   -0.3344   -0.2387   -0.3362   -0.2357    0.0035    1    0.1144    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0814    0.0679
   17    2    2    0    0.7228   -0.0846    0.7293   -0.0807    0.0076    1    0.1507    0.1198
   18    2    4    0    1.0393   -0.5107    1.0696   -0.4972    0.0331    1    0.3287    0.2483
   19    3   -1   -1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1270    0.0994
   20    3    1   -1    0.4432    0.1621    0.4423    0.1634    0.0016    1    0.1553    0.1178
   21   -1    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2    0   -2    0.2994    0.3310    0.3053    0.3413    0.0118    1    0.1176    0.0899
   23    1   -1   -3    0.0360    0.2714    0.0347    0.2716    0.0013    1    0.1050    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -1    3    3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0   -2   -4   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1    3    1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    0    2    2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1   -1   -3   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0    4    2    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1    3    3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1    1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    3    1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -3    1   -1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    3    1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3    3    1    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2    2    0   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2    2    0    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    2    4    0    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    3   -1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    3    1   -1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1    1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    0   -2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1   -1   -3    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.38                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2677    1.7763    1.7769   91.1176   89.3795   89.3770      0.4773
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2540    1.7819    1.7902   90.0000   90.0000   90.0000      0.4515         0.7005    0.9954    2.7776    3.9469    3.9653
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0304    0.0296    0.0000    0.0000    0.0000      0.0296         0.0116    0.0188    0.1819    0.2671    0.2678
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7524   -0.2134    0.1036)
 a2 = (    0.1738   -0.4440    0.2996)
 a3 = (   -0.0135    0.3014    0.4753)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7606   -0.2165    0.1029) (    0.0014    0.0044    0.0034)
 a2 = (    0.1672   -0.4477    0.2941) (    0.0047    0.0089    0.0041)
 a3 = (   -0.0220    0.3007    0.4702) (    0.0026    0.0065    0.0075)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.8269   32.6675 -175.8166    0.4749    0.3864    0.4622
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
             57             83
# Figure of merit at the beginning and the end of the refinement
        14.8418        30.1592
# Chi-squares at the beginning and the end of the refinement
    0.2016    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0716    0.0702
    2   -1   -3    3   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1054    0.0995
    3    0    4   -2   -0.0290    0.0954   -0.0262    0.0895    0.0066    1    0.1036    0.0967
    4   -1   -1    3   -0.2017   -0.5853   -0.1957   -0.5833    0.0063    1    0.1103    0.1078
    5    0   -2    2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0681    0.0654
    6   -1    3   -1   -0.1121    0.1237   -0.1085    0.1216    0.0042    1    0.0819    0.0778
    7    0   -2    4    0.1150   -0.5998    0.1201   -0.5973    0.0057    1    0.1409    0.1302
    8    1   -3    3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1094    0.1017
    9   -2    2    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0833    0.0726
   10    1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0488    0.0467
   11    1   -1    3    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1334    0.1248
   12   -3    1    1   -0.1841   -0.0379   -0.1829   -0.0381    0.0013    1    0.1067    0.0984
   13    3   -1    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1065    0.0927
   14    3   -1    3    0.5374   -0.1539    0.5293   -0.1451    0.0119    1    0.1589    0.1473
   15   -2    0    2   -0.3386   -0.2359   -0.3362   -0.2357    0.0024    1    0.0936    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0659    0.0679
   17    2    0    2    0.7460   -0.0857    0.7293   -0.0807    0.0174    1    0.1238    0.1198
   18    2    0    4    1.0824   -0.5407    1.0696   -0.4972    0.0454    1    0.2780    0.2483
   19    3    1   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1027    0.0994
   20    3    1    1    0.4544    0.1697    0.4423    0.1634    0.0136    1    0.1262    0.1178
   21   -1   -1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0459    0.0568
   22    2    2    0    0.3042    0.3456    0.3053    0.3413    0.0044    1    0.0959    0.0899
   23    1    3   -1    0.0332    0.2815    0.0347    0.2716    0.0100    1    0.0857    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -1   -3    3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0    4   -2   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1   -1    3   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    0   -2    2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1    3   -1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0   -2    4    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1   -3    3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    2    0   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1   -1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -1    3    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -3    1    1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    3   -1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3   -1    3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2    0    2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2    0    2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    2    0    4    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    3    1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    3    1    1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1   -1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    2    0    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1    3   -1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.52                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2480    1.7609    1.8209   91.6844   89.9826   90.0142      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2629    1.7765    1.7828   90.0000   90.0000   90.0000      0.4476         0.7084    0.9965    2.8213    3.9688    3.9828
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0329    0.0356    0.0000    0.0000    0.0000      0.0305         0.0142    0.0262    0.1925    0.2806    0.2832
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1903   -0.7576   -0.1785)
 a2 = (   -0.3230   -0.1827    0.4302)
 a3 = (   -0.4417   -0.0342   -0.3249)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1885   -0.7482   -0.1779) (    0.0044    0.0013    0.0037)
 a2 = (   -0.3073   -0.1810    0.4355) (    0.0091    0.0044    0.0068)
 a3 = (   -0.4506   -0.0345   -0.3323) (    0.0112    0.0042    0.0050)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -16.1943  126.3261  -85.6196    0.3701    0.5330    0.4798
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0004    0.0018      0.0023    0.0022    0.0135

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.9861
# Chi-squares at the beginning and the end of the refinement
    0.3812    0.0185
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -3   -1   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    3    1   -1   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -2    0   -2   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5   -2    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    2    0   -2   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -3    1   -1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8   -3    1    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    1   -1   -3   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -2    2    0    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    0   -2   -4   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -1    3    3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -2    4    2    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1   -1   -3   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1    3    1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -2    4    0    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    1    3    3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    0    4    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1   -1   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    1    3    1    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    2    2    0    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7316   -0.0565   -0.7310   -0.0567    0.0006    1          0.0666          0.0702
    2   -3   -1   -1   -0.0133   -0.1741   -0.0130   -0.1762    0.0022    1          0.0995          0.0995
    3    3    1   -1   -0.0264    0.0894   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -2    0   -2   -0.1957   -0.5855   -0.1957   -0.5833    0.0021    1          0.1034          0.1078
    5   -2    0    0    0.0565   -0.2236    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6    2    0   -2   -0.1071    0.1194   -0.1085    0.1216    0.0026    1          0.0767          0.0778
    7   -3    1   -1    0.1200   -0.5955    0.1201   -0.5973    0.0018    1          0.1324          0.1302
    8   -3    1    1    0.1436   -0.2203    0.1454   -0.2240    0.0041    1          0.1033          0.1017
    9    1   -1   -3   -0.1946    0.0485   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    1    1    0.2254   -0.1272    0.2251   -0.1274    0.0004    1          0.0461          0.0467
   11   -2    2    0    0.5351   -0.6124    0.5303   -0.6130    0.0048    1          0.1247          0.1248
   12    0   -2   -4   -0.1812   -0.0380   -0.1829   -0.0381    0.0017    1          0.1001          0.0984
   13   -1    3    3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1          0.1007          0.0927
   14   -2    4    2    0.5292   -0.1488    0.5293   -0.1451    0.0037    1          0.1496          0.1473
   15   -1   -1   -3   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    0    2    2    0.1260    0.0353    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1    3    1    0.7283   -0.0801    0.7293   -0.0807    0.0013    1          0.1156          0.1198
   18   -2    4    0    1.0590   -0.5096    1.0696   -0.4972    0.0163    1          0.2543          0.2483
   19    1    3    3    0.0438    0.0287    0.0442    0.0295    0.0009    1          0.0971          0.0994
   20    0    4    2    0.4436    0.1646    0.4423    0.1634    0.0018    1          0.1189          0.1178
   21   -1   -1   -1   -0.0337   -0.0578   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    3    1    0.2981    0.3331    0.3053    0.3413    0.0109    1          0.0902          0.0899
   23    2    2    0    0.0350    0.2718    0.0347    0.2716    0.0004    1          0.0806          0.0816

###            No.54                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2688    1.7717    1.7799   91.1913   89.6276   89.6403      0.5055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7720    1.7848   90.0000   90.0000   90.0000      0.4471         0.7087    0.9929    2.8289    3.9634    3.9919
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0272    0.0336    0.0000    0.0000    0.0000      0.0288         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1871    0.7449    0.1770)
 a2 = (    0.3049    0.1775   -0.4408)
 a3 = (   -0.4470   -0.0358   -0.3386)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1885    0.7471    0.1774) (    0.0043    0.0013    0.0034)
 a2 = (    0.3084    0.1814   -0.4364) (    0.0072    0.0036    0.0062)
 a3 = (   -0.4498   -0.0346   -0.3323) (    0.0102    0.0038    0.0048)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  163.8206  126.3737  -85.6049    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
             75             89
# Figure of merit at the beginning and the end of the refinement
         9.3876        29.9325
# Chi-squares at the beginning and the end of the refinement
    0.2062    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7526   -0.0603   -0.7310   -0.0567    0.0219    1    0.0767    0.0702
    2    3    1   -1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1117    0.0995
    3   -3   -1   -1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.1094    0.0967
    4    2    0   -2   -0.1979   -0.5945   -0.1957   -0.5833    0.0114    1    0.1176    0.1078
    5    2    0    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0721    0.0654
    6   -2    0   -2   -0.1133    0.1267   -0.1085    0.1216    0.0070    1    0.0863    0.0778
    7    3   -1   -1    0.1206   -0.6019    0.1201   -0.5973    0.0046    1    0.1501    0.1302
    8    3   -1    1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1159    0.1017
    9   -1    1   -3   -0.2043    0.0513   -0.1952    0.0486    0.0095    1    0.0877    0.0726
   10    1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0516    0.0467
   11    2   -2    0    0.5388   -0.6214    0.5303   -0.6130    0.0120    1    0.1419    0.1248
   12    0    2   -4   -0.1891   -0.0393   -0.1829   -0.0381    0.0063    1    0.1125    0.0984
   13    1   -3    3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1126    0.0927
   14    2   -4    2    0.5353   -0.1524    0.5293   -0.1451    0.0095    1    0.1689    0.1473
   15    1    1   -3   -0.3440   -0.2429   -0.3362   -0.2357    0.0106    1    0.0992    0.0881
   16    0   -2    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0697    0.0679
   17    1   -3    1    0.7398   -0.0844    0.7293   -0.0807    0.0111    1    0.1314    0.1198
   18    2   -4    0    1.0717   -0.5244    1.0696   -0.4972    0.0274    1    0.2927    0.2483
   19   -1   -3    3    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1087    0.0994
   20    0   -4    2    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1341    0.1178
   21    1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0486    0.0568
   22   -1   -3    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1019    0.0899
   23   -2   -2    0    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0908    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3    1   -1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3   -1   -1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2    0   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2    0   -2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3   -1   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3   -1    1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1    1   -3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1   -1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2   -2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0    2   -4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1   -3    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2   -4    2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1    1   -3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0   -2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -3    1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2   -4    0    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19   -1   -3    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -4    2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1   -3    1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2   -2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.56                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2601    1.7662    1.7974   90.1874   89.4472   90.7334      0.5864
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7720    1.7848   90.0000   90.0000   90.0000      0.4471         0.7087    0.9929    2.8289    3.9634    3.9919
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0272    0.0336    0.0000    0.0000    0.0000      0.0288         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1898   -0.7494   -0.1797)
 a2 = (    0.3138    0.1766   -0.4369)
 a3 = (    0.4444    0.0385    0.3325)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1885   -0.7471   -0.1774) (    0.0043    0.0013    0.0034)
 a2 = (    0.3084    0.1814   -0.4364) (    0.0072    0.0036    0.0062)
 a3 = (    0.4498    0.0346    0.3323) (    0.0102    0.0038    0.0048)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -163.8206   53.6263   94.3951    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
             93             89
# Figure of merit at the beginning and the end of the refinement
         4.4867        29.9322
# Chi-squares at the beginning and the end of the refinement
    0.4626    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7426   -0.0643   -0.7310   -0.0567    0.0138    1    0.0873    0.0702
    2   -3    1    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    3   -1    1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4   -2    0    2   -0.1903   -0.5886   -0.1957   -0.5833    0.0076    1    0.1359    0.1078
    5   -2    0    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2    0    2   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7   -3   -1    1    0.1236   -0.5945    0.1201   -0.5973    0.0045    1    0.1744    0.1302
    8   -3   -1   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1    1    3   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10   -1   -1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -2   -2    0    0.5339   -0.6072    0.5303   -0.6130    0.0068    1    0.1638    0.1248
   12    0    2    4   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13   -1   -3   -3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -2   -4   -2    0.5290   -0.1499    0.5293   -0.1451    0.0048    1    0.1972    0.1473
   15   -1    1    3   -0.3363   -0.2403   -0.3362   -0.2357    0.0046    1    0.1145    0.0881
   16    0   -2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1   -3   -1    0.7254   -0.0834    0.7293   -0.0807    0.0048    1    0.1520    0.1198
   18   -2   -4    0    1.0437   -0.5058    1.0696   -0.4972    0.0272    1    0.3317    0.2483
   19    1   -3   -3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    0   -4   -2    0.4455    0.1628    0.4423    0.1634    0.0032    1    0.1563    0.1178
   21   -1    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1   -3   -1    0.3016    0.3323    0.3053    0.3413    0.0098    1    0.1182    0.0899
   23    2   -2    0    0.0366    0.2729    0.0347    0.2716    0.0022    1    0.1052    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -3    1    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3   -1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4   -2    0    2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5   -2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    2    0    2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -3   -1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -3   -1   -1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9    1    1    3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10   -1   -1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11   -2   -2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0    2    4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1   -3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2   -4   -2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1    1    3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0   -2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1   -3   -1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -2   -4    0    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19    1   -3   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -4   -2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1   -3   -1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2   -2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.58                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2636    1.7704    1.7884   90.4730   89.4624   89.3467      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7720    1.7848   90.0000   90.0000   90.0000      0.4471         0.7087    0.9929    2.8289    3.9634    3.9920
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0272    0.0336    0.0000    0.0000    0.0000      0.0288         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1874    0.7482    0.1776)
 a2 = (   -0.3068   -0.1872    0.4358)
 a3 = (    0.4481    0.0275    0.3333)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1885    0.7471    0.1774) (    0.0043    0.0013    0.0034)
 a2 = (   -0.3084   -0.1814    0.4364) (    0.0072    0.0036    0.0062)
 a3 = (    0.4498    0.0346    0.3323) (    0.0102    0.0038    0.0048)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   16.1794   53.6263   94.3951    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
             77             89
# Figure of merit at the beginning and the end of the refinement
        23.7846        29.9321
# Chi-squares at the beginning and the end of the refinement
    0.0389    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2    3   -1    1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -3    1    1   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    2    0    2   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -2    0    2   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7    3    1    1    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8    3    1   -1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -1   -1    3   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10    1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    2    2    0    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12    0   -2    4   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13    1    3   -3    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    2    4   -2    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15    1   -1    3   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16    0    2   -2    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    1    3   -1    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18    2    4    0    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19   -1    3   -3    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    0    4   -2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    1   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1    3   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23   -2    2    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3   -1    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3    1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2    0    2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2    0    2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3    1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3    1   -1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1   -1    3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1    1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0   -2    4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1    3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2    4   -2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -1    3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1    3   -1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2    4    0    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19   -1    3   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0    4   -2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    3   -1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2    2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.59                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2624    1.7776    1.7825   90.1387   89.8085   90.0011      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7848    1.7720   90.0000   90.0000   90.0000      0.4471         0.7138    1.0072    2.8289    3.9920    3.9634
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0336    0.0272    0.0000    0.0000    0.0000      0.0288         0.0110    0.0218    0.1823    0.2680    0.2626
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1894   -0.7479   -0.1794)
 a2 = (    0.4529    0.0351    0.3318)
 a3 = (   -0.3039   -0.1796    0.4361)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1885   -0.7471   -0.1774) (    0.0043    0.0013    0.0034)
 a2 = (    0.4498    0.0346    0.3323) (    0.0102    0.0038    0.0048)
 a3 = (   -0.3084   -0.1814    0.4364) (    0.0072    0.0036    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -20.7221   39.3510  -59.5357    0.4322    0.4308    0.5152
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
             79             89
# Figure of merit at the beginning and the end of the refinement
         4.7313        29.9321
# Chi-squares at the beginning and the end of the refinement
    0.4598    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2   -3    1   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    3    1    1   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4   -2    2    0   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5   -2    0    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2    2    0   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7   -3    1    1    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8   -3   -1    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1    3   -1   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10   -1   -1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -2    0    2    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12    0    4   -2   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13   -1   -3    3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -2   -2    4    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15   -1    3   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    0   -2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1   -1    3    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18   -2    0    4    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19    1   -3    3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    0   -2    4    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21   -1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1   -1    3    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23    2    0    2    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -3    1   -1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3    1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4   -2    2    0   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5   -2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    2    2    0   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -3    1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -3   -1    1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9    1    3   -1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10   -1   -1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11   -2    0    2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0    4   -2   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1   -3    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2   -2    4    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1    3   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0   -2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1   -1    3    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -2    0    4    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19    1   -3    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -2    4    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1   -1    3    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2    0    2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.64                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2663    1.7634    1.7916   89.2103   89.7722   90.2214      0.4717
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7848    1.7720   90.0000   90.0000   90.0000      0.4471         0.7138    1.0072    2.8289    3.9920    3.9634
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0336    0.0272    0.0000    0.0000    0.0000      0.0288         0.0110    0.0218    0.1823    0.2680    0.2626
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1876    0.7467    0.1760)
 a2 = (    0.4563    0.0381    0.3347)
 a3 = (    0.2974    0.1757   -0.4385)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1885    0.7471    0.1774) (    0.0043    0.0013    0.0034)
 a2 = (    0.4498    0.0346    0.3323) (    0.0102    0.0038    0.0048)
 a3 = (    0.3084    0.1814   -0.4364) (    0.0072    0.0036    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   20.7221  140.6491  120.4644    0.4322    0.4308    0.5152
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
             65             89
# Figure of merit at the beginning and the end of the refinement
        15.9837        29.9320
# Chi-squares at the beginning and the end of the refinement
    0.0776    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7284   -0.0608   -0.7310   -0.0567    0.0049    1    0.0705    0.0702
    2    3    1    1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1043    0.0995
    3   -3    1   -1   -0.0287    0.0945   -0.0262    0.0895    0.0056    1    0.1023    0.0967
    4    2    2    0   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1090    0.1078
    5    2    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0674    0.0654
    6   -2    2    0   -0.1115    0.1227   -0.1085    0.1216    0.0032    1    0.0809    0.0778
    7    3    1   -1    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1393    0.1302
    8    3   -1   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1082    0.1017
    9   -1    3    1   -0.1981    0.0488   -0.1952    0.0486    0.0029    1    0.0823    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0483    0.0467
   11    2    0   -2    0.5310   -0.6252    0.5303   -0.6130    0.0122    1    0.1316    0.1248
   12    0    4    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1056    0.0984
   13    1   -3   -3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1054    0.0927
   14    2   -2   -4    0.5354   -0.1544    0.5293   -0.1451    0.0111    1    0.1571    0.1473
   15    1    3    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    0   -2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0652    0.0679
   17    1   -1   -3    0.7427   -0.0878    0.7293   -0.0807    0.0151    1    0.1222    0.1198
   18    2    0   -4    1.0721   -0.5417    1.0696   -0.4972    0.0446    1    0.2728    0.2483
   19   -1   -3   -3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1017    0.0994
   20    0   -2   -4    0.4537    0.1681    0.4423    0.1634    0.0123    1    0.1247    0.1178
   21    1    1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0455    0.0568
   22   -1   -1   -3    0.3045    0.3441    0.3053    0.3413    0.0029    1    0.0947    0.0899
   23   -2    0   -2    0.0334    0.2807    0.0347    0.2716    0.0091    1    0.0845    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3    1    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3    1   -1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2    2    0   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2    2    0   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3    1   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3   -1   -1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1    3    1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1   -1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    0   -2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0    4    2   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1   -3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    2   -2   -4    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1    3    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0   -2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -1   -3    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2    0   -4    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19   -1   -3   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -2   -4    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1    1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1   -1   -3    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2    0   -2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.71                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2515    1.7733    1.8033   90.9623   88.3872   90.0974      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7848    1.7720   90.0000   90.0000   90.0000      0.4471         0.7138    1.0072    2.8289    3.9920    3.9634
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0336    0.0272    0.0000    0.0000    0.0000      0.0288         0.0110    0.0218    0.1823    0.2680    0.2626
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1893   -0.7556   -0.1794)
 a2 = (   -0.4535   -0.0351   -0.3335)
 a3 = (    0.2910    0.1919   -0.4317)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1885   -0.7471   -0.1774) (    0.0043    0.0013    0.0034)
 a2 = (   -0.4498   -0.0346   -0.3323) (    0.0102    0.0038    0.0048)
 a3 = (    0.3084    0.1814   -0.4364) (    0.0072    0.0036    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -159.2779  140.6491  120.4644    0.4322    0.4308    0.5152
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         8.6014        29.9320
# Chi-squares at the beginning and the end of the refinement
    0.1241    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -3   -1    1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    3   -1   -1   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -2   -2    0   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    2   -2    0   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -3   -1   -1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -3    1   -1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    1   -3    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -2    0   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    0   -4    2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -1    3   -3    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -2    2   -4    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1   -3    1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0    2   -2    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1    1   -3    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    0   -4    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1    3   -3    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    0    2   -4    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1   -1    1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    1    1   -3    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    2    0   -2    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -3   -1    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3   -1   -1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4   -2   -2    0   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5   -2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    2   -2    0   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -3   -1   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -3    1   -1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9    1   -3    1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10   -1    1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11   -2    0   -2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0   -4    2   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1    3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -2    2   -4    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1   -3    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1    1   -3    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -2    0   -4    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19    1    3   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0    2   -4    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1    1   -3    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2    0   -2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.78                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2684    1.7623    1.7898   88.9157   89.9858   90.0167      0.4773
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7848    1.7720   90.0000   90.0000   90.0000      0.4471         0.7138    1.0072    2.8289    3.9920    3.9634
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0336    0.0272    0.0000    0.0000    0.0000      0.0288         0.0110    0.0218    0.1823    0.2680    0.2626
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1873    0.7454    0.1757)
 a2 = (   -0.4563   -0.0354   -0.3356)
 a3 = (   -0.2961   -0.1780    0.4392)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1885    0.7471    0.1774) (    0.0043    0.0013    0.0034)
 a2 = (   -0.4498   -0.0346   -0.3323) (    0.0102    0.0038    0.0048)
 a3 = (   -0.3084   -0.1814    0.4364) (    0.0072    0.0036    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  159.2779   39.3509  -59.5356    0.4322    0.4308    0.5152
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
             57             90
# Figure of merit at the beginning and the end of the refinement
        14.8418        29.8207
# Chi-squares at the beginning and the end of the refinement
    0.1043    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0716    0.0702
    2    3   -1   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1054    0.0995
    3   -3   -1    1   -0.0290    0.0954   -0.0262    0.0895    0.0066    1    0.1036    0.0967
    4    2   -2    0   -0.2017   -0.5853   -0.1957   -0.5833    0.0063    1    0.1103    0.1078
    5    2    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0681    0.0654
    6   -2   -2    0   -0.1121    0.1237   -0.1085    0.1216    0.0042    1    0.0819    0.0778
    7    3   -1    1    0.1150   -0.5998    0.1201   -0.5973    0.0057    1    0.1409    0.1302
    8    3    1    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1094    0.1017
    9   -1   -3   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0833    0.0726
   10    1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0488    0.0467
   11    2    0    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1334    0.1248
   12    0   -4   -2   -0.1841   -0.0379   -0.1829   -0.0381    0.0013    1    0.1067    0.0984
   13    1    3    3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1065    0.0927
   14    2    2    4    0.5374   -0.1539    0.5293   -0.1451    0.0119    1    0.1589    0.1473
   15    1   -3   -1   -0.3386   -0.2359   -0.3362   -0.2357    0.0024    1    0.0936    0.0881
   16    0    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0659    0.0679
   17    1    1    3    0.7460   -0.0857    0.7293   -0.0807    0.0174    1    0.1238    0.1198
   18    2    0    4    1.0824   -0.5407    1.0696   -0.4972    0.0454    1    0.2780    0.2483
   19   -1    3    3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1027    0.0994
   20    0    2    4    0.4544    0.1697    0.4423    0.1634    0.0136    1    0.1262    0.1178
   21    1   -1   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0459    0.0568
   22   -1    1    3    0.3042    0.3456    0.3053    0.3413    0.0044    1    0.0959    0.0899
   23   -2    0    2    0.0332    0.2815    0.0347    0.2716    0.0100    1    0.0857    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3   -1   -1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3   -1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2   -2    0   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2   -2    0   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3   -1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3    1    1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1   -3   -1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1    1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    0    2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0   -4   -2   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1    3    3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    2    2    4    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -3   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1    1    3    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2    0    4    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19   -1    3    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0    2    4    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    1    3    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2    0    2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.85                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2352    1.2360    2.6201   89.6996   89.7395   90.1651      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2355    1.2377    2.6157   90.0000   90.0000   90.0000      0.3293         0.4723    0.4732    3.7518    3.7586    7.9433
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0167    0.0982    0.0000    0.0000    0.0000      0.0249         0.0177    0.0185    0.2835    0.2885    0.6701
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6821   -0.3862   -0.2027)
 a2 = (    0.4121    0.6940    0.0553)
 a3 = (    0.0671   -0.0715    0.3689)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6826   -0.3849   -0.2025) (    0.0023    0.0041    0.0055)
 a2 = (    0.4081    0.6952    0.0542) (    0.0073    0.0093    0.0036)
 a3 = (    0.0701   -0.0700    0.3692) (    0.0046    0.0043    0.0133)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -74.9822   15.0165   45.0574    0.9422    0.4112    1.0534
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0010      0.0023    0.0022    0.0379

# Number of computed bands
            223            211
# Figure of merit at the beginning and the end of the refinement
         2.5635         5.7256
# Chi-squares at the beginning and the end of the refinement
    0.5172    0.1246
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    3   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2   -2    4    0   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3    2   -2    2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4   -1    3    3   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5   -2    2    0    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6    3   -1    3   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7   -2    2    2    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8   -4    2    0    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9    3    1    3   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10   -2    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11   -3    1    3    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12    2    2    2   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13   -4   -2    0    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14   -5   -1    3    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15    1    3    3   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16   -2   -2    0    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17   -3   -1    3    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18   -4    0    6    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19   -2   -4    0    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20   -2   -2    2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21    0    2    0   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22   -1   -3    3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23    1   -3    3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    3   -0.7320   -0.0566   -0.7310   -0.0567    0.0010    1          0.0707          0.0702
    2   -2    4    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.1056          0.0995
    3    3   -3    3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.1034          0.0967
    4   -1    3    3   -0.1947   -0.5862   -0.1957   -0.5833    0.0031    1          0.1098          0.1078
    5   -2    2    0    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0682          0.0654
    6    3   -1    3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0815          0.0778
    7   -3    3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1405          0.1302
    8   -4    2    0    0.1438   -0.2196    0.1454   -0.2240    0.0046    1          0.1097          0.1017
    9    3    1    3   -0.1951    0.0490   -0.1952    0.0486    0.0004    1          0.0827          0.0726
   10   -2    0    0    0.2253   -0.1269    0.2251   -0.1274    0.0005    1          0.0489          0.0467
   11   -3    1    3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1322          0.1248
   12    3    3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.1061          0.0984
   13   -4   -2    0    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1066          0.0927
   14   -5   -1    3    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1585          0.1473
   15    1    3    3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0929          0.0881
   16   -2   -2    0    0.1260    0.0357    0.1275    0.0362    0.0016    1          0.0659          0.0679
   17   -3   -1    3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1225          0.1198
   18   -4    0    6    1.0600   -0.5138    1.0696   -0.4972    0.0193    1          0.2700          0.2483
   19   -2   -4    0    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.1027          0.0994
   20   -3   -3    3    0.4452    0.1656    0.4423    0.1634    0.0036    1          0.1258          0.1178
   21    0    2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0460          0.0568
   22   -1   -3    3    0.2983    0.3354    0.3053    0.3413    0.0092    1          0.0954          0.0899
   23    1   -3    3    0.0340    0.2725    0.0347    0.2716    0.0010    1          0.0854          0.0816

###            No.88                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2354    1.2382    2.6152   90.5817   89.7955   90.0089      0.9229
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2379    1.2354    2.6154   90.0000   90.0000   90.0000      0.3101         0.4733    0.4724    3.9925    3.9845    8.4350
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0167    0.1020    0.0000    0.0000    0.0000      0.0235         0.0185    0.0177    0.3025    0.3066    0.7188
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4101    0.6958    0.0545)
 a2 = (   -0.6801    0.3850    0.2038)
 a3 = (    0.0667   -0.0699    0.3700)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4080    0.6951    0.0542) (    0.0040    0.0024    0.0035)
 a2 = (   -0.6826    0.3849    0.2026) (    0.0097    0.0061    0.0063)
 a3 = (    0.0701   -0.0700    0.3693) (    0.0047    0.0044    0.0139)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   15.0167   15.0180   45.0594    0.9422    0.4112    1.0534
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            146            280
# Figure of merit at the beginning and the end of the refinement
         0.9444         5.6708
# Chi-squares at the beginning and the end of the refinement
   19.4107    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    3   -0.7400   -0.0580   -0.7310   -0.0567    0.0091    1    0.1990    0.0702
    2    2    0    0   -0.0343   -0.0581   -0.0130   -0.1762    0.1200    1    0.1292    0.0995
    3   -1   -1    1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0964    0.0967
    4    3    1    3   -0.1950   -0.5882   -0.1957   -0.5833    0.0049    1    0.3111    0.1078
    5    2    2    0    0.0562   -0.2249    0.0560   -0.2234    0.0016    1    0.1919    0.0654
    6    0   -2    2   -0.1623    0.0989   -0.1085    0.1216    0.0585    1    0.1466    0.0778
    7    1    1    1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1315    0.1302
    8    2    2    0    0.0562   -0.2249    0.1454   -0.2240    0.0892    1    0.1919    0.1017
    9    1   -1    1   -0.1829   -0.0381   -0.1952    0.0486    0.0875    1    0.0987    0.0726
   10    0    2    0    0.2269   -0.1285    0.2251   -0.1274    0.0021    1    0.1371    0.0467
   11    1    3    3    0.5359   -0.6150    0.5303   -0.6130    0.0059    1    0.3763    0.1248
   12    1   -1    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0987    0.0984
   13   -2    2    0    0.1267    0.0361    0.1990   -0.0092    0.0853    1    0.1852    0.0927
   14   -1    3    1    0.3787   -0.0619    0.5293   -0.1451    0.1721    0    0.2369    0.1473
   15    3   -1    3   -0.3379   -0.2389   -0.3362   -0.2357    0.0036    1    0.2619    0.0881
   16   -2    2    0    0.1267    0.0361    0.1275    0.0362    0.0008    1    0.1852    0.0679
   17   -1    3    3    0.7317   -0.0812    0.7293   -0.0807    0.0024    1    0.3481    0.1198
   18    0    2    2    0.7400   -0.3802    1.0696   -0.4972    0.3497    0    0.2421    0.2483
   19   -1   -1    1   -0.0262    0.0895    0.0442    0.0295    0.0924    1    0.0964    0.0994
   20   -1    1    1    0.4457    0.1657    0.4423    0.1634    0.0041    1    0.1177    0.1178
   21    2    0    0   -0.0343   -0.0581   -0.0341   -0.0579    0.0002    1    0.1292    0.0568
   22   -2    0    2    0.1539    0.3431    0.3053    0.3413    0.1514    1    0.1627    0.0899
   23   -3   -1    3    0.0355    0.2723    0.0347    0.2716    0.0011    1    0.2408    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    3   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    4    2    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -5   -3    3   -0.0018    0.0471   -0.0262    0.0895    0.0489    1          0.1299          0.0967
    4    3    1    3   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    2    2    0    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1   -3    3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    3    3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    2    4    0    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1   -3    3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1    3    3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    5   -3    3   -0.1441   -0.0710   -0.1829   -0.0381    0.0509    1          0.1330          0.0984
   13   -2    4    0    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    5    3    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    3   -1    3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16   -2    2    0    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1    3    3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    0    4    6    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19   -4    2    0    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20   -3    3    3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    2    0    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -3    1    3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -3   -1    3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.89                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2600    1.7766    1.7868   89.9048   89.9852   90.0120      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2345    1.7898    1.8104   90.0000   90.0000   90.0000      0.3016         0.6819    0.9886    4.0929    5.9338    6.0020
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0293    0.0320    0.0000    0.0000    0.0000      0.0206         0.0121    0.0193    0.2793    0.4165    0.4231
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7569   -0.2147    0.1043)
 a2 = (    0.0213   -0.3051   -0.4725)
 a3 = (    0.1670   -0.4448    0.2958)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7742   -0.2135    0.1055) (    0.0014    0.0045    0.0034)
 a2 = (    0.0195   -0.3028   -0.4691) (    0.0025    0.0065    0.0074)
 a3 = (    0.1612   -0.4408    0.2912) (    0.0047    0.0091    0.0041)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  171.1789   58.1802   20.0916    0.2855    0.4024    0.4049
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0080   -0.0003   -0.0165      0.0021    0.0023    0.0143

# Number of computed bands
            179            203
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.2186
# Chi-squares at the beginning and the end of the refinement
    1.2471    0.8715
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    2   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2   -1   -5   -5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    0    2    4   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4   -2   -6   -2   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    0   -4   -4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -2    2    6   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    0   -4   -2    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    1   -3   -3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -2    0    2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    2   -2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -6   -2    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12   -3   -1    1   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13    3   -1   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    3   -3   -1    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15   -4   -4    0   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    4   -4    0    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18    2   -4    0    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    5    1    1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    3   -1    1    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21   -2   -2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    2    0    2    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23    2    2    6    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    2   -0.7298   -0.0592   -0.7310   -0.0567    0.0028    1          0.0868          0.0702
    2   -1   -5   -5   -0.0014   -0.2021   -0.0130   -0.1762    0.0285    1          0.1064          0.0995
    3    0    2    4   -0.0340    0.0901   -0.0262    0.0895    0.0078    1          0.0637          0.0967
    4   -2   -6   -2   -0.2152   -0.5836   -0.1957   -0.5833    0.0195    1          0.1360          0.1078
    5    0   -2   -2    0.0478   -0.2293    0.0560   -0.2234    0.0101    1          0.0422          0.0654
    6   -1    1    3   -0.1152    0.1187   -0.1085    0.1216    0.0073    1          0.0503          0.0778
    7    0   -4   -2    0.1080   -0.6060    0.1201   -0.5973    0.0149    1          0.0870          0.1302
    8    1   -3   -3    0.1394   -0.2256    0.1454   -0.2240    0.0062    1          0.0680          0.1017
    9   -2    0    2   -0.1986    0.0466   -0.1952    0.0486    0.0039    1          0.0518          0.0726
   10    1   -1   -1    0.2226   -0.1277    0.2251   -0.1274    0.0025    1          0.0307          0.0467
   11    1   -3   -1    0.5338   -0.6188    0.5303   -0.6130    0.0068    1          0.0820          0.1248
   12   -3   -1    1   -0.1838   -0.0355   -0.1829   -0.0381    0.0027    1          0.0671          0.0984
   13    3   -1   -1    0.1924   -0.0079    0.1990   -0.0092    0.0066    1          0.0676          0.0927
   14    3   -3   -1    0.5235   -0.1479    0.5293   -0.1451    0.0065    1          0.0992          0.1473
   15   -2   -2    0   -0.3416   -0.2279   -0.3362   -0.2357    0.0095    1          0.0581          0.0881
   16    4    0    0    0.1207    0.0358    0.1275    0.0362    0.0068    1          0.0841          0.0679
   17    4   -4    0    0.7187   -0.0815    0.7293   -0.0807    0.0107    1          0.1526          0.1198
   18    2   -4    0    1.0504   -0.5101    1.0696   -0.4972    0.0231    1          0.1647          0.2483
   19    5    1    1    0.0696    0.0384    0.0442    0.0295    0.0269    1          0.1060          0.0994
   20    3   -1    1    0.4372    0.1592    0.4423    0.1634    0.0066    1          0.0792          0.1178
   21   -2   -2   -2   -0.0425   -0.0552   -0.0341   -0.0579    0.0088    1          0.0578          0.0568
   22    2    0    2    0.2995    0.3286    0.3053    0.3413    0.0140    1          0.0598          0.0899
   23    1    1    3    0.0326    0.2763    0.0347    0.2716    0.0051    1          0.0528          0.0816

###            No.90                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2613    1.7773    1.7844   89.7295   89.8675   90.1292      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2345    1.8103    1.7898   90.0000   90.0000   90.0000      0.3016         0.6898    1.0115    4.0932    6.0024    5.9342
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0320    0.0293    0.0000    0.0000    0.0000      0.0206         0.0113    0.0197    0.2793    0.4232    0.4165
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7561    0.2145   -0.1042)
 a2 = (   -0.1667    0.4485   -0.2960)
 a3 = (   -0.0215    0.3005    0.4725)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7742    0.2135   -0.1055) (    0.0014    0.0045    0.0034)
 a2 = (   -0.1612    0.4408   -0.2912) (    0.0047    0.0091    0.0041)
 a3 = (   -0.0195    0.3028    0.4691) (    0.0025    0.0065    0.0074)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.1183   32.8958 -176.3090    0.4705    0.3943    0.4554
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0080   -0.0003   -0.0165      0.0021    0.0023    0.0143

# Number of computed bands
            173            205
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.2078
# Chi-squares at the beginning and the end of the refinement
    1.2482    0.8715
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    2   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    1    5    5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    0   -4   -2   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2    2    6   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    4    4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2   -6   -2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    0    2    4    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8   -1    3    3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    2   -2    0   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10   -2    2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -2    2    6    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    3   -1    1   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13   -3    1    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -3    1    3    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    4    0    4   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16   -4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17   -4    0    4    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18   -2    0    4    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19   -5   -1   -1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -3   -1    1    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    2    2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -2   -2    0    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23   -2   -6   -2    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    2   -0.7299   -0.0592   -0.7310   -0.0567    0.0028    1          0.0868          0.0702
    2    1    5    5   -0.0014   -0.2021   -0.0130   -0.1762    0.0285    1          0.1064          0.0995
    3    0   -4   -2   -0.0340    0.0901   -0.0262    0.0895    0.0078    1          0.0636          0.0967
    4    2    2    6   -0.2152   -0.5836   -0.1957   -0.5833    0.0195    1          0.1360          0.1078
    5    0    2    2    0.0478   -0.2293    0.0560   -0.2234    0.0101    1          0.0422          0.0654
    6    1   -3   -1   -0.1152    0.1187   -0.1085    0.1216    0.0073    1          0.0503          0.0778
    7    0    2    4    0.1080   -0.6060    0.1201   -0.5973    0.0149    1          0.0870          0.1302
    8   -1    3    3    0.1394   -0.2256    0.1454   -0.2240    0.0062    1          0.0680          0.1017
    9    2   -2    0   -0.1986    0.0466   -0.1952    0.0486    0.0039    1          0.0518          0.0726
   10   -1    1    1    0.2226   -0.1277    0.2251   -0.1274    0.0025    1          0.0307          0.0467
   11   -1    1    3    0.5338   -0.6188    0.5303   -0.6130    0.0068    1          0.0819          0.1248
   12    3   -1    1   -0.1838   -0.0355   -0.1829   -0.0381    0.0027    1          0.0671          0.0984
   13   -3    1    1    0.1924   -0.0079    0.1990   -0.0092    0.0066    1          0.0676          0.0927
   14   -3    1    3    0.5235   -0.1479    0.5293   -0.1451    0.0065    1          0.0992          0.1473
   15    2    0    2   -0.3416   -0.2279   -0.3362   -0.2357    0.0095    1          0.0581          0.0881
   16   -4    0    0    0.1207    0.0358    0.1275    0.0362    0.0068    1          0.0840          0.0679
   17   -4    0    4    0.7187   -0.0815    0.7293   -0.0807    0.0107    1          0.1526          0.1198
   18   -2    0    4    1.0504   -0.5101    1.0696   -0.4972    0.0231    1          0.1647          0.2483
   19   -5   -1   -1    0.0696    0.0384    0.0442    0.0295    0.0270    1          0.1060          0.0994
   20   -3   -1    1    0.4372    0.1592    0.4423    0.1634    0.0066    1          0.0792          0.1178
   21    2    2    2   -0.0425   -0.0552   -0.0341   -0.0579    0.0088    1          0.0578          0.0568
   22   -2   -2    0    0.2995    0.3286    0.3053    0.3413    0.0140    1          0.0598          0.0899
   23   -1   -3   -1    0.0326    0.2763    0.0347    0.2716    0.0051    1          0.0528          0.0816

###            No.91                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2609    1.7808    1.7814   90.0540   89.7674   89.7702      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2737    1.8062    1.7387   90.0000   90.0000   90.0000      0.2930         0.7325    1.0388    4.3462    6.1637    5.9333
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0339    0.0263    0.0000    0.0000    0.0000      0.0196         0.0111    0.0221    0.2912    0.4288    0.4075
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1884   -0.7498   -0.1767)
 a2 = (    0.4513    0.0375    0.3320)
 a3 = (   -0.3056   -0.1772    0.4363)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1803   -0.7430   -0.1786) (    0.0043    0.0012    0.0035)
 a2 = (    0.4430    0.0280    0.3309) (    0.0101    0.0038    0.0047)
 a3 = (   -0.3186   -0.1836    0.4422) (    0.0072    0.0036    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -20.8335   39.7492  -60.0505    0.4361    0.4290    0.5034
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0088    0.0013    0.0097      0.0023    0.0021    0.0115

# Number of computed bands
            179            190
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.0652
# Chi-squares at the beginning and the end of the refinement
    1.2324    0.8553
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2   -5    1   -1    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    3    1    1   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4   -4    4    0   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5   -4    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    4    4    0   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7   -3    1    1    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8   -3   -1    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1    3   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10   -2   -2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -4    0    4    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12    0    4   -2   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13   -1   -3    3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -2   -2    4    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15   -2    6   -2   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    0   -4    4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -2   -2    6    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18   -2    0    4    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    1   -5    5    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    0   -2    4    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21   -2    2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1   -1    3    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23    4    0    4    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7455   -0.0478   -0.7310   -0.0567    0.0170    1          0.0876          0.0702
    2   -5    1   -1   -0.0018   -0.1981   -0.0130   -0.1762    0.0246    1          0.1060          0.0995
    3    6    2    2   -0.0343    0.0902   -0.0262    0.0895    0.0082    1          0.1278          0.0967
    4   -4    4    0   -0.2086   -0.5875   -0.1957   -0.5833    0.0135    1          0.1361          0.1078
    5   -4    0    0    0.0457   -0.2260    0.0560   -0.2234    0.0106    1          0.0842          0.0654
    6    4    4    0   -0.1133    0.1186   -0.1085    0.1216    0.0057    1          0.1003          0.0778
    7   -6    2    2    0.1119   -0.6021    0.1201   -0.5973    0.0095    1          0.1754          0.1302
    8   -4   -2    2    0.1717   -0.2063    0.1454   -0.2240    0.0317    1          0.0965          0.1017
    9    1    3   -1   -0.1975    0.0478   -0.1952    0.0486    0.0024    1          0.0508          0.0726
   10   -2   -2    2    0.2224   -0.1317    0.2251   -0.1274    0.0050    1          0.0610          0.0467
   11   -4    0    4    0.5371   -0.6133    0.5303   -0.6130    0.0067    1          0.1672          0.1248
   12    0    8   -4   -0.1824   -0.0358   -0.1829   -0.0381    0.0023    1          0.1312          0.0984
   13   -1   -3    3    0.1967   -0.0103    0.1990   -0.0092    0.0025    1          0.0668          0.0927
   14   -4   -4    8    0.5256   -0.1487    0.5293   -0.1451    0.0052    1          0.2010          0.1473
   15   -2    6   -2   -0.3425   -0.2311   -0.3362   -0.2357    0.0078    1          0.1144          0.0881
   16    0   -4    4    0.1256    0.0361    0.1275    0.0362    0.0019    1          0.0828          0.0679
   17   -2   -2    6    0.7196   -0.0770    0.7293   -0.0807    0.0104    1          0.1557          0.1198
   18   -2    0    4    1.0541   -0.4898    1.0696   -0.4972    0.0172    1          0.1699          0.2483
   19    1   -5    5    0.0740    0.0399    0.0442    0.0295    0.0315    1          0.1044          0.0994
   20    0   -4    8    0.4387    0.1625    0.4423    0.1634    0.0038    1          0.1603          0.1178
   21   -2    2   -2   -0.0398   -0.0521   -0.0341   -0.0579    0.0081    1          0.0571          0.0568
   22    2   -2    6    0.2963    0.3297    0.3053    0.3413    0.0147    1          0.1213          0.0899
   23    4    0    4    0.0323    0.2744    0.0347    0.2716    0.0036    1          0.1069          0.0816

###            No.92                ###
# Bravais type
 Orthorhombic(F)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2622    1.7773    1.7831   90.2300   89.8378   89.8410      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2737    1.7387    1.8062   90.0000   90.0000   90.0000      0.2930         0.7051    0.9626    4.3463    5.9333    6.1637
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0263    0.0339    0.0000    0.0000    0.0000      0.0196         0.0132    0.0205    0.2912    0.4075    0.4288
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1882    0.7491    0.1765)
 a2 = (   -0.3055   -0.1812    0.4364)
 a3 = (    0.4506    0.0332    0.3322)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1803    0.7430    0.1786) (    0.0043    0.0012    0.0035)
 a2 = (   -0.3186   -0.1836    0.4422) (    0.0072    0.0036    0.0062)
 a3 = (    0.4430    0.0280    0.3309) (    0.0101    0.0038    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   16.4774   53.3003   93.6169    0.3381    0.4340    0.4551
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0088    0.0013    0.0097      0.0023    0.0021    0.0115

# Number of computed bands
            173            191
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.0598
# Chi-squares at the beginning and the end of the refinement
    1.2438    0.8553
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    4   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    5   -1    1    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3   -3    1    1   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    4    0    4   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    4    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -4    0    4   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    3    1    1    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    3    1   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -1   -1    3   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    2    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    4    4    0    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    0   -2    4   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    1    3   -3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    2    4   -2    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    2   -2    6   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    4   -4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    2    6   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    2    4    0    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19   -1    5   -5    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    0    4   -2    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    2   -2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -1    3   -1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23   -4    4    0    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    4   -0.7455   -0.0478   -0.7310   -0.0567    0.0170    1          0.0876          0.0702
    2    5   -1    1   -0.0018   -0.1981   -0.0130   -0.1762    0.0246    1          0.1060          0.0995
    3   -6    2    2   -0.0343    0.0902   -0.0262    0.0895    0.0082    1          0.1278          0.0967
    4    4    0    4   -0.2086   -0.5875   -0.1957   -0.5833    0.0135    1          0.1361          0.1078
    5    4    0    0    0.0457   -0.2260    0.0560   -0.2234    0.0106    1          0.0842          0.0654
    6   -4    0    4   -0.1133    0.1186   -0.1085    0.1216    0.0057    1          0.1003          0.0778
    7    6    2    2    0.1119   -0.6021    0.1201   -0.5973    0.0095    1          0.1754          0.1302
    8    4    2   -2    0.1717   -0.2063    0.1454   -0.2240    0.0317    1          0.0965          0.1017
    9   -1   -1    3   -0.1975    0.0478   -0.1952    0.0486    0.0024    1          0.0508          0.0726
   10    2    2   -2    0.2224   -0.1317    0.2251   -0.1274    0.0050    1          0.0610          0.0467
   11    4    4    0    0.5371   -0.6133    0.5303   -0.6130    0.0067    1          0.1672          0.1248
   12    0   -4    8   -0.1824   -0.0358   -0.1829   -0.0381    0.0023    1          0.1312          0.0984
   13    1    3   -3    0.1967   -0.0103    0.1990   -0.0092    0.0025    1          0.0668          0.0927
   14    4    8   -4    0.5256   -0.1487    0.5293   -0.1451    0.0052    1          0.2010          0.1473
   15    2   -2    6   -0.3425   -0.2311   -0.3362   -0.2357    0.0078    1          0.1144          0.0881
   16    0    4   -4    0.1256    0.0361    0.1275    0.0362    0.0019    1          0.0828          0.0679
   17    2    6   -2    0.7196   -0.0770    0.7293   -0.0807    0.0104    1          0.1557          0.1198
   18    2    4    0    1.0541   -0.4898    1.0696   -0.4972    0.0172    1          0.1699          0.2483
   19   -1    5   -5    0.0740    0.0399    0.0442    0.0295    0.0315    1          0.1044          0.0994
   20    0    8   -4    0.4387    0.1625    0.4423    0.1634    0.0038    1          0.1603          0.1178
   21    2   -2    2   -0.0398   -0.0521   -0.0341   -0.0579    0.0081    1          0.0571          0.0568
   22   -2    6   -2    0.2963    0.3297    0.3053    0.3413    0.0147    1          0.1213          0.0899
   23   -4    4    0    0.0323    0.2744    0.0347    0.2716    0.0036    1          0.1069          0.0816

###                                ###
### Candidates for Orthorhombic(I) ###
###                                ###

###            No.1                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2515    1.2539    1.2752   89.0386   91.2081   91.0908      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2642    1.2598    1.2558   90.0000   90.0000   90.0000      0.4479         1.0066    1.0032    2.8222    2.8125    2.8036
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0479    0.0181    0.0000    0.0000    0.0000      0.0342         0.0145    0.0413    0.2158    0.2402    0.2182
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1893   -0.7556   -0.1794)
 a2 = (    0.1625   -0.1567    0.7651)
 a3 = (   -0.7445   -0.2270    0.0982)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1888   -0.7473   -0.1778) (    0.0044    0.0016    0.0053)
 a2 = (    0.1450   -0.1457    0.7667) (    0.0098    0.0092    0.0280)
 a3 = (   -0.7595   -0.2162    0.1026) (    0.0115    0.0050    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.0969   82.5985  -74.1075    0.4035    0.3086    0.3571
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0004   -0.0002      0.0022    0.0022    0.0400

# Number of computed bands
            400             84
# Figure of merit at the beginning and the end of the refinement
         8.6014        31.0455
# Chi-squares at the beginning and the end of the refinement
    0.4409    0.0235
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -3    0   -1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    3    1    0   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -2    1   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    2    1   -1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -3    1    0    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -3    0    1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    1    1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -2    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    0    1   -3   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -1    0    3    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -2    1    3    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1    1   -2   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0    0    2    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1    1    2    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    2    2    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1    0    3    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    0    1    3    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1    0   -1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    1    1    2    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    2    1    1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7296   -0.0573   -0.7310   -0.0567    0.0016    1          0.0664          0.0702
    2   -3    0   -1   -0.0133   -0.1745   -0.0130   -0.1762    0.0017    1          0.0993          0.0995
    3    3    1    0   -0.0264    0.0894   -0.0262    0.0895    0.0002    1          0.0972          0.0967
    4   -2    1   -1   -0.1967   -0.5856   -0.1957   -0.5833    0.0025    1          0.1032          0.1078
    5   -2    0    0    0.0568   -0.2240    0.0560   -0.2234    0.0011    1          0.0641          0.0654
    6    2    1   -1   -0.1074    0.1193   -0.1085    0.1216    0.0025    1          0.0766          0.0778
    7   -3    1    0    0.1202   -0.5965    0.1201   -0.5973    0.0008    1          0.1321          0.1302
    8   -3    0    1    0.1442   -0.2202    0.1454   -0.2240    0.0040    1          0.1031          0.1017
    9    1    1   -2   -0.1948    0.0481   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0    1    0.2254   -0.1264    0.2251   -0.1274    0.0011    1          0.0461          0.0467
   11   -2    1    1    0.5364   -0.6124    0.5303   -0.6130    0.0061    1          0.1243          0.1248
   12    0    1   -3   -0.1812   -0.0381   -0.1829   -0.0381    0.0016    1          0.1003          0.0984
   13   -1    0    3    0.1969   -0.0082    0.1990   -0.0092    0.0023    1          0.1007          0.0927
   14   -2    1    3    0.5289   -0.1478    0.5293   -0.1451    0.0027    1          0.1492          0.1473
   15   -1    1   -2   -0.3357   -0.2360   -0.3362   -0.2357    0.0005    1          0.0876          0.0881
   16    0    0    2    0.1253    0.0352    0.1275    0.0362    0.0024    1          0.0623          0.0679
   17   -1    1    2    0.7277   -0.0791    0.7293   -0.0807    0.0024    1          0.1151          0.1198
   18   -2    2    2    1.0602   -0.5089    1.0696   -0.4972    0.0150    1          0.2532          0.2483
   19    1    0    3    0.0434    0.0284    0.0442    0.0295    0.0014    1          0.0972          0.0994
   20    0    1    3    0.4427    0.1644    0.4423    0.1634    0.0010    1          0.1186          0.1178
   21   -1    0   -1   -0.0339   -0.0581   -0.0341   -0.0579    0.0004    1          0.0434          0.0568
   22    1    1    2    0.2981    0.3326    0.3053    0.3413    0.0113    1          0.0899          0.0899
   23    2    1    1    0.0351    0.2720    0.0347    0.2716    0.0005    1          0.0803          0.0816

###            No.2                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2563    1.2613    1.2622   89.9973   90.2275   90.1855      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2607    1.2550    1.2641   90.0000   90.0000   90.0000      0.4495         0.9973    0.9928    2.8044    2.7917    2.8120
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0503    0.0476    0.0000    0.0000    0.0000      0.0285         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1451   -0.1480    0.7686)
 a2 = (   -0.7561   -0.2145    0.1042)
 a3 = (    0.1882   -0.7491   -0.1765)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1450   -0.1448    0.7663) (    0.0050    0.0046    0.0015)
 a2 = (   -0.7599   -0.2163    0.1029) (    0.0311    0.0087    0.0038)
 a3 = (    0.1888   -0.7475   -0.1770) (    0.0085    0.0289    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.3823  102.9296   14.1754    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            173             83
# Figure of merit at the beginning and the end of the refinement
         3.3422        30.6805
# Chi-squares at the beginning and the end of the refinement
    1.2330    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    0   -1   -5    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    1    0    3   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2   -2   -4   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    0   -4    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2   -2    4   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    1    0   -3    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    0    1   -3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1   -2    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    0    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2    2   -4    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    1   -3    0   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    0    3   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1    3   -2    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    2   -4   -2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    2    4   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    2    2   -2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    0    5    1    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    1    3    0    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    0   -2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1    2    1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    2    2    4    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -1   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    0    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1   -1   -2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1   -1    2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1    0   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0    1   -3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1   -2    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1    1   -2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1   -3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0    3   -1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1    3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -2   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1    2   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2    2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    3    1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20    1    3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1    2    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    1    2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.3                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2593    1.2594    1.2610   90.2492   89.9684   90.0865      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2550    1.2641    1.2607   90.0000   90.0000   90.0000      0.4495         0.9955    1.0027    2.7917    2.8119    2.8044
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0176    0.0505    0.0000    0.0000    0.0000      0.0346         0.0399    0.0377    0.2146    0.2196    0.2431
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7574    0.2154   -0.1028)
 a2 = (   -0.1880    0.7506    0.1782)
 a3 = (    0.1441   -0.1423    0.7667)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7599    0.2163   -0.1029) (    0.0016    0.0045    0.0042)
 a2 = (   -0.1888    0.7475    0.1770) (    0.0053    0.0101    0.0061)
 a3 = (    0.1450   -0.1448    0.7663) (    0.0099    0.0094    0.0295)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -30.0032   14.9737   45.0431    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            195             83
# Figure of merit at the beginning and the end of the refinement
         3.3663        30.6804
# Chi-squares at the beginning and the end of the refinement
    0.4734    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0    2   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    1    3    0   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3    0   -3    1   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4    2    4    2   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6    1   -2    1   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7    0    3    1    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8   -1    3    0    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9    2   -1    1   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1    2    1    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12    3    0    1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13   -3    1    0    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14   -3    2    1    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15    2    1    1   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16   -4    0    0    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17   -4    2    2    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18   -2    2    2    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19   -5   -1    0    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20   -3    0    1    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    2    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22   -2   -1    1    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -1   -2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    1    3    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0   -3    1   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1    2    1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1   -2    1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0    3    1    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -1    3    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    2   -1    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    2    1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    3    0    1   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13   -3    1    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -3    2    1    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    2    1    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16   -2    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -2    1    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2    2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -3   -1    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20   -3    0    1    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    1    1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -2   -1    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -2    1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.6                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2564    1.2565    1.2669   90.2048   89.9570   89.9926      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2550    1.2641    1.2607   90.0000   90.0000   90.0000      0.4495         0.9955    1.0027    2.7917    2.8119    2.8044
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0176    0.0505    0.0000    0.0000    0.0000      0.0346         0.0399    0.0377    0.2146    0.2196    0.2431
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7593    0.2154   -0.1032)
 a2 = (    0.1890   -0.7522   -0.1787)
 a3 = (   -0.1445    0.1419   -0.7629)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7599    0.2163   -0.1029) (    0.0016    0.0045    0.0042)
 a2 = (    0.1888   -0.7475   -0.1770) (    0.0053    0.0101    0.0061)
 a3 = (   -0.1450    0.1448   -0.7663) (    0.0099    0.0094    0.0295)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -149.9968  165.0263 -134.9569    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
             91             83
# Figure of merit at the beginning and the end of the refinement
        11.9806        30.6802
# Chi-squares at the beginning and the end of the refinement
    0.0945    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2    1   -3    0   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    0    3   -1   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4    1   -2   -1   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0   -2    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6    1    2   -1   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    0   -3   -1    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8   -1   -3    0    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9    2    1   -1   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11   -1   -2   -1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12    3    0   -1   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13   -3   -1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14   -3   -2   -1    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15    2   -1   -1   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17   -2   -1   -1    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18   -2   -2   -2    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19   -3    1    0    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20   -3    0   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22   -2    1   -1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23   -1    2   -1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    1   -3    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0    3   -1   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1   -2   -1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    2   -1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0   -3   -1    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -1   -3    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    2    1   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1   -1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -2   -1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    3    0   -1   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13   -3   -1    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -3   -2   -1    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    2   -1   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16   -2    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -2   -1   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2   -2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -3    1    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20   -3    0   -1    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    1   -1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -2    1   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    2   -1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.8                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2366    1.2709    1.2726   89.9364   90.3407   89.6312      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2607    1.2641    1.2550   90.0000   90.0000   90.0000      0.4495         1.0045    1.0072    2.8044    2.8119    2.7917
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0476    0.0503    0.0000    0.0000    0.0000      0.0285         0.0402    0.0140    0.1779    0.2074    0.2094
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1410   -0.1610    0.7798)
 a2 = (   -0.1860    0.7426    0.1817)
 a3 = (   -0.7503   -0.2125    0.0967)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1450   -0.1448    0.7663) (    0.0050    0.0046    0.0015)
 a2 = (   -0.1888    0.7475    0.1770) (    0.0085    0.0289    0.0047)
 a3 = (   -0.7599   -0.2163    0.1029) (    0.0311    0.0087    0.0038)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   76.9592   82.5766  -74.1105    0.3839    0.3018    0.3441
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            400             83
# Figure of merit at the beginning and the end of the refinement
         6.3733        30.6802
# Chi-squares at the beginning and the end of the refinement
    0.3453    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2    0    3   -1   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    1   -3    0   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    1    2   -1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5    0    2    0    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    1   -2   -1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7    1    3    0    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8    0    3    1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    1   -1   -2   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    2    1    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    1    0   -3   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    0    1    3    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    1    2    3    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15    1    1   -2   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0    0    2    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1    1    2    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    2    2    2    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    0   -1    3    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    1    0    3    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0    1   -1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    1   -1    2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    1   -2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0    3   -1   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1   -3    0   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1    2   -1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1   -2   -1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1    3    0    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0    3    1    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1   -1   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1    2    1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1    0   -3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0    1    3    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1    2    3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    1   -2   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1    1    2    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2    2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0   -1    3    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    1    0    3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1   -1    2    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -2    1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.9                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2482    1.2655    1.2663   89.9930   90.3198   90.9100      0.4717
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2607    1.2550    1.2641   90.0000   90.0000   90.0000      0.4495         0.9973    0.9928    2.8044    2.7917    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0503    0.0476    0.0000    0.0000    0.0000      0.0285         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1589   -0.1376    0.7732)
 a2 = (    0.7537    0.2138   -0.1038)
 a3 = (   -0.1876    0.7467    0.1760)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1450   -0.1448    0.7663) (    0.0050    0.0046    0.0015)
 a2 = (    0.7599    0.2163   -0.1029) (    0.0311    0.0087    0.0038)
 a3 = (   -0.1888    0.7475    0.1770) (    0.0085    0.0289    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.6177   77.0704 -165.8246    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
             65             83
# Figure of merit at the beginning and the end of the refinement
        15.9837        30.6802
# Chi-squares at the beginning and the end of the refinement
    0.4404    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7284   -0.0608   -0.7310   -0.0567    0.0049    1    0.0705    0.0702
    2    0    1    3   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1043    0.0995
    3    1    0   -3   -0.0287    0.0945   -0.0262    0.0895    0.0056    1    0.1023    0.0967
    4    1    1    2   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1090    0.1078
    5    0    0    2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0674    0.0654
    6    1    1   -2   -0.1115    0.1227   -0.1085    0.1216    0.0032    1    0.0809    0.0778
    7    1    0    3    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1393    0.1302
    8    0   -1    3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1082    0.1017
    9    1    2   -1   -0.1981    0.0488   -0.1952    0.0486    0.0029    1    0.0823    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0483    0.0467
   11    1   -1    2    0.5310   -0.6252    0.5303   -0.6130    0.0122    1    0.1316    0.1248
   12    1    3    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1056    0.0984
   13    0   -3    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1054    0.0927
   14    1   -3    2    0.5354   -0.1544    0.5293   -0.1451    0.0111    1    0.1571    0.1473
   15    1    2    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0652    0.0679
   17    1   -2    1    0.7427   -0.0878    0.7293   -0.0807    0.0151    1    0.1222    0.1198
   18    2   -2    2    1.0721   -0.5417    1.0696   -0.4972    0.0446    1    0.2728    0.2483
   19    0   -3   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1017    0.0994
   20    1   -3    0    0.4537    0.1681    0.4423    0.1634    0.0123    1    0.1247    0.1178
   21    0    1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0455    0.0568
   22    1   -2   -1    0.3045    0.3441    0.3053    0.3413    0.0029    1    0.0947    0.0899
   23    1   -1   -2    0.0334    0.2807    0.0347    0.2716    0.0091    1    0.0845    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0    1    3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    0   -3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1    1    2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0    2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    1   -2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1    0    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0   -1    3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1    2   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -1    2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1    3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0   -3    1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1   -3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0   -2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1   -2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0   -3   -1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    1   -3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1   -2   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -1   -2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.10                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2530    1.2634    1.2636   89.9228   90.8452   89.4191      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2607    1.2550    1.2641   90.0000   90.0000   90.0000      0.4495         0.9973    0.9928    2.8044    2.7917    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0503    0.0476    0.0000    0.0000    0.0000      0.0285         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1413    0.1597   -0.7692)
 a2 = (   -0.7550   -0.2147    0.1025)
 a3 = (   -0.1874    0.7482    0.1776)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1450    0.1448   -0.7663) (    0.0050    0.0046    0.0015)
 a2 = (   -0.7599   -0.2163    0.1029) (    0.0311    0.0087    0.0038)
 a3 = (   -0.1888    0.7475    0.1770) (    0.0085    0.0289    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.3823   77.0704 -165.8246    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
             77             83
# Figure of merit at the beginning and the end of the refinement
        23.7846        30.6802
# Chi-squares at the beginning and the end of the refinement
    0.3542    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2    0   -1    3   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1    0   -3   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1   -1    2   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -1   -1   -2   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7   -1    0    3    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8    0    1    3    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -1   -2   -1   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    1    2    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12   -1   -3    0   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13    0    3    1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14   -1    3    2    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15   -1   -2    1   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16    0    2    0    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17   -1    2    1    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18   -2    2    2    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19    0    3   -1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -1    3    0    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1    2   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23   -1    1   -2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -1    3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -1    0   -3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -1   -1    2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0    2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -1   -1   -2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7   -1    0    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0    1    3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -1   -2   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    1    2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -1   -3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0    3    1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -1    3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1   -2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -1    2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2    2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    3   -1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20   -1    3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -1    2   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    1   -2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.13                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2432    1.2683    1.2685   89.9125   90.6362   90.1532      0.4569
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2607    1.2550    1.2641   90.0000   90.0000   90.0000      0.4495         0.9973    0.9928    2.8044    2.7917    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0503    0.0476    0.0000    0.0000    0.0000      0.0285         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1433    0.1396   -0.7792)
 a2 = (    0.7520    0.2138   -0.1021)
 a3 = (    0.1867   -0.7452   -0.1769)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1450    0.1448   -0.7663) (    0.0050    0.0046    0.0015)
 a2 = (    0.7599    0.2163   -0.1029) (    0.0311    0.0087    0.0038)
 a3 = (    0.1888   -0.7475   -0.1770) (    0.0085    0.0289    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.6177  102.9296   14.1754    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
             71             83
# Figure of merit at the beginning and the end of the refinement
        16.7330        30.6802
# Chi-squares at the beginning and the end of the refinement
    0.2202    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7511   -0.0623   -0.7310   -0.0567    0.0209    1    0.0693    0.0702
    2    0    1   -3   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1    0    3   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0988    0.0967
    4   -1    1   -2   -0.1978   -0.5929   -0.1957   -0.5833    0.0098    1    0.1063    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -1    1    2   -0.1134    0.1266   -0.1085    0.1216    0.0071    1    0.0779    0.0778
    7   -1    0   -3    0.1195   -0.6012    0.1201   -0.5973    0.0039    1    0.1356    0.1302
    8    0   -1   -3    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -1    2    1   -0.2044    0.0509   -0.1952    0.0486    0.0094    1    0.0792    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1   -1   -2    0.5374   -0.6221    0.5303   -0.6130    0.0115    1    0.1281    0.1248
   12   -1    3    0   -0.1888   -0.0395   -0.1829   -0.0381    0.0062    1    0.1017    0.0984
   13    0   -3   -1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14   -1   -3   -2    0.5354   -0.1528    0.5293   -0.1451    0.0097    1    0.1525    0.1473
   15   -1    2   -1   -0.3431   -0.2427   -0.3362   -0.2357    0.0098    1    0.0897    0.0881
   16    0   -2    0    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17   -1   -2   -1    0.7400   -0.0851    0.7293   -0.0807    0.0116    1    0.1187    0.1198
   18   -2   -2   -2    1.0706   -0.5273    1.0696   -0.4972    0.0302    1    0.2642    0.2483
   19    0   -3    1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -1   -3    0    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1211    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1   -2    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0920    0.0899
   23   -1   -1    2    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0820    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0    1   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -1    0    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -1    1   -2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -1    1    2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7   -1    0   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0   -1   -3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -1    2    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -1   -2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -1    3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0   -3   -1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -1   -3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1    2   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0   -2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -1   -2   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2   -2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0   -3    1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20   -1   -3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -1   -2    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1   -1    2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.16                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2589    1.2590    1.2619   89.9863   90.1249   90.0858      0.4543
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2550    1.2641    1.2607   90.0000   90.0000   90.0000      0.4496         0.9955    1.0027    2.7916    2.8118    2.8043
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0176    0.0505    0.0000    0.0000    0.0000      0.0346         0.0399    0.0377    0.2146    0.2196    0.2431
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7576   -0.2154    0.1029)
 a2 = (    0.1881   -0.7509   -0.1782)
 a3 = (    0.1435   -0.1456    0.7656)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7600   -0.2163    0.1029) (    0.0016    0.0045    0.0042)
 a2 = (    0.1888   -0.7476   -0.1770) (    0.0053    0.0101    0.0061)
 a3 = (    0.1450   -0.1448    0.7663) (    0.0099    0.0094    0.0295)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  149.9970   14.9736   45.0428    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
             83             83
# Figure of merit at the beginning and the end of the refinement
        28.7743        30.6769
# Chi-squares at the beginning and the end of the refinement
    0.0381    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0673    0.0702
    2   -1   -3    0   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1012    0.0995
    3    0    3    1   -0.0261    0.0886   -0.0262    0.0895    0.0009    1    0.0989    0.0967
    4   -1   -2    1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1048    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0653    0.0654
    6   -1    2    1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0778    0.0778
    7    0   -3    1    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.1342    0.1302
    8    1   -3    0    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1049    0.1017
    9   -2    1    1   -0.1943    0.0490   -0.1952    0.0486    0.0010    1    0.0789    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -2    1    0.5316   -0.6124    0.5303   -0.6130    0.0014    1    0.1260    0.1248
   12   -3    0    1   -0.1813   -0.0376   -0.1829   -0.0381    0.0016    1    0.1014    0.0984
   13    3   -1    0    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1019    0.0927
   14    3   -2    1    0.5286   -0.1497    0.5293   -0.1451    0.0047    1    0.1513    0.1473
   15   -2   -1    1   -0.3354   -0.2363   -0.3362   -0.2357    0.0010    1    0.0887    0.0881
   16    2    0    0    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0631    0.0679
   17    2   -1    1    0.7279   -0.0814    0.7293   -0.0807    0.0016    1    0.1168    0.1198
   18    2   -2    2    1.0556   -0.5129    1.0696   -0.4972    0.0211    1    0.2565    0.2483
   19    3    1    0    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0984    0.0994
   20    3    0    1    0.4432    0.1648    0.4423    0.1634    0.0016    1    0.1202    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0441    0.0568
   22    2    1    1    0.2968    0.3328    0.3053    0.3413    0.0120    1    0.0912    0.0899
   23    1    2    1    0.0345    0.2704    0.0347    0.2716    0.0012    1    0.0817    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2   -1   -3    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0    3    1   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -1   -2    1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -1    2    1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0   -3    1    0.1202   -0.5969    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    1   -3    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -2    1    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1   -1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -2    1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -3    0    1   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    3   -1    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    3   -2    1    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2   -1    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    2    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    2   -1    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    3    1    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    3    0    1    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21   -1   -1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    2    1    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    2    1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.17                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2381    1.2620    1.2807   90.8403   91.7366   90.0058      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2607    1.2641    1.2550   90.0000   90.0000   90.0000      0.4496         1.0046    1.0073    2.8043    2.8117    2.7915
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0476    0.0503    0.0000    0.0000    0.0000      0.0285         0.0402    0.0140    0.1779    0.2074    0.2094
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1722   -0.1402    0.7769)
 a2 = (    0.1993   -0.7460   -0.1784)
 a3 = (    0.7451    0.2113   -0.1023)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1450   -0.1448    0.7663) (    0.0050    0.0046    0.0015)
 a2 = (    0.1888   -0.7476   -0.1770) (    0.0085    0.0289    0.0047)
 a3 = (    0.7600    0.2163   -0.1029) (    0.0311    0.0087    0.0038)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0405   97.4232  105.8894    0.3839    0.3018    0.3441
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            400             83
# Figure of merit at the beginning and the end of the refinement
         7.5123        30.6734
# Chi-squares at the beginning and the end of the refinement
    1.0502    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0   -3    1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    1    3    0   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1   -2    1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    0   -2    0    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    1    2    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    1   -3    0    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    0   -3   -1    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    1    1    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    1    0    3   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    0   -1   -3    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    1   -2   -3    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    1   -1    2   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0    0   -2    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    1   -1   -2    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    2   -2   -2    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    0    1   -3    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    1    0   -3    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0   -1    1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    1    1   -2    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23    1    2   -1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -3    1   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    3    0   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1   -2    1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    2    1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1   -3    0    0.1202   -0.5969    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0   -3   -1    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1031          0.1017
    9    1    1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -2   -1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0   -1   -3    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1   -2   -3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -1    2   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1   -1   -2    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    1   -3    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    1    0   -3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1    1   -2    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    2   -1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.30                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8737    0.8751    2.6165   89.4839   91.1330   89.8744      0.4073
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8702    0.8765    2.6224   90.0000   90.0000   90.0000      0.3117         0.3318    0.3342    2.7916    2.8118    8.4129
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0122    0.1050    0.0000    0.0000    0.0000      0.0240         0.0133    0.0126    0.2146    0.2196    0.7292
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.0918   -0.3097    0.1504)
 a2 = (    0.2733   -1.0790   -0.2588)
 a3 = (    0.0628   -0.0693    0.3707)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.0960   -0.3120    0.1485) (    0.0022    0.0065    0.0060)
 a2 = (    0.2723   -1.0782   -0.2553) (    0.0076    0.0146    0.0087)
 a3 = (    0.0697   -0.0696    0.3684) (    0.0048    0.0045    0.0142)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  149.9968   14.9735   45.0430    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            221            285
# Figure of merit at the beginning and the end of the refinement
         2.9190         5.7138
# Chi-squares at the beginning and the end of the refinement
    0.3699    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    3   -0.7464   -0.0593   -0.7310   -0.0567    0.0156    1    0.0877    0.0702
    2   -1   -3    0   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    0    2    2   -0.0263    0.0897   -0.0262    0.0895    0.0003    1    0.0849    0.0967
    4   -1   -2    3   -0.1923   -0.5922   -0.1957   -0.5833    0.0095    1    0.1361    0.1078
    5    0   -2    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1    2    3   -0.1072    0.1207   -0.1085    0.1216    0.0015    1    0.1001    0.0778
    7    0   -2    2    0.1245   -0.5974    0.1201   -0.5973    0.0044    1    0.1162    0.1302
    8    1   -3    0    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -2    1    3   -0.1963    0.0496   -0.1952    0.0486    0.0015    1    0.1015    0.0726
   10    1   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1   -2    3    0.5384   -0.6092    0.5303   -0.6130    0.0090    1    0.1644    0.1248
   12   -2    0    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0869    0.0984
   13    3   -1    0    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    3   -2    3    0.5307   -0.1491    0.5293   -0.1451    0.0043    1    0.1975    0.1473
   15   -2   -1    3   -0.3389   -0.2407   -0.3362   -0.2357    0.0056    1    0.1145    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    2   -1    3    0.7279   -0.0808    0.7293   -0.0807    0.0014    1    0.1524    0.1198
   18    2   -2    6    1.0531   -0.5024    1.0696   -0.4972    0.0173    1    0.3340    0.2483
   19    3    1    0    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    2    0    2    0.4459    0.1642    0.4423    0.1634    0.0036    1    0.1042    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2    1    3    0.3011    0.3334    0.3053    0.3413    0.0090    1    0.1186    0.0899
   23    1    2    3    0.0365    0.2735    0.0347    0.2716    0.0026    1    0.1056    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    3   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2   -1   -3    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    4    3   -0.0016    0.0479   -0.0262    0.0895    0.0483    1          0.1298          0.0967
    4   -1   -2    3   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -1    2    3   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0   -3    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    1   -3    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -2    1    3   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1   -1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -2    3    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -4   -1    3   -0.1432   -0.0707   -0.1829   -0.0381    0.0513    1          0.1336          0.0984
   13    3   -1    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    3   -2    3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2   -1    3   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    2    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    2   -1    3    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2    6    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    3    1    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    3    0    3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21   -1   -1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    2    1    3    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    2    3    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.31                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8745    0.8746    2.6152   90.5562   89.7326   90.1283      0.9229
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8765    0.8702    2.6223   90.0000   90.0000   90.0000      0.3117         0.3342    0.3318    2.8119    2.7917    8.4131
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0121    0.0987    0.0000    0.0000    0.0000      0.0235         0.0126    0.0133    0.2116    0.2136    0.7078
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2700    1.0808    0.2583)
 a2 = (    1.0902    0.3107   -0.1493)
 a3 = (   -0.0667    0.0699   -0.3700)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2723    1.0781    0.2553) (    0.0062    0.0022    0.0073)
 a2 = (    1.0960    0.3120   -0.1485) (    0.0158    0.0071    0.0062)
 a3 = (   -0.0697    0.0696   -0.3684) (    0.0046    0.0043    0.0133)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  120.0032  165.0263 -134.9569    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            146            285
# Figure of merit at the beginning and the end of the refinement
         0.9444         5.7138
# Chi-squares at the beginning and the end of the refinement
   19.3145    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -3   -0.7400   -0.0580   -0.7310   -0.0567    0.0091    1    0.1990    0.0702
    2    1    1    0   -0.0343   -0.0581   -0.0130   -0.1762    0.1200    1    0.1292    0.0995
    3   -1    0   -1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0964    0.0967
    4    2    1   -3   -0.1950   -0.5882   -0.1957   -0.5833    0.0049    1    0.3111    0.1078
    5    2    0    0    0.0562   -0.2249    0.0560   -0.2234    0.0016    1    0.1919    0.0654
    6   -1    1   -2   -0.1623    0.0989   -0.1085    0.1216    0.0585    1    0.1466    0.0778
    7    1    0   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1315    0.1302
    8    2    0    0    0.0562   -0.2249    0.1454   -0.2240    0.0892    1    0.1919    0.1017
    9    0    1   -1   -0.1829   -0.0381   -0.1952    0.0486    0.0875    1    0.0987    0.0726
   10    1   -1    0    0.2269   -0.1285    0.2251   -0.1274    0.0021    1    0.1371    0.0467
   11    2   -1   -3    0.5359   -0.6150    0.5303   -0.6130    0.0059    1    0.3763    0.1248
   12    0    1   -1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0987    0.0984
   13    0   -2    0    0.1267    0.0361    0.1990   -0.0092    0.0853    1    0.1852    0.0927
   14    1   -2   -1    0.3787   -0.0619    0.5293   -0.1451    0.1721    0    0.2369    0.1473
   15    1    2   -3   -0.3379   -0.2389   -0.3362   -0.2357    0.0036    1    0.2619    0.0881
   16    0   -2    0    0.1267    0.0361    0.1275    0.0362    0.0008    1    0.1852    0.0679
   17    1   -2   -3    0.7317   -0.0812    0.7293   -0.0807    0.0024    1    0.3481    0.1198
   18    1   -1   -2    0.7400   -0.3802    1.0696   -0.4972    0.3497    0    0.2421    0.2483
   19   -1    0   -1   -0.0262    0.0895    0.0442    0.0295    0.0924    1    0.0964    0.0994
   20    0   -1   -1    0.4457    0.1657    0.4423    0.1634    0.0041    1    0.1177    0.1178
   21    1    1    0   -0.0343   -0.0581   -0.0341   -0.0579    0.0002    1    0.1292    0.0568
   22   -1   -1   -2    0.1539    0.3431    0.3053    0.3413    0.1514    1    0.1627    0.0899
   23   -2   -1   -3    0.0355    0.2723    0.0347    0.2716    0.0011    1    0.2408    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -3   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    3    1    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -4   -1   -3   -0.0016    0.0479   -0.0262    0.0895    0.0483    1          0.1298          0.0967
    4    2    1   -3   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    2    0    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -2    1   -3   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    3    0   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    3   -1    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -1    2   -3   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1   -1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    2   -1   -3    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1    4   -3   -0.1432   -0.0707   -0.1829   -0.0381    0.0513    1          0.1336          0.0984
   13    1   -3    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    2   -3   -3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    2   -3   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0   -2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1   -2   -3    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2   -6    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -1   -3    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    0   -3   -3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    1    1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -1   -2   -3    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2   -1   -3    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.34                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8734    0.8759    2.6150   89.7152   91.0962   90.3054      0.7057
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8765    0.8702    2.6223   90.0000   90.0000   90.0000      0.3117         0.3342    0.3318    2.8119    2.7917    8.4131
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0121    0.0987    0.0000    0.0000    0.0000      0.0235         0.0126    0.0133    0.2116    0.2136    0.7078
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2701   -1.0819   -0.2607)
 a2 = (   -1.0887   -0.3126    0.1432)
 a3 = (   -0.0656    0.0653   -0.3711)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2723   -1.0781   -0.2553) (    0.0062    0.0022    0.0073)
 a2 = (   -1.0960   -0.3120    0.1485) (    0.0158    0.0071    0.0062)
 a3 = (   -0.0697    0.0696   -0.3684) (    0.0046    0.0043    0.0133)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -59.9968  165.0263 -134.9569    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            175            287
# Figure of merit at the beginning and the end of the refinement
         1.1647         5.7005
# Chi-squares at the beginning and the end of the refinement
   18.2935    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -3   -0.7485   -0.0679   -0.7310   -0.0567    0.0208    1    0.1535    0.0702
    2   -2    0    0    0.0566   -0.2268   -0.0130   -0.1762    0.0861    1    0.1468    0.0995
    3    1    0   -1   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0734    0.0967
    4   -2   -1   -3   -0.1931   -0.5909   -0.1957   -0.5833    0.0080    1    0.2389    0.1078
    5   -2    0    0    0.0566   -0.2268    0.0560   -0.2234    0.0035    1    0.1468    0.0654
    6    1   -1   -2   -0.1664    0.1005   -0.1085    0.1216    0.0616    1    0.1117    0.0778
    7   -1    0   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1010    0.1302
    8   -2    0    0    0.0566   -0.2268    0.1454   -0.2240    0.0888    1    0.1468    0.1017
    9    1   -1   -2   -0.1664    0.1005   -0.1952    0.0486    0.0593    1    0.1117    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.1044    0.0467
   11   -2    1   -3    0.5315   -0.6143    0.5303   -0.6130    0.0017    1    0.2861    0.1248
   12    0   -1   -1   -0.1888   -0.0404   -0.1829   -0.0381    0.0064    1    0.0756    0.0984
   13    0    2    0    0.1215    0.0349    0.1990   -0.0092    0.0891    1    0.1410    0.0927
   14   -2    2   -2    0.4623   -0.2517    0.5293   -0.1451    0.1259    1    0.2596    0.1473
   15   -1   -2   -3   -0.3410   -0.2449   -0.3362   -0.2357    0.0103    1    0.2013    0.0881
   16    0    2    0    0.1215    0.0349    0.1275    0.0362    0.0061    1    0.1410    0.0679
   17   -1    2   -3    0.7280   -0.0843    0.7293   -0.0807    0.0039    1    0.2637    0.1198
   18   -2    2   -6    1.0501   -0.5181    1.0696   -0.4972    0.0287    1    0.5897    0.2483
   19   -1    2    1    0.0671   -0.0139    0.0442    0.0295    0.0492    1    0.1572    0.0994
   20    0    1   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0894    0.1178
   21   -1   -1    0   -0.0368   -0.0626   -0.0341   -0.0579    0.0054    1    0.0989    0.0568
   22    1    2   -3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.2044    0.0899
   23    2    1   -3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1827    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -3   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2   -3   -1    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    4    1   -3   -0.0016    0.0479   -0.0262    0.0895    0.0483    1          0.1298          0.0967
    4   -2   -1   -3   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5   -2    0    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    2   -1   -3   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7   -3    0   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -3    1    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1   -2   -3   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2    1   -3    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -1   -4   -3   -0.1432   -0.0707   -0.1829   -0.0381    0.0513    1          0.1336          0.0984
   13   -1    3    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -2    3   -3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1   -2   -3   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -1    2   -3    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2    2   -6    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    1    3    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20    0    3   -3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21   -1   -1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1    2   -3    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    2    1   -3    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.35                ###
# Bravais type
 Orthorhombic(I)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8724    0.8750    2.6201   89.9717   90.3972   90.0380      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8702    0.8765    2.6224   90.0000   90.0000   90.0000      0.3117         0.3318    0.3342    2.7916    2.8118    8.4129
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0122    0.1050    0.0000    0.0000    0.0000      0.0240         0.0133    0.0126    0.2146    0.2196    0.7292
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.0942    0.3079   -0.1475)
 a2 = (    0.2699   -1.0802   -0.2580)
 a3 = (   -0.0671    0.0715   -0.3689)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.0960    0.3120   -0.1485) (    0.0022    0.0065    0.0060)
 a2 = (    0.2723   -1.0782   -0.2553) (    0.0076    0.0146    0.0087)
 a3 = (   -0.0697    0.0696   -0.3684) (    0.0048    0.0045    0.0142)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -149.9968  165.0265 -134.9570    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            223            289
# Figure of merit at the beginning and the end of the refinement
         2.5635         5.6874
# Chi-squares at the beginning and the end of the refinement
    0.5182    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -3   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2    1   -3    0   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3    0    2   -2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4    1   -2   -3   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5    0   -2    0    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6    1    2   -3   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7    0   -2   -2    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8   -1   -3    0    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9    2    1   -3   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11   -1   -2   -3    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12    2    0   -2   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13   -3   -1    0    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14   -3   -2   -3    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15    2   -1   -3   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16   -2    0    0    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17   -2   -1   -3    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18   -2   -2   -6    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19   -3    1    0    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20   -2    0   -2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21    1   -1    0   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22   -2    1   -3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23   -1    2   -3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -3   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    1   -3    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -1    4   -3   -0.0016    0.0479   -0.0262    0.0895    0.0483    1          0.1298          0.0967
    4    1   -2   -3   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    2   -3   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0   -3   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -1   -3    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    2    1   -3   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1   -1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -2   -3    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    4   -1   -3   -0.1432   -0.0707   -0.1829   -0.0381    0.0513    1          0.1336          0.0984
   13   -3   -1    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -3   -2   -3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    2   -1   -3   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16   -2    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -2   -1   -3    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2   -2   -6    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -3    1    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20   -3    0   -3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    1   -1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -2    1   -3    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    2   -3    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###                                ###
### Candidates for Orthorhombic(C) ###
###                                ###

###            No.1                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9946    1.4128    1.4233   90.0305   90.4979   90.2400      0.4015
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9980    1.4142    1.4171   90.0000   90.0000   90.0000      0.3549         0.7042    0.9980    2.8117    3.9845    3.9925
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0531    0.0553    0.0000    0.0000    0.0000      0.0225         0.0275    0.0135    0.1782    0.2935    0.2971
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1772   -0.1882    0.9716)
 a2 = (   -0.5963    0.3376    0.1773)
 a3 = (   -0.3560   -0.6040   -0.0457)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1838   -0.1834    0.9678) (    0.0062    0.0057    0.0019)
 a2 = (   -0.5963    0.3363    0.1770) (    0.0230    0.0141    0.0042)
 a3 = (   -0.3564   -0.6072   -0.0474) (    0.0147    0.0236    0.0032)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   75.4728   93.8497  -30.4148    0.4072    0.2522    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            157            145
# Figure of merit at the beginning and the end of the refinement
         6.8940        12.7834
# Chi-squares at the beginning and the end of the refinement
    0.1774    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7402   -0.0512   -0.7310   -0.0567    0.0107    1    0.0754    0.0702
    2    0    2   -4   -0.0129   -0.1729   -0.0130   -0.1762    0.0033    1    0.1119    0.0995
    3    1   -3    3   -0.0275    0.0922   -0.0262    0.0895    0.0031    1    0.1101    0.0967
    4    1    1   -3   -0.1955   -0.5910   -0.1957   -0.5833    0.0077    1    0.1166    0.1078
    5    0    2   -2    0.0568   -0.2224    0.0560   -0.2234    0.0013    1    0.0724    0.0654
    6    1   -3    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0868    0.0778
    7    1    3   -3    0.1231   -0.5969    0.1201   -0.5973    0.0030    1    0.1495    0.1302
    8    0    4   -2    0.1433   -0.2192    0.1454   -0.2240    0.0053    1    0.1166    0.1017
    9    1   -3   -1   -0.1961    0.0504   -0.1952    0.0486    0.0020    1    0.0879    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0521    0.0467
   11    1    3   -1    0.5377   -0.6117    0.5303   -0.6130    0.0075    1    0.1410    0.1248
   12    1   -3   -3   -0.1828   -0.0368   -0.1829   -0.0381    0.0013    1    0.1125    0.0984
   13    0    4    2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1135    0.0927
   14    1    5    1    0.5307   -0.1504    0.5293   -0.1451    0.0055    1    0.1693    0.1473
   15    1   -1   -3   -0.3400   -0.2375   -0.3362   -0.2357    0.0042    1    0.0984    0.0881
   16    0    2    2    0.1281    0.0358    0.1275    0.0362    0.0007    1    0.0701    0.0679
   17    1    3    1    0.7316   -0.0820    0.7293   -0.0807    0.0026    1    0.1310    0.1198
   18    2    4    0    1.0618   -0.5092    1.0696   -0.4972    0.0144    1    0.2883    0.2483
   19    0    2    4    0.0454    0.0302    0.0442    0.0295    0.0014    1    0.1090    0.0994
   20    1    3    3    0.4489    0.1654    0.4423    0.1634    0.0068    1    0.1344    0.1178
   21    0    0   -2   -0.0331   -0.0562   -0.0341   -0.0579    0.0020    1    0.0487    0.0568
   22    1    1    3    0.3023    0.3380    0.3053    0.3413    0.0044    1    0.1020    0.0899
   23    1   -1    3    0.0349    0.2767    0.0347    0.2716    0.0050    1    0.0910    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0    2   -4   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    1   -3    3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1    1   -3   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0    2   -2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6    1   -3    1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    1    3   -3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0    4   -2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1   -3   -1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1    3   -1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    1   -3   -3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0    4    2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    5    1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    1   -1   -3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0    2    2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17    1    3    1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    2    4    0    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0    2    4    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20    1    3    3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    0   -3   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0649          0.0568
   22    1    1    3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1   -1    3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.2                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0017    1.4080    1.4182   90.0110   90.4442   89.1015      0.5522
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    1.4142    1.4174   90.0000   90.0000   90.0000      0.3524         0.7039    0.9978    2.8317    4.0137    4.0225
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0531    0.0553    0.0000    0.0000    0.0000      0.0223         0.0275    0.0135    0.1794    0.2955    0.2992
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1737   -0.1690    0.9686)
 a2 = (    0.5984   -0.3388   -0.1779)
 a3 = (    0.3573    0.6061    0.0473)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1839   -0.1835    0.9680) (    0.0062    0.0057    0.0019)
 a2 = (    0.5963   -0.3362   -0.1770) (    0.0230    0.0141    0.0042)
 a3 = (    0.3564    0.6071    0.0474) (    0.0147    0.0236    0.0032)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  104.5297   86.1500  149.5861    0.4071    0.2523    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0014      0.0023    0.0022    0.0378

# Number of computed bands
            159            141
# Figure of merit at the beginning and the end of the refinement
         2.3052        12.6194
# Chi-squares at the beginning and the end of the refinement
    4.0159    0.0299
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7364   -0.0641   -0.7310   -0.0567    0.0092    1    0.1035    0.0702
    2    0   -2    3    0.0100   -0.1989   -0.0130   -0.1762    0.0323    1    0.1259    0.0995
    3    1    3   -2   -0.0583    0.1114   -0.0262    0.0895    0.0389    1    0.1317    0.0967
    4    1   -1    3   -0.1907   -0.5860   -0.1957   -0.5833    0.0057    1    0.1612    0.1078
    5    0   -2    2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1    0.1001    0.0654
    6    1    3   -1   -0.1076    0.1196   -0.1085    0.1216    0.0022    1    0.1190    0.0778
    7    1   -3    3    0.1220   -0.5916    0.1201   -0.5973    0.0060    1    0.2069    0.1302
    8    0   -2    1    0.1438   -0.2199    0.1454   -0.2240    0.0044    1    0.0805    0.1017
    9    1    3    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1209    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0719    0.0467
   11    1   -3    1    0.5279   -0.6069    0.5303   -0.6130    0.0066    1    0.1939    0.1248
   12    1    3    2   -0.1973   -0.0020   -0.1829   -0.0381    0.0389    1    0.1351    0.0984
   13    0   -2   -1    0.1981   -0.0091    0.1990   -0.0092    0.0009    1    0.0782    0.0927
   14    1   -5   -1    0.5261   -0.1522    0.5293   -0.1451    0.0078    1    0.2339    0.1473
   15    1    1    3   -0.3360   -0.2388   -0.3362   -0.2357    0.0031    1    0.1361    0.0881
   16    0   -2   -2    0.1267    0.0354    0.1275    0.0362    0.0011    1    0.0967    0.0679
   17    1   -3   -1    0.7244   -0.0883    0.7293   -0.0807    0.0091    1    0.1800    0.1198
   18    2   -4    0    1.0379   -0.5159    1.0696   -0.4972    0.0368    1    0.3938    0.2483
   19    0   -2   -3    0.0752    0.0378    0.0442    0.0295    0.0321    1    0.1219    0.0994
   20    1   -3   -3    0.4470    0.1611    0.4423    0.1634    0.0052    1    0.1850    0.1178
   21    0    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0672    0.0568
   22    1   -1   -3    0.3033    0.3341    0.3053    0.3413    0.0075    1    0.1398    0.0899
   23    1    1   -3    0.0353    0.2744    0.0347    0.2716    0.0028    1    0.1245    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7320   -0.0564   -0.7310   -0.0567    0.0010    1          0.0661          0.0702
    2    0   -2    4   -0.0127   -0.1741   -0.0130   -0.1762    0.0021    1          0.0987          0.0995
    3    1    3   -3   -0.0266    0.0896   -0.0262    0.0895    0.0004    1          0.0967          0.0967
    4    1   -1    3   -0.1947   -0.5863   -0.1957   -0.5833    0.0032    1          0.1026          0.1078
    5    0   -2    2    0.0571   -0.2232    0.0560   -0.2234    0.0011    1          0.0638          0.0654
    6    1    3   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0762          0.0778
    7    1   -3    3    0.1208   -0.5949    0.1201   -0.5973    0.0025    1          0.1314          0.1302
    8    0   -4    2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1025          0.1017
    9    1    3    1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0773          0.0726
   10    0   -2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0457          0.0467
   11    1   -3    1    0.5343   -0.6126    0.5303   -0.6130    0.0040    1          0.1236          0.1248
   12    1    3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0992          0.0984
   13    0   -4   -2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.0997          0.0927
   14    1   -5   -1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1482          0.1473
   15    1    1    3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0868          0.0881
   16    0   -2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0616          0.0679
   17    1   -3   -1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1146          0.1198
   18    2   -4    0    1.0600   -0.5138    1.0696   -0.4972    0.0192    1          0.2525          0.2483
   19    0   -2   -4    0.0436    0.0289    0.0442    0.0295    0.0008    1          0.0960          0.0994
   20    1   -3   -3    0.4453    0.1656    0.4423    0.1634    0.0037    1          0.1176          0.1178
   21    0    0    3   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0645          0.0568
   22    1   -1   -3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0892          0.0899
   23    1    1   -3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0798          0.0816

###            No.4                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9864    1.4251    1.4228   90.1311   90.4132   90.3880      0.3538
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    1.4142    1.4174   90.0000   90.0000   90.0000      0.3524         0.7039    0.9978    2.8317    4.0137    4.0225
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0531    0.0553    0.0000    0.0000    0.0000      0.0223         0.0275    0.0135    0.1794    0.2955    0.2992
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1789    0.1845   -0.9807)
 a2 = (    0.5912   -0.3347   -0.1757)
 a3 = (   -0.3559   -0.6037   -0.0539)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1839    0.1835   -0.9680) (    0.0062    0.0057    0.0019)
 a2 = (    0.5963   -0.3362   -0.1770) (    0.0230    0.0141    0.0042)
 a3 = (   -0.3564   -0.6071   -0.0474) (    0.0147    0.0236    0.0032)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -104.5297   93.8500  -30.4139    0.4071    0.2523    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0014      0.0023    0.0022    0.0378

# Number of computed bands
            141            141
# Figure of merit at the beginning and the end of the refinement
         7.8086        12.6193
# Chi-squares at the beginning and the end of the refinement
    0.1483    0.0299
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0681    0.0702
    2    0   -2   -4   -0.0143   -0.1827   -0.0130   -0.1762    0.0066    1    0.0989    0.0995
    3   -1    3    3   -0.0264    0.0895   -0.0262    0.0895    0.0002    1    0.0964    0.0967
    4   -1   -1   -3   -0.2020   -0.6045   -0.1957   -0.5833    0.0221    1    0.1049    0.1078
    5    0   -2   -2    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0639    0.0654
    6   -1    3    1   -0.1108    0.1243   -0.1085    0.1216    0.0036    1    0.0760    0.0778
    7   -1   -3   -3    0.1222   -0.6101    0.1201   -0.5973    0.0130    1    0.1335    0.1302
    8    0   -4   -2    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1024    0.1017
    9   -1    3   -1   -0.2066    0.0523   -0.1952    0.0486    0.0120    1    0.0774    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0455    0.0467
   11   -1   -3   -1    0.5434   -0.6243    0.5303   -0.6130    0.0173    1    0.1256    0.1248
   12   -1    3   -3   -0.1954   -0.0403   -0.1829   -0.0381    0.0127    1    0.0995    0.0984
   13    0   -4    2    0.1931   -0.0082    0.1990   -0.0092    0.0059    1    0.0990    0.0927
   14   -1   -5    1    0.5337   -0.1508    0.5293   -0.1451    0.0072    1    0.1483    0.1473
   15   -1    1   -3   -0.3520   -0.2475   -0.3362   -0.2357    0.0197    1    0.0881    0.0881
   16    0   -2    2    0.1190    0.0338    0.1275    0.0362    0.0088    1    0.0612    0.0679
   17   -1   -3    1    0.7364   -0.0815    0.7293   -0.0807    0.0071    1    0.1151    0.1198
   18   -2   -4    0    1.0763   -0.5201    1.0696   -0.4972    0.0239    1    0.2577    0.2483
   19    0   -2    4    0.0360    0.0241    0.0442    0.0295    0.0098    1    0.0957    0.0994
   20   -1   -3    3    0.4441    0.1654    0.4423    0.1634    0.0027    1    0.1172    0.1178
   21    0    0   -3   -0.0390   -0.0662   -0.0341   -0.0579    0.0096    1    0.0645    0.0568
   22   -1   -1    3    0.2975    0.3339    0.3053    0.3413    0.0108    1    0.0889    0.0899
   23   -1    1    3    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0796    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7320   -0.0564   -0.7310   -0.0567    0.0010    1          0.0661          0.0702
    2    0   -2   -4   -0.0127   -0.1741   -0.0130   -0.1762    0.0021    1          0.0987          0.0995
    3   -1    3    3   -0.0266    0.0896   -0.0262    0.0895    0.0004    1          0.0967          0.0967
    4   -1   -1   -3   -0.1947   -0.5863   -0.1957   -0.5833    0.0032    1          0.1026          0.1078
    5    0   -2   -2    0.0571   -0.2232    0.0560   -0.2234    0.0011    1          0.0638          0.0654
    6   -1    3    1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0762          0.0778
    7   -1   -3   -3    0.1208   -0.5949    0.1201   -0.5973    0.0025    1          0.1314          0.1302
    8    0   -4   -2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1025          0.1017
    9   -1    3   -1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0773          0.0726
   10    0   -2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0457          0.0467
   11   -1   -3   -1    0.5343   -0.6126    0.5303   -0.6130    0.0040    1          0.1236          0.1248
   12   -1    3   -3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0992          0.0984
   13    0   -4    2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.0997          0.0927
   14   -1   -5    1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1482          0.1473
   15   -1    1   -3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0868          0.0881
   16    0   -2    2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0616          0.0679
   17   -1   -3    1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1146          0.1198
   18   -2   -4    0    1.0600   -0.5138    1.0696   -0.4972    0.0192    1          0.2525          0.2483
   19    0   -2    4    0.0436    0.0289    0.0442    0.0295    0.0008    1          0.0960          0.0994
   20   -1   -3    3    0.4453    0.1656    0.4423    0.1634    0.0037    1          0.1176          0.1178
   21    0    0   -3   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0645          0.0568
   22   -1   -1    3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0892          0.0899
   23   -1    1    3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0798          0.0816

###            No.9                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0006    1.4191    1.4089   90.3744   91.2008   89.9536      0.3469
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9978    1.4142    1.4174   90.0000   90.0000   90.0000      0.3524         0.7039    0.9978    2.8317    4.0137    4.0225
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0531    0.0553    0.0000    0.0000    0.0000      0.0223         0.0275    0.0135    0.1794    0.2955    0.2992
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1729    0.1981   -0.9644)
 a2 = (   -0.5911    0.3406    0.1765)
 a3 = (    0.3598    0.6103    0.0455)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1839    0.1835   -0.9680) (    0.0062    0.0057    0.0019)
 a2 = (   -0.5963    0.3362    0.1770) (    0.0230    0.0141    0.0042)
 a3 = (    0.3564    0.6071    0.0474) (    0.0147    0.0236    0.0032)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -75.4703   86.1500  149.5861    0.4071    0.2523    0.3340
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0014      0.0023    0.0022    0.0378

# Number of computed bands
            149            142
# Figure of merit at the beginning and the end of the refinement
        10.6636        12.5896
# Chi-squares at the beginning and the end of the refinement
    0.3449    0.0299
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7386   -0.0470   -0.7310   -0.0567    0.0123    1    0.0646    0.0702
    2    0    2    4   -0.0140   -0.1701   -0.0130   -0.1762    0.0062    1    0.0976    0.0995
    3   -1   -3   -3   -0.0257    0.0906   -0.0262    0.0895    0.0012    1    0.0959    0.0967
    4   -1    1    3   -0.1949   -0.5819   -0.1957   -0.5833    0.0016    1    0.1003    0.1078
    5    0    2    2    0.0536   -0.2203    0.0560   -0.2234    0.0039    1    0.0629    0.0654
    6   -1   -3   -1   -0.1053    0.1215   -0.1085    0.1216    0.0031    1    0.0750    0.0778
    7   -1    3    3    0.1161   -0.5913    0.1201   -0.5973    0.0073    1    0.1285    0.1302
    8    0    4    2    0.1397   -0.2194    0.1454   -0.2240    0.0073    1    0.1008    0.1017
    9   -1   -3    1   -0.1948    0.0515   -0.1952    0.0486    0.0029    1    0.0755    0.0726
   10    0    2    0    0.2241   -0.1291    0.2251   -0.1274    0.0020    1    0.0448    0.0467
   11   -1    3    1    0.5311   -0.6139    0.5303   -0.6130    0.0011    1    0.1209    0.1248
   12   -1   -3    3   -0.1815   -0.0366   -0.1829   -0.0381    0.0020    1    0.0968    0.0984
   13    0    4   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.0976    0.0927
   14   -1    5   -1    0.5302   -0.1510    0.5293   -0.1451    0.0059    1    0.1453    0.1473
   15   -1   -1    3   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0848    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0605    0.0679
   17   -1    3   -1    0.7302   -0.0795    0.7293   -0.0807    0.0015    1    0.1124    0.1198
   18   -2    4    0    1.0618   -0.5083    1.0696   -0.4972    0.0135    1    0.2469    0.2483
   19    0    2   -4    0.0450    0.0302    0.0442    0.0295    0.0010    1    0.0946    0.0994
   20   -1    3   -3    0.4438    0.1668    0.4423    0.1634    0.0037    1    0.1158    0.1178
   21    0    0    3   -0.0326   -0.0553   -0.0341   -0.0579    0.0031    1    0.0637    0.0568
   22   -1    1   -3    0.2953    0.3330    0.3053    0.3413    0.0130    1    0.0883    0.0899
   23   -1   -1   -3    0.0359    0.2702    0.0347    0.2716    0.0019    1    0.0794    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7320   -0.0564   -0.7310   -0.0567    0.0010    1          0.0661          0.0702
    2    0    2    4   -0.0127   -0.1741   -0.0130   -0.1762    0.0021    1          0.0987          0.0995
    3   -1   -3   -3   -0.0266    0.0896   -0.0262    0.0895    0.0004    1          0.0967          0.0967
    4   -1    1    3   -0.1947   -0.5863   -0.1957   -0.5833    0.0032    1          0.1026          0.1078
    5    0    2    2    0.0571   -0.2232    0.0560   -0.2234    0.0011    1          0.0638          0.0654
    6   -1   -3   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0762          0.0778
    7   -1    3    3    0.1208   -0.5949    0.1201   -0.5973    0.0025    1          0.1314          0.1302
    8    0    4    2    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1025          0.1017
    9   -1   -3    1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0773          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0457          0.0467
   11   -1    3    1    0.5343   -0.6126    0.5303   -0.6130    0.0040    1          0.1236          0.1248
   12   -1   -3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0992          0.0984
   13    0    4   -2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.0997          0.0927
   14   -1    5   -1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1482          0.1473
   15   -1   -1    3   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0868          0.0881
   16    0    2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0616          0.0679
   17   -1    3   -1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1146          0.1198
   18   -2    4    0    1.0600   -0.5138    1.0696   -0.4972    0.0192    1          0.2525          0.2483
   19    0    2   -4    0.0436    0.0289    0.0442    0.0295    0.0008    1          0.0960          0.0994
   20   -1    3   -3    0.4453    0.1656    0.4423    0.1634    0.0037    1          0.1176          0.1178
   21    0    0    3   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0645          0.0568
   22   -1    1   -3    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0892          0.0899
   23   -1   -1   -3    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0798          0.0816

###            No.11                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0075    1.3998    1.4185   90.2507   90.6108   88.9195      0.3559
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9957    1.4139    1.4206   90.0000   90.0000   90.0000      0.3573         0.7009    0.9952    2.7866    3.9569    3.9758
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0252    0.0239    0.0000    0.0000    0.0000      0.0239         0.0118    0.0190    0.1864    0.2739    0.2742
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9428   -0.2866    0.1203)
 a2 = (   -0.2077    0.5733   -0.3724)
 a3 = (    0.0295   -0.3736   -0.5972)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9579   -0.2727    0.1291) (    0.0019    0.0058    0.0043)
 a2 = (   -0.2107    0.5647   -0.3702) (    0.0063    0.0117    0.0052)
 a3 = (    0.0278   -0.3783   -0.5929) (    0.0032    0.0082    0.0098)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  166.1982  147.3889    4.2010    0.4854    0.4031    0.4642
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0006   -0.0045      0.0021    0.0023    0.0150

# Number of computed bands
            400            157
# Figure of merit at the beginning and the end of the refinement
         5.9925        12.4730
# Chi-squares at the beginning and the end of the refinement
    0.3083    0.0226
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0677    0.0702
    2   -1    3   -3   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1005    0.0995
    3    0   -4    2   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0982    0.0967
    4   -1    1   -3   -0.1935   -0.5926   -0.1957   -0.5833    0.0095    1    0.1044    0.1078
    5    0    2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0645    0.0654
    6   -1   -3    1   -0.1098    0.1243   -0.1085    0.1216    0.0030    1    0.0768    0.0778
    7    0    2   -4    0.1208   -0.5981    0.1201   -0.5973    0.0010    1    0.1327    0.1302
    8    1    3   -3    0.1420   -0.2192    0.1454   -0.2240    0.0059    1    0.1028    0.1017
    9   -2   -2    0   -0.2063    0.0514   -0.1952    0.0486    0.0114    1    0.0775    0.0726
   10    1    1   -1    0.2227   -0.1246    0.2251   -0.1274    0.0037    1    0.0455    0.0467
   11    1    1   -3    0.5425   -0.6163    0.5303   -0.6130    0.0126    1    0.1244    0.1248
   12   -3   -1   -1   -0.1931   -0.0424   -0.1829   -0.0381    0.0111    1    0.0998    0.0984
   13    3    1   -1    0.1909   -0.0054    0.1990   -0.0092    0.0088    1    0.0991    0.0927
   14    3    1   -3    0.5318   -0.1420    0.5293   -0.1451    0.0040    1    0.1474    0.1473
   15   -2    0   -2   -0.3429   -0.2479   -0.3362   -0.2357    0.0139    1    0.0883    0.0881
   16    2    0    0    0.1168    0.0355    0.1275    0.0362    0.0107    1    0.0616    0.0679
   17    2    0   -2    0.7321   -0.0655    0.7293   -0.0807    0.0155    1    0.1143    0.1198
   18    2    0   -4    1.0834   -0.4980    1.0696   -0.4972    0.0139    1    0.2554    0.2483
   19    3   -1    1    0.0354    0.0247    0.0442    0.0295    0.0101    1    0.0970    0.0994
   20    3   -1   -1    0.4329    0.1731    0.4423    0.1634    0.0135    1    0.1174    0.1178
   21   -1    1   -1   -0.0365   -0.0638   -0.0341   -0.0579    0.0063    1    0.0438    0.0568
   22    2   -2    0    0.2830    0.3311    0.3053    0.3413    0.0245    0    0.0898    0.0899
   23    1   -3    1    0.0323    0.2651    0.0347    0.2716    0.0069    1    0.0813    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7299   -0.0559   -0.7310   -0.0567    0.0014    1          0.0663          0.0702
    2   -1    3   -3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3    0   -4    2   -0.0265    0.0896   -0.0262    0.0895    0.0004    1          0.0975          0.0967
    4   -1    1   -3   -0.1967   -0.5859   -0.1957   -0.5833    0.0027    1          0.1030          0.1078
    5    0    2   -2    0.0567   -0.2236    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6   -1   -3    1   -0.1075    0.1194   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    0    2   -4    0.1204   -0.5965    0.1201   -0.5973    0.0009    1          0.1318          0.1302
    8    1    3   -3    0.1439   -0.2199    0.1454   -0.2240    0.0043    1          0.1032          0.1017
    9   -2   -2    0   -0.1947    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10    1    1   -1    0.2252   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    1   -3    0.5370   -0.6123    0.5303   -0.6130    0.0067    1          0.1238          0.1248
   12   -3   -1   -1   -0.1811   -0.0381   -0.1829   -0.0381    0.0017    1          0.1004          0.0984
   13    3    1   -1    0.1969   -0.0085    0.1990   -0.0092    0.0021    1          0.1008          0.0927
   14    3    1   -3    0.5289   -0.1477    0.5293   -0.1451    0.0026    1          0.1490          0.1473
   15   -2    0   -2   -0.3359   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16    2    0    0    0.1256    0.0351    0.1275    0.0362    0.0022    1          0.0624          0.0679
   17    2    0   -2    0.7278   -0.0785    0.7293   -0.0807    0.0027    1          0.1149          0.1198
   18    2    0   -4    1.0617   -0.5074    1.0696   -0.4972    0.0129    1          0.2518          0.2483
   19    3   -1    1    0.0437    0.0284    0.0442    0.0295    0.0012    1          0.0973          0.0994
   20    3   -1   -1    0.4428    0.1646    0.4423    0.1634    0.0013    1          0.1186          0.1178
   21   -1    1   -1   -0.0336   -0.0579   -0.0341   -0.0579    0.0006    1          0.0435          0.0568
   22    2   -2    0    0.2979    0.3329    0.3053    0.3413    0.0112    1          0.0900          0.0899
   23    1   -3    1    0.0350    0.2721    0.0347    0.2716    0.0005    1          0.0805          0.0816

###            No.15                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0087    1.4139    1.4029   91.4180   90.4264   90.6033      0.3553
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9953    1.4143    1.4209   90.0000   90.0000   90.0000      0.3583         0.7005    0.9954    2.7776    3.9469    3.9653
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0241    0.0235    0.0000    0.0000    0.0000      0.0235         0.0116    0.0188    0.1819    0.2671    0.2678
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9455   -0.2695    0.1282)
 a2 = (    0.2034   -0.5601    0.3815)
 a3 = (   -0.0314    0.3776    0.6041)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9583   -0.2728    0.1296) (    0.0018    0.0056    0.0042)
 a2 = (    0.2107   -0.5641    0.3706) (    0.0060    0.0112    0.0051)
 a3 = (   -0.0277    0.3789    0.5925) (    0.0032    0.0082    0.0095)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.8269   32.6675 -175.8166    0.4749    0.3864    0.4622
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            400            153
# Figure of merit at the beginning and the end of the refinement
         5.7529        12.4314
# Chi-squares at the beginning and the end of the refinement
    0.2564    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7625   -0.0593   -0.7310   -0.0567    0.0316    0    0.0683    0.0702
    2   -1   -3    3   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.0988    0.0995
    3    0    4   -2   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0968    0.0967
    4   -1   -1    3   -0.1976   -0.5985   -0.1957   -0.5833    0.0153    1    0.1043    0.1078
    5    0   -2    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0638    0.0654
    6   -1    3   -1   -0.1144    0.1289   -0.1085    0.1216    0.0094    1    0.0763    0.0778
    7    0   -2    4    0.1222   -0.6037    0.1201   -0.5973    0.0068    1    0.1330    0.1302
    8    1   -3    3    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1024    0.1017
    9   -2    2    0   -0.2071    0.0524   -0.1952    0.0486    0.0125    1    0.0774    0.0726
   10    1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0456    0.0467
   11    1   -1    3    0.5426   -0.6213    0.5303   -0.6130    0.0148    1    0.1258    0.1248
   12   -3    1    1   -0.1914   -0.0398   -0.1829   -0.0381    0.0087    1    0.0993    0.0984
   13    3   -1    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1    0.0995    0.0927
   14    3   -1    3    0.5365   -0.1514    0.5293   -0.1451    0.0096    1    0.1495    0.1473
   15   -2    0    2   -0.3468   -0.2455   -0.3362   -0.2357    0.0144    1    0.0878    0.0881
   16    2    0    0    0.1255    0.0358    0.1275    0.0362    0.0021    1    0.0616    0.0679
   17    2    0    2    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1165    0.1198
   18    2    0    4    1.0757   -0.5181    1.0696   -0.4972    0.0219    1    0.2595    0.2483
   19    3    1   -1    0.0430    0.0288    0.0442    0.0295    0.0014    1    0.0961    0.0994
   20    3    1    1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1189    0.1178
   21   -1   -1    1   -0.0342   -0.0580   -0.0341   -0.0579    0.0001    1    0.0430    0.0568
   22    2    2    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0905    0.0899
   23    1    3   -1    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.0806    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -1   -3    3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0    4   -2   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1   -1    3   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    0   -2    2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1    3   -1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0   -2    4    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1   -3    3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    2    0   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1   -1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -1    3    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -3    1    1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    3   -1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3   -1    3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2    0    2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2    0    2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    2    0    4    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    3    1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    3    1    1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1   -1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    2    0    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1    3   -1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.17                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9865    1.4245    1.4234   90.0056   90.5253   89.8298      0.3817
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9980    1.4171    1.4142   90.0000   90.0000   90.0000      0.3549         0.7057    1.0020    2.8117    3.9925    3.9845
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0553    0.0531    0.0000    0.0000    0.0000      0.0225         0.0265    0.0135    0.1782    0.2971    0.2935
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1795    0.1789   -0.9816)
 a2 = (    0.3557    0.6034    0.0471)
 a3 = (    0.5919   -0.3351   -0.1759)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1838    0.1834   -0.9678) (    0.0062    0.0057    0.0019)
 a2 = (    0.3564    0.6072    0.0474) (    0.0147    0.0236    0.0032)
 a3 = (    0.5963   -0.3363   -0.1770) (    0.0230    0.0141    0.0042)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -86.0236  104.4937   60.5819    0.2621    0.4054    0.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            147            149
# Figure of merit at the beginning and the end of the refinement
         7.3583        12.0762
# Chi-squares at the beginning and the end of the refinement
    0.2092    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7519   -0.0597   -0.7310   -0.0567    0.0211    1    0.0729    0.0702
    2    0    4   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1062    0.0995
    3   -1   -3    3   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.1041    0.0967
    4   -1    3   -1   -0.1979   -0.5946   -0.1957   -0.5833    0.0115    1    0.1118    0.1078
    5    0    2   -2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0686    0.0654
    6   -1   -1    3   -0.1130    0.1263   -0.1085    0.1216    0.0066    1    0.0821    0.0778
    7   -1    3   -3    0.1208   -0.6018    0.1201   -0.5973    0.0045    1    0.1428    0.1302
    8    0    2   -4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1103    0.1017
    9   -1    1    3   -0.2039    0.0512   -0.1952    0.0486    0.0090    1    0.0834    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0492    0.0467
   11   -1    1   -3    0.5389   -0.6210    0.5303   -0.6130    0.0117    1    0.1349    0.1248
   12   -1    3    3   -0.1888   -0.0391   -0.1829   -0.0381    0.0060    1    0.1070    0.0984
   13    0   -2   -4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1072    0.0927
   14   -1   -1   -5    0.5351   -0.1524    0.5293   -0.1451    0.0093    1    0.1607    0.1473
   15   -1    3    1   -0.3440   -0.2426   -0.3362   -0.2357    0.0104    1    0.0943    0.0881
   16    0   -2   -2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0663    0.0679
   17   -1   -1   -3    0.7395   -0.0845    0.7293   -0.0807    0.0108    1    0.1250    0.1198
   18   -2    0   -4    1.0713   -0.5241    1.0696   -0.4972    0.0270    1    0.2781    0.2483
   19    0   -4   -2    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1034    0.0994
   20   -1   -3   -3    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1276    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0463    0.0568
   22   -1   -3   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0969    0.0899
   23   -1   -3    1    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0    4   -3    0.0222   -0.2071   -0.0130   -0.1762    0.0469    1          0.1126          0.0995
    3   -1   -3    3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -1    3   -1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0    2   -2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1   -1    3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7   -1    3   -3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0    2   -4    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9   -1    1    3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0   -2    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11   -1    1   -3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12   -1    3    3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0   -2   -4    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1   -1   -5    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1    3    1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0   -2   -2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1   -1   -3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18   -2    0   -4    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0   -4   -3    0.0891    0.0391    0.0442    0.0295    0.0459    1          0.1089          0.0994
   20   -1   -3   -3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1   -3   -1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -1   -3    1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.18                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9928    1.4266    1.4121   90.0051   90.1847   90.5268      0.3821
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9980    1.4171    1.4142   90.0000   90.0000   90.0000      0.3549         0.7057    1.0020    2.8117    3.9925    3.9845
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0553    0.0531    0.0000    0.0000    0.0000      0.0225         0.0265    0.0135    0.1782    0.2971    0.2935
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1888   -0.1765    0.9735)
 a2 = (    0.3552    0.6025    0.0470)
 a3 = (   -0.5962    0.3375    0.1792)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1838   -0.1834    0.9678) (    0.0062    0.0057    0.0019)
 a2 = (    0.3564    0.6072    0.0474) (    0.0147    0.0236    0.0032)
 a3 = (   -0.5963    0.3363    0.1770) (    0.0230    0.0141    0.0042)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   86.0236   75.5063 -119.4181    0.2621    0.4054    0.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            155            152
# Figure of merit at the beginning and the end of the refinement
         7.9512        11.9962
# Chi-squares at the beginning and the end of the refinement
    0.1544    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0718    0.0702
    2    0    4    2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1065    0.0995
    3    1   -3   -3   -0.0274    0.0900   -0.0262    0.0895    0.0014    1    0.1043    0.0967
    4    1    3    1   -0.1976   -0.5912   -0.1957   -0.5833    0.0081    1    0.1116    0.1078
    5    0    2    2    0.0579   -0.2258    0.0560   -0.2234    0.0031    1    0.0690    0.0654
    6    1   -1   -3   -0.1080    0.1193   -0.1085    0.1216    0.0024    1    0.0825    0.0778
    7    1    3    3    0.1214   -0.6005    0.1201   -0.5973    0.0034    1    0.1431    0.1302
    8    0    2    4    0.1455   -0.2220    0.1454   -0.2240    0.0020    1    0.1112    0.1017
    9    1    1   -3   -0.1947    0.0490   -0.1952    0.0486    0.0006    1    0.0838    0.0726
   10    0    0    2    0.2276   -0.1289    0.2251   -0.1274    0.0029    1    0.0497    0.0467
   11    1    1    3    0.5359   -0.6195    0.5303   -0.6130    0.0086    1    0.1351    0.1248
   12    1    3   -3   -0.1821   -0.0370   -0.1829   -0.0381    0.0013    1    0.1074    0.0984
   13    0   -2    4    0.2008   -0.0094    0.1990   -0.0092    0.0018    1    0.1081    0.0927
   14    1   -1    5    0.5345   -0.1543    0.5293   -0.1451    0.0106    1    0.1616    0.1473
   15    1    3   -1   -0.3396   -0.2374   -0.3362   -0.2357    0.0037    1    0.0941    0.0881
   16    0   -2    2    0.1289    0.0359    0.1275    0.0362    0.0015    1    0.0666    0.0679
   17    1   -1    3    0.7384   -0.0882    0.7293   -0.0807    0.0118    1    0.1253    0.1198
   18    2    0    4    1.0645   -0.5288    1.0696   -0.4972    0.0321    1    0.2774    0.2483
   19    0   -4    2    0.0452    0.0300    0.0442    0.0295    0.0012    1    0.1035    0.0994
   20    1   -3    3    0.4538    0.1654    0.4423    0.1634    0.0116    1    0.1277    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0462    0.0568
   22    1   -3    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0966    0.0899
   23    1   -3   -1    0.0335    0.2773    0.0347    0.2716    0.0058    1    0.0860    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0    4    3    0.0222   -0.2071   -0.0130   -0.1762    0.0469    1          0.1126          0.0995
    3    1   -3   -3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1    3    1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0    2    2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6    1   -1   -3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    1    3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0    2    4    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1    1   -3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0    2    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1    1    3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    1    3   -3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0   -2    4    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1   -1    5    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    1    3   -1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0   -2    2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17    1   -1    3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    2    0    4    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0   -4    3    0.0891    0.0391    0.0442    0.0295    0.0459    1          0.1089          0.0994
   20    1   -3    3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0    2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1   -3    1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    1   -3   -1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.19                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9945    1.4188    1.4177   89.9933   90.8185   90.7528      0.3957
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9980    1.4171    1.4142   90.0000   90.0000   90.0000      0.3549         0.7057    1.0020    2.8117    3.9925    3.9845
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0553    0.0531    0.0000    0.0000    0.0000      0.0225         0.0265    0.0135    0.1782    0.2971    0.2935
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2031    0.1799   -0.9685)
 a2 = (   -0.3571   -0.6059   -0.0473)
 a3 = (   -0.5943    0.3365    0.1767)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1838    0.1834   -0.9678) (    0.0062    0.0057    0.0019)
 a2 = (   -0.3564   -0.6072   -0.0474) (    0.0147    0.0236    0.0032)
 a3 = (   -0.5963    0.3363    0.1770) (    0.0230    0.0141    0.0042)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -93.9764   75.5063 -119.4181    0.2621    0.4054    0.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            137            152
# Figure of merit at the beginning and the end of the refinement
         7.0851        11.9962
# Chi-squares at the beginning and the end of the refinement
    0.5087    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0742    0.0702
    2    0   -4    2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1106    0.0995
    3   -1    3   -3   -0.0275    0.0903   -0.0262    0.0895    0.0015    1    0.1084    0.0967
    4   -1   -3    1   -0.2008   -0.5827   -0.1957   -0.5833    0.0051    1    0.1152    0.1078
    5    0   -2    2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0714    0.0654
    6   -1    1   -3   -0.1084    0.1195   -0.1085    0.1216    0.0021    1    0.0857    0.0778
    7   -1   -3    3    0.1148   -0.5976    0.1201   -0.5973    0.0053    1    0.1473    0.1302
    8    0   -2    4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1148    0.1017
    9   -1   -1   -3   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0872    0.0726
   10    0    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0512    0.0467
   11   -1   -1    3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1388    0.1248
   12   -1   -3   -3   -0.1821   -0.0374   -0.1829   -0.0381    0.0010    1    0.1118    0.0984
   13    0    2    4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1116    0.0927
   14   -1    1    5    0.5334   -0.1530    0.5293   -0.1451    0.0089    1    0.1658    0.1473
   15   -1   -3   -1   -0.3365   -0.2343   -0.3362   -0.2357    0.0014    1    0.0978    0.0881
   16    0    2    2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0690    0.0679
   17   -1    1    3    0.7393   -0.0854    0.7293   -0.0807    0.0110    1    0.1286    0.1198
   18   -2    0    4    1.0727   -0.5366    1.0696   -0.4972    0.0396    1    0.2872    0.2483
   19    0    4    2    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1076    0.0994
   20   -1    3    3    0.4493    0.1674    0.4423    0.1634    0.0080    1    0.1314    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0481    0.0568
   22   -1    3    1    0.2996    0.3402    0.3053    0.3413    0.0058    1    0.0997    0.0899
   23   -1    3   -1    0.0322    0.2747    0.0347    0.2716    0.0039    1    0.0893    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    0   -4    3    0.0222   -0.2071   -0.0130   -0.1762    0.0469    1          0.1126          0.0995
    3   -1    3   -3   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -1   -3    1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    0   -2    2    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1    1   -3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7   -1   -3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    0   -2    4    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9   -1   -1   -3   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0    2    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11   -1   -1    3    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12   -1   -3   -3   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    0    2    4    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    1    5    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1   -3   -1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0    2    2    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1    1    3    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18   -2    0    4    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    0    4    3    0.0891    0.0391    0.0442    0.0295    0.0459    1          0.1089          0.0994
   20   -1    3    3    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0   -2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -1    3    1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -1    3   -1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.23                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9969    1.4158    1.4171   90.4010   90.1198   90.0980      0.5416
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9953    1.4209    1.4143   90.0000   90.0000   90.0000      0.3583         0.7037    1.0047    2.7777    3.9654    3.9470
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0235    0.0241    0.0000    0.0000    0.0000      0.0235         0.0120    0.0190    0.1819    0.2679    0.2671
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9567   -0.2714    0.1318)
 a2 = (   -0.0272    0.3803    0.5946)
 a3 = (   -0.2122    0.5653   -0.3653)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9583   -0.2728    0.1296) (    0.0018    0.0056    0.0042)
 a2 = (   -0.0277    0.3789    0.5925) (    0.0032    0.0082    0.0095)
 a3 = (   -0.2107    0.5641   -0.3706) (    0.0060    0.0112    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    8.7121  121.6093 -159.5193    0.2861    0.3945    0.4026
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            161            147
# Figure of merit at the beginning and the end of the refinement
         2.3953        10.0834
# Chi-squares at the beginning and the end of the refinement
    1.1079    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7213   -0.0546   -0.7310   -0.0567    0.0100    1    0.1002    0.0702
    2   -1    3    3   -0.0136   -0.1779   -0.0130   -0.1762    0.0018    1    0.1524    0.0995
    3    0   -2   -4   -0.0247    0.0826   -0.0262    0.0895    0.0070    1    0.1488    0.0967
    4   -1    3    1   -0.1961   -0.5850   -0.1957   -0.5833    0.0017    1    0.1578    0.1078
    5    0    2    2    0.0577   -0.2279    0.0560   -0.2234    0.0049    1    0.0985    0.0654
    6   -1   -1   -3   -0.1018    0.1134   -0.1085    0.1216    0.0106    1    0.1170    0.0778
    7    0    2    1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1011    0.1302
    8    1    3    3    0.1463   -0.2240    0.1454   -0.2240    0.0009    1    0.1586    0.1017
    9   -2    0   -2   -0.1879    0.0472   -0.1952    0.0486    0.0074    1    0.1187    0.0726
   10    1    1    1    0.2291   -0.1291    0.2251   -0.1274    0.0044    1    0.0707    0.0467
   11    1    3    1    0.5353   -0.6141    0.5303   -0.6130    0.0050    1    0.1907    0.1248
   12   -3    1   -1   -0.1773   -0.0365   -0.1829   -0.0381    0.0058    1    0.1527    0.0984
   13    3    1    1    0.2005   -0.0085    0.1990   -0.0092    0.0017    1    0.1541    0.0927
   14    3    3    1    0.5311   -0.1497    0.5293   -0.1451    0.0049    1    0.2292    0.1473
   15   -1    1    0   -0.3339   -0.2341   -0.3362   -0.2357    0.0029    1    0.0665    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0951    0.0679
   17    1    1    0    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.0879    0.1198
   18    2    4    0    1.0587   -0.5122    1.0696   -0.4972    0.0185    1    0.3893    0.2483
   19    3   -1   -1    0.0436    0.0292    0.0442    0.0295    0.0007    1    0.1482    0.0994
   20    3    1   -1    0.4434    0.1650    0.4423    0.1634    0.0019    1    0.1811    0.1178
   21   -1    1    1   -0.0351   -0.0595   -0.0341   -0.0579    0.0018    1    0.0662    0.0568
   22    2    0   -2    0.2951    0.3316    0.3053    0.3413    0.0141    1    0.1368    0.0899
   23    1   -1   -3    0.0331    0.2656    0.0347    0.2716    0.0063    1    0.1223    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -1    3    3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0   -2   -4   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1    3    1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    0    2    2    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1   -1   -3   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0    4    2    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1    3    3    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1    1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    3    1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -3    1   -1   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    3    1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3    3    1    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2    2    0   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2    2    0    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    2    4    0    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    3   -1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    3    1   -1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1    1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    0   -2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1   -1   -3    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.24                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4159    1.4168    0.9971   90.1126   90.2351   90.0790      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4171    1.4142    0.9980   90.0000   90.0000   90.0000      0.3549         1.4200    1.4171    3.9925    3.9845    2.8117
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0191    0.0389    0.0000    0.0000    0.0000      0.0269         0.0554    0.0532    0.3025    0.3066    0.2396
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3583    0.6070    0.0455)
 a2 = (    0.5947   -0.3367   -0.1768)
 a3 = (   -0.1813    0.1844   -0.9691)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3564    0.6072    0.0474) (    0.0035    0.0021    0.0031)
 a2 = (    0.5963   -0.3363   -0.1770) (    0.0085    0.0054    0.0055)
 a3 = (   -0.1838    0.1834   -0.9678) (    0.0123    0.0114    0.0363)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  164.9833  164.9820 -134.9406    0.9422    0.4112    1.0534
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            155            149
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.7562
# Chi-squares at the beginning and the end of the refinement
    1.8660    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    4   -2    0   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3   -3    3   -1   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    3   -1   -1   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    2   -2    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6   -1    3   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    3   -3   -1    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    2   -4    0    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    1    3   -1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    1   -3   -1    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    3    3   -1   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13   -1   -3    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14   -1   -5   -1    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    3    1   -1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16   -2   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -1   -3   -1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    0   -2   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19   -4   -2    0    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20   -3   -3   -1    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    2    0    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22   -3   -1   -1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23   -3    1   -1    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    4   -2    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -3    3   -1   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    3   -1   -1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    2   -2    0    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1    3   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    3   -3   -1    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    2   -4    0    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1    3   -1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0   -2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1   -3   -1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    3    3   -1   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13   -2   -4    0    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1   -5   -1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    3    1   -1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16   -2   -2    0    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1   -3   -1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    0   -4   -2    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19   -4   -2    0    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20   -3   -3   -1    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    2    0    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -3   -1   -1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -3    1   -1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.25                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4227    1.4237    0.9875   90.6157   90.5850   90.0731      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4170    1.4142    0.9980   90.0000   90.0000   90.0000      0.3549         1.4198    1.4169    3.9925    3.9844    2.8120
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0191    0.0389    0.0000    0.0000    0.0000      0.0269         0.0554    0.0532    0.3026    0.3067    0.2397
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3566   -0.6041   -0.0453)
 a2 = (   -0.5918    0.3350    0.1759)
 a3 = (   -0.2012    0.1799   -0.9761)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3565   -0.6072   -0.0474) (    0.0035    0.0021    0.0031)
 a2 = (   -0.5964    0.3363    0.1770) (    0.0085    0.0054    0.0055)
 a3 = (   -0.1838    0.1834   -0.9677) (    0.0123    0.0114    0.0364)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -15.0144  164.9833 -134.9381    0.9422    0.4113    1.0535
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0010      0.0023    0.0022    0.0379

# Number of computed bands
            133            149
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.7552
# Chi-squares at the beginning and the end of the refinement
    3.0447    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2   -3    1    0   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3    3   -3   -1   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4   -3    1   -1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5   -1    1    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6    1   -3   -1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7   -3    3   -1    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8   -1    3    0    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -1   -3   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -1    3   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -3   -3   -1   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    1    3    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    1    5   -1    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15   -3   -1   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    1    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    1    3   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    0    2   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    3    1    0    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20    3    3   -1    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21   -2    0    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22    3    1   -1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23    3   -1   -1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0665          0.0702
    2   -4    2    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3    3   -3   -1   -0.0266    0.0896   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4   -3    1   -1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1033          0.1078
    5   -2    2    0    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6    1   -3   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7   -3    3   -1    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8   -2    4    0    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1032          0.1017
    9   -1   -3   -1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0460          0.0467
   11   -1    3   -1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1244          0.1248
   12   -3   -3   -1   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    2    4    0    0.1977   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    1    5   -1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -3   -1   -1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0874          0.0881
   16    2    2    0    0.1260    0.0357    0.1275    0.0362    0.0015    1          0.0620          0.0679
   17    1    3   -1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1153          0.1198
   18    0    4   -2    1.0599   -0.5138    1.0696   -0.4972    0.0193    1          0.2541          0.2483
   19    4    2    0    0.0436    0.0289    0.0442    0.0295    0.0008    1          0.0967          0.0994
   20    3    3   -1    0.4453    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21   -2    0    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    3    1   -1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23    3   -1   -1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.28                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4255    1.4268    0.9834   90.7397   89.6870   90.0390      0.3878
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4171    1.4142    0.9980   90.0000   90.0000   90.0000      0.3549         1.4200    1.4171    3.9924    3.9844    2.8116
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0191    0.0389    0.0000    0.0000    0.0000      0.0269         0.0554    0.0532    0.3025    0.3066    0.2396
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3554    0.6030    0.0471)
 a2 = (   -0.5903    0.3347    0.1755)
 a3 = (    0.1724   -0.1850    0.9850)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3564    0.6072    0.0474) (    0.0035    0.0021    0.0031)
 a2 = (   -0.5963    0.3363    0.1770) (    0.0085    0.0054    0.0055)
 a3 = (    0.1838   -0.1834    0.9678) (    0.0123    0.0114    0.0363)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   15.0168   15.0179   45.0593    0.9422    0.4112    1.0534
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            400            151
# Figure of merit at the beginning and the end of the refinement
         4.3518         9.7131
# Chi-squares at the beginning and the end of the refinement
    0.1619    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7618   -0.0567   -0.7310   -0.0567    0.0308    0    0.0745    0.0702
    2    4    2    0   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1078    0.0995
    3   -3   -3    1   -0.0285    0.0975   -0.0262    0.0895    0.0084    1    0.1058    0.0967
    4    3    1    1   -0.1983   -0.5990   -0.1957   -0.5833    0.0159    1    0.1138    0.1078
    5    2    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0696    0.0654
    6   -1   -3    1   -0.1139    0.1286   -0.1085    0.1216    0.0089    1    0.0834    0.0778
    7    3    3    1    0.1223   -0.6041    0.1201   -0.5973    0.0072    1    0.1451    0.1302
    8    2    4    0    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1118    0.1017
    9    1   -3    1   -0.2065    0.0527   -0.1952    0.0486    0.0120    1    0.0845    0.0726
   10    0    2    0    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0498    0.0467
   11    1    3    1    0.5431   -0.6214    0.5303   -0.6130    0.0152    1    0.1374    0.1248
   12    3   -3    1   -0.1911   -0.0394   -0.1829   -0.0381    0.0084    1    0.1084    0.0984
   13   -2    4    0    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1086    0.0927
   14   -1    5    1    0.5364   -0.1516    0.5293   -0.1451    0.0096    1    0.1633    0.1473
   15    3   -1    1   -0.3473   -0.2448   -0.3362   -0.2357    0.0143    1    0.0957    0.0881
   16   -2    2    0    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0672    0.0679
   17   -1    3    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1272    0.1198
   18    0    4    2    1.0767   -0.5174    1.0696   -0.4972    0.0215    1    0.2835    0.2483
   19   -4    2    0    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1049    0.0994
   20   -3    3    1    0.4520    0.1679    0.4423    0.1634    0.0106    1    0.1298    0.1178
   21    2    0    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0469    0.0568
   22   -3    1    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0988    0.0899
   23   -3   -1    1    0.0368    0.2822    0.0347    0.2716    0.0108    1    0.0880    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    4    2    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -3   -3    1   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    3    1    1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    2    2    0    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -1   -3    1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    3    3    1    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    2    4    0    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9    1   -3    1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1    3    1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12    3   -3    1   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13   -2    4    0    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14   -1    5    1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15    3   -1    1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16   -2    2    0    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17   -1    3    1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    0    4    2    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19   -4    2    0    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20   -3    3    1    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    2    0    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22   -3    1    1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -3   -1    1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.31                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3994    1.4199    1.0073   91.2391   91.7080   89.1509      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4142    1.4171    0.9980   90.0000   90.0000   90.0000      0.3549         1.4171    1.4200    3.9844    3.9925    2.8117
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0191    0.0375    0.0000    0.0000    0.0000      0.0266         0.0532    0.0554    0.2987    0.3041    0.2357
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6023    0.3410    0.1790)
 a2 = (   -0.3481   -0.6106   -0.0481)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5963    0.3363    0.1770) (    0.0020    0.0036    0.0048)
 a2 = (   -0.3564   -0.6072   -0.0474) (    0.0064    0.0082    0.0032)
 a3 = (    0.1838   -0.1834    0.9678) (    0.0120    0.0113    0.0349)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  105.0167   15.0180   45.0594    0.9422    0.4112    1.0534
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0001    0.0011      0.0023    0.0022    0.0379

# Number of computed bands
            400            153
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.6705
# Chi-squares at the beginning and the end of the refinement
    0.1140    0.0332
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    2   -4    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    3    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    1   -3    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2   -2    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -3    1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3   -3    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    4   -2    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -3   -1    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    2    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    3   -1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12   -3   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    4    2    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    5    1    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15   -1   -3    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    2    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    3    1    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    4    0    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19    2    4    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    3    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    0   -2    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    1    3    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -1    3    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7320   -0.0565   -0.7310   -0.0567    0.0010    1          0.0666          0.0702
    2    2   -4    0   -0.0128   -0.1741   -0.0130   -0.1762    0.0021    1          0.0994          0.0995
    3   -3    3    1   -0.0265    0.0895   -0.0262    0.0895    0.0004    1          0.0974          0.0967
    4    1   -3    1   -0.1947   -0.5863   -0.1957   -0.5833    0.0031    1          0.1034          0.1078
    5    2   -2    0    0.0570   -0.2232    0.0560   -0.2234    0.0011    1          0.0642          0.0654
    6   -3    1    1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    3   -3    1    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1323          0.1302
    8    4   -2    0    0.1438   -0.2196    0.1454   -0.2240    0.0047    1          0.1033          0.1017
    9   -3   -1    1   -0.1950    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    2    0    0    0.2252   -0.1269    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    3   -1    1    0.5343   -0.6127    0.5303   -0.6130    0.0040    1          0.1245          0.1248
   12   -3   -3    1   -0.1820   -0.0378   -0.1829   -0.0381    0.0009    1          0.0999          0.0984
   13    4    2    0    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1004          0.0927
   14    5    1    1    0.5298   -0.1496    0.5293   -0.1451    0.0045    1          0.1492          0.1473
   15   -1   -3    1   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    2    2    0    0.1260    0.0356    0.1275    0.0362    0.0016    1          0.0620          0.0679
   17    3    1    1    0.7303   -0.0813    0.7293   -0.0807    0.0011    1          0.1154          0.1198
   18    4    0    2    1.0599   -0.5138    1.0696   -0.4972    0.0192    1          0.2542          0.2483
   19    2    4    0    0.0436    0.0289    0.0442    0.0295    0.0009    1          0.0967          0.0994
   20    3    3    1    0.4452    0.1656    0.4423    0.1634    0.0037    1          0.1184          0.1178
   21    0   -2    0   -0.0337   -0.0581   -0.0341   -0.0579    0.0005    1          0.0433          0.0568
   22    1    3    1    0.2983    0.3355    0.3053    0.3413    0.0091    1          0.0898          0.0899
   23   -1    3    1    0.0340    0.2725    0.0347    0.2716    0.0011    1          0.0804          0.0816

###            No.32                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4080    1.4159    1.0042   89.1108   92.0623   91.0272      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4169    1.4159    0.9970   90.0000   90.0000   90.0000      0.3579         1.4212    1.4202    3.9586    3.9559    2.7855
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0289    0.0182    0.0000    0.0000    0.0000      0.0235         0.0260    0.0246    0.2605    0.2725    0.1902
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0533    0.3836    0.5960)
 a2 = (   -0.2009    0.5680   -0.3689)
 a3 = (   -0.9505   -0.2696    0.1309)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0276    0.3807    0.5937) (    0.0032    0.0042    0.0027)
 a2 = (   -0.2103    0.5631   -0.3709) (    0.0063    0.0137    0.0051)
 a3 = (   -0.9568   -0.2718    0.1299) (    0.0177    0.0074    0.0046)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  121.9755   82.5616  -74.1434    0.4235    0.2517    0.3417
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0053      0.0021    0.0024    0.0149

# Number of computed bands
            400            161
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.5350
# Chi-squares at the beginning and the end of the refinement
    1.7651    0.0238
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3    3   -1   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -2   -4    0   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    3    1   -1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    2    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -1   -3   -1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    4    2    0    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    3    1    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    0   -2   -2   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    3    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    1   -1   -3   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    1    3    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    3    1    3    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    2    0   -2   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    2    0    2    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    4    0    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1   -1    3    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    1   -1    3    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1    1   -1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    0   -2    2    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -1   -3    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7316   -0.0577   -0.7310   -0.0567    0.0012    1          0.0664          0.0702
    2    3    3   -1   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0996          0.0995
    3   -2   -4    0   -0.0266    0.0905   -0.0262    0.0895    0.0011    1          0.0975          0.0967
    4    3    1   -1   -0.1961   -0.5854   -0.1957   -0.5833    0.0021    1          0.1031          0.1078
    5    2    2    0    0.0566   -0.2235    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6   -1   -3   -1   -0.1078    0.1201   -0.1085    0.1216    0.0016    1          0.0769          0.0778
    7    4    2    0    0.1197   -0.5961    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    3    3    1    0.1438   -0.2202    0.1454   -0.2240    0.0041    1          0.1033          0.1017
    9    0   -2   -2   -0.1951    0.0485   -0.1952    0.0486    0.0002    1          0.0781          0.0726
   10    1    1    1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11    3    1    1    0.5353   -0.6139    0.5303   -0.6130    0.0051    1          0.1241          0.1248
   12    1   -1   -3   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1004          0.0984
   13    1    1    3    0.1981   -0.0085    0.1990   -0.0092    0.0011    1          0.1008          0.0927
   14    3    1    3    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1493          0.1473
   15    2    0   -2   -0.3358   -0.2363   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1266    0.0356    0.1275    0.0362    0.0011    1          0.0624          0.0679
   17    2    0    2    0.7304   -0.0811    0.7293   -0.0807    0.0011    1          0.1152          0.1198
   18    4    0    2    1.0607   -0.5134    1.0696   -0.4972    0.0185    1          0.2526          0.2483
   19   -1   -1    3    0.0444    0.0291    0.0442    0.0295    0.0005    1          0.0973          0.0994
   20    1   -1    3    0.4455    0.1650    0.4423    0.1634    0.0035    1          0.1188          0.1178
   21    1    1   -1   -0.0333   -0.0572   -0.0341   -0.0579    0.0011    1          0.0435          0.0568
   22    0   -2    2    0.3000    0.3348    0.3053    0.3413    0.0084    1          0.0901          0.0899
   23   -1   -3    1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0806          0.0816

###            No.33                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9999    1.4401    1.3890   90.1856   90.4566   89.7221      0.4271
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0039    1.4166    1.4064   90.0000   90.0000   90.0000      0.3549         0.7138    1.0072    2.8289    3.9919    3.9634
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0266    0.0216    0.0000    0.0000    0.0000      0.0229         0.0110    0.0218    0.1823    0.2680    0.2626
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2391    0.9443    0.2265)
 a2 = (   -0.5519   -0.0428   -0.4192)
 a3 = (   -0.4036   -0.2282    0.5508)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2374    0.9413    0.2235) (    0.0055    0.0016    0.0043)
 a2 = (   -0.5667   -0.0436   -0.4187) (    0.0129    0.0048    0.0060)
 a3 = (   -0.3886   -0.2286    0.5498) (    0.0091    0.0046    0.0078)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  159.2779   39.3510  -59.5357    0.4322    0.4308    0.5152
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            123            115
# Figure of merit at the beginning and the end of the refinement
         4.9485         9.5121
# Chi-squares at the beginning and the end of the refinement
    0.2607    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0802    0.0702
    2    3   -1   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1197    0.0995
    3   -3   -1    1   -0.0255    0.0890   -0.0262    0.0895    0.0008    1    0.1169    0.0967
    4    2   -2    0   -0.1884   -0.5944   -0.1957   -0.5833    0.0133    1    0.1246    0.1078
    5    2    0    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0774    0.0654
    6   -2   -2    0   -0.1060    0.1208   -0.1085    0.1216    0.0026    1    0.0915    0.0778
    7    3   -1    1    0.1280   -0.5955    0.1201   -0.5973    0.0081    1    0.1599    0.1302
    8    3    1    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1245    0.1017
    9   -1   -3   -1   -0.1961    0.0502   -0.1952    0.0486    0.0018    1    0.0925    0.0726
   10    1    1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0556    0.0467
   11    2    0    2    0.5396   -0.6012    0.5303   -0.6130    0.0150    1    0.1503    0.1248
   12    0   -4   -2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1191    0.0984
   13    1    3    3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1211    0.0927
   14    2    2    4    0.5278   -0.1470    0.5293   -0.1451    0.0024    1    0.1811    0.1473
   15    1   -3   -1   -0.3394   -0.2425   -0.3362   -0.2357    0.0075    1    0.1045    0.0881
   16    0    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0748    0.0679
   17    1    1    3    0.7208   -0.0781    0.7293   -0.0807    0.0090    1    0.1395    0.1198
   18    2    0    4    1.0427   -0.4862    1.0696   -0.4972    0.0290    1    0.3023    0.2483
   19   -1    3    3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1166    0.0994
   20    0    2    4    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1439    0.1178
   21    1   -1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0521    0.0568
   22   -1    1    3    0.2998    0.3290    0.3053    0.3413    0.0135    1    0.1090    0.0899
   23   -2    0    2    0.0380    0.2713    0.0347    0.2716    0.0034    1    0.0969    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3   -1   -1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3   -1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2   -2    0   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2   -2    0   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3   -1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3    1    1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1   -3   -1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1    1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    0    2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0   -4   -2   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1    3    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2    2    4    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -3   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1    1    3    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2    0    4    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19   -1    3    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0    2    4    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    1    3    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2    0    2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.34                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0024    1.4226    1.4026   90.2032   90.4586   90.2714      0.4665
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0039    1.4170    1.4059   90.0000   90.0000   90.0000      0.3630         0.7140    1.0079    2.7652    3.9032    3.8726
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0266    0.0216    0.0000    0.0000    0.0000      0.0236         0.0110    0.0218    0.1797    0.2641    0.2586
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2386   -0.9420   -0.2259)
 a2 = (   -0.5617   -0.0450   -0.4203)
 a3 = (    0.3915    0.2254   -0.5516)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2374   -0.9413   -0.2235) (    0.0055    0.0016    0.0043)
 a2 = (   -0.5665   -0.0435   -0.4186) (    0.0128    0.0048    0.0060)
 a3 = (    0.3889    0.2287   -0.5499) (    0.0091    0.0046    0.0078)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -159.2814  140.6375  120.4569    0.4322    0.4308    0.5151
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005    0.0012      0.0023    0.0021    0.0116

# Number of computed bands
            115            115
# Figure of merit at the beginning and the end of the refinement
         4.0517         9.5062
# Chi-squares at the beginning and the end of the refinement
    0.4648    0.1092
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7435   -0.0595   -0.7310   -0.0567    0.0128    1    0.0877    0.0702
    2   -3   -1    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    3   -1   -1   -0.0265    0.0900   -0.0262    0.0895    0.0007    1    0.1275    0.0967
    4   -2   -2    0   -0.1936   -0.5914   -0.1957   -0.5833    0.0083    1    0.1363    0.1078
    5   -2    0    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2   -2    0   -0.1076    0.1207   -0.1085    0.1216    0.0012    1    0.1003    0.0778
    7   -3   -1   -1    0.1233   -0.5981    0.1201   -0.5973    0.0033    1    0.1747    0.1302
    8   -3    1   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1   -3    1   -0.1964    0.0493   -0.1952    0.0486    0.0014    1    0.1017    0.0726
   10   -1    1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -2    0   -2    0.5380   -0.6119    0.5303   -0.6130    0.0077    1    0.1646    0.1248
   12    0   -4    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1308    0.0984
   13   -1    3   -3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -1    1   -2    0.5318   -0.1499    0.5293   -0.1451    0.0054    1    0.0984    0.1473
   15   -1   -3    1   -0.3388   -0.2400   -0.3362   -0.2357    0.0050    1    0.1148    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1    1   -3    0.7304   -0.0817    0.7293   -0.0807    0.0014    1    0.1526    0.1198
   18   -2    0   -4    1.0567   -0.5082    1.0696   -0.4972    0.0169    1    0.3355    0.2483
   19    1    3   -3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    0    2   -4    0.4471    0.1648    0.4423    0.1634    0.0049    1    0.1566    0.1178
   21   -1   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1    1   -3    0.3016    0.3349    0.3053    0.3413    0.0075    1    0.1185    0.0899
   23    2    0   -2    0.0359    0.2743    0.0347    0.2716    0.0029    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7337   -0.0568   -0.7310   -0.0567    0.0026    1          0.0680          0.0702
    2   -3   -1    1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.1015          0.0995
    3    3   -1   -1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0994          0.0967
    4   -2   -2    0   -0.1956   -0.5864   -0.1957   -0.5833    0.0031    1          0.1055          0.1078
    5   -2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0004    1          0.0655          0.0654
    6    2   -2    0   -0.1077    0.1199   -0.1085    0.1216    0.0018    1          0.0783          0.0778
    7   -3   -1   -1    0.1209   -0.5965    0.1201   -0.5973    0.0011    1          0.1352          0.1302
    8   -3    1   -1    0.1439   -0.2205    0.1454   -0.2240    0.0039    1          0.1054          0.1017
    9    1   -3    1   -0.1948    0.0483   -0.1952    0.0486    0.0005    1          0.0795          0.0726
   10   -1    1   -1    0.2261   -0.1273    0.2251   -0.1274    0.0010    1          0.0471          0.0467
   11   -2    0   -2    0.5377   -0.6121    0.5303   -0.6130    0.0074    1          0.1274          0.1248
   12    0   -4    2   -0.1807   -0.0380   -0.1829   -0.0381    0.0022    1          0.1022          0.0984
   13   -1    3   -3    0.1985   -0.0085    0.1990   -0.0092    0.0008    1          0.1029          0.0927
   14   -2    2   -4    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1530          0.1473
   15   -1   -3    1   -0.3357   -0.2365   -0.3362   -0.2357    0.0009    1          0.0893          0.0881
   16    0    2   -2    0.1271    0.0356    0.1275    0.0362    0.0007    1          0.0637          0.0679
   17   -1    1   -3    0.7290   -0.0789    0.7293   -0.0807    0.0019    1          0.1183          0.1198
   18   -2    0   -4    1.0610   -0.5063    1.0696   -0.4972    0.0125    1          0.2600          0.2483
   19    1    3   -3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0993          0.0994
   20    0    2   -4    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1217          0.1178
   21   -1   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0443          0.0568
   22    1    1   -3    0.2995    0.3339    0.3053    0.3413    0.0095    1          0.0923          0.0899
   23    2    0   -2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0823          0.0816

###            No.36                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4139    1.4152    0.9996   90.0446   89.9786   90.0121      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4209    1.4143    0.9953   90.0000   90.0000   90.0000      0.3583         1.4276    1.4210    3.9654    3.9470    2.7776
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0267    0.0165    0.0000    0.0000    0.0000      0.0228         0.0236    0.0242    0.2519    0.2616    0.1824
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0270   -0.3812   -0.5951)
 a2 = (   -0.2097    0.5638   -0.3708)
 a3 = (    0.9543    0.2707   -0.1297)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0277   -0.3789   -0.5925) (    0.0032    0.0039    0.0026)
 a2 = (   -0.2107    0.5641   -0.3706) (    0.0059    0.0127    0.0048)
 a3 = (    0.9583    0.2728   -0.1296) (    0.0162    0.0067    0.0046)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -121.9067   97.4117  105.8889    0.3975    0.2442    0.3365
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            151            159
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.4772
# Chi-squares at the beginning and the end of the refinement
    0.2959    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2   -3    3    1   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    2   -4    0   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4   -3    1    1   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5   -2    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    1   -3    1   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7   -4    2    0    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8   -3    3   -1    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    0   -2    2   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10   -1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -3    1   -1    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12   -1   -1    3   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13   -1    1   -3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -3    1   -3    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15   -2    0    2   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16    0    0   -2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -2    0   -2    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18   -4    0   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19    1   -1   -3    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -1   -1   -3    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21   -1    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    0   -2   -2    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23    1   -3   -1    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -3    3    1   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    2   -4    0   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -3    1    1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5   -2    2    0    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1   -3    1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7   -4    2    0    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8   -3    3   -1    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    0   -2    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10   -1    1   -1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -3    1   -1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -1   -1    3   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13   -1    1   -3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14   -3    1   -3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2    0    2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    0    0   -2    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17   -2    0   -2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18   -4    0   -2    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    1   -1   -3    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20   -1   -1   -3    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1    1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    0   -2   -2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    1   -3   -1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.39                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4101    1.4107    1.0057   90.6216   90.5681   91.1176      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4143    1.4209    0.9953   90.0000   90.0000   90.0000      0.3583         1.4210    1.4276    3.9469    3.9653    2.7776
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0268    0.0170    0.0000    0.0000    0.0000      0.0233         0.0242    0.0236    0.2565    0.2683    0.1866
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2182    0.5595   -0.3775)
 a2 = (    0.0170   -0.3796   -0.5986)
 a3 = (   -0.9484   -0.2690    0.1306)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2107    0.5641   -0.3706) (    0.0040    0.0029    0.0041)
 a2 = (    0.0277   -0.3789   -0.5925) (    0.0034    0.0104    0.0095)
 a3 = (   -0.9583   -0.2728    0.1296) (    0.0168    0.0066    0.0046)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -148.0933   82.5883  -74.1111    0.3975    0.2442    0.3365
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            133            159
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.4771
# Chi-squares at the beginning and the end of the refinement
    3.3285    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    2   -2   -1   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -4    2    0   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    1   -3   -1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    1   -1    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -3    1   -1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    2   -4    0    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    2   -2    1    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -2    0   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    1   -3    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -1   -1   -3   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    1   -1    2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    1   -3    3    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    0   -2   -2   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0    0    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    0   -2    2    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    0   -2    1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19   -1    1    2    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -1   -1    3    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    1   -1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -2    0    2    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -3    1    1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2    3   -3   -1   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -4    2    0   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4    1   -3   -1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    2   -2    0    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -3    1   -1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    2   -4    0    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    3   -3    1    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1   -1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -3    1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12   -1   -1   -3   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    1   -1    3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    1   -3    3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15    0   -2   -2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    0    0    2    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    0   -2    2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    0   -4    2    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19   -1    1    3    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20   -1   -1    3    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21    1   -1   -1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22   -2    0    2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23   -3    1    1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.40                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4126    1.4147    1.0008   90.1472   90.1998   90.2933      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4143    1.4209    0.9953   90.0000   90.0000   90.0000      0.3583         1.4210    1.4276    3.9469    3.9653    2.7776
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0268    0.0170    0.0000    0.0000    0.0000      0.0233         0.0242    0.0236    0.2565    0.2683    0.1866
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2088   -0.5640    0.3734)
 a2 = (   -0.0275    0.3796    0.5956)
 a3 = (   -0.9530   -0.2703    0.1313)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2107   -0.5641    0.3706) (    0.0040    0.0029    0.0041)
 a2 = (   -0.0277    0.3789    0.5925) (    0.0034    0.0104    0.0095)
 a3 = (   -0.9583   -0.2728    0.1296) (    0.0168    0.0066    0.0046)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   31.9067   82.5883  -74.1111    0.3975    0.2442    0.3365
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            155            159
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.4771
# Chi-squares at the beginning and the end of the refinement
    1.8064    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2   -3    3   -1   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3    4   -2    0   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4   -1    3   -1   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5   -2    2    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6    3   -1   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7   -2    4    0    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8   -3    3    1    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    2    0   -2   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -1    3    1    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    1    1   -3   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13   -1    1    2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14   -1    3    3    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    0    2   -2   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    0    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    0    2    2    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    0    2    1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19    1   -1    3    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20    1    1    3    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21   -1    1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22    2    0    2    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23    3   -1    1    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2   -3    3   -1   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    4   -2    0   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1    3   -1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5   -2    2    0    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    3   -1   -1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7   -2    4    0    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8   -3    3    1    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    2    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10   -1    1    1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    3    1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12    1    1   -3   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13   -1    1    3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14   -1    3    3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15    0    2   -2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    0    0    2    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    0    2    2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    0    4    2    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19    1   -1    3    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    1    1    3    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1    1   -1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    0    2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23    3   -1    1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.41                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4118    1.4155    1.0009   90.3874   90.4524   90.2264      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4209    1.4143    0.9953   90.0000   90.0000   90.0000      0.3583         1.4276    1.4210    3.9654    3.9470    2.7776
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0267    0.0165    0.0000    0.0000    0.0000      0.0228         0.0236    0.0242    0.2519    0.2616    0.1824
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0217    0.3827    0.5957)
 a2 = (    0.2147   -0.5612    0.3716)
 a3 = (    0.9532    0.2704   -0.1295)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0277    0.3789    0.5925) (    0.0032    0.0039    0.0026)
 a2 = (    0.2107   -0.5641    0.3706) (    0.0059    0.0127    0.0048)
 a3 = (    0.9583    0.2728   -0.1296) (    0.0162    0.0067    0.0046)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   58.0933   97.4117  105.8889    0.3975    0.2442    0.3365
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0072      0.0021    0.0023    0.0143

# Number of computed bands
            139            160
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.4574
# Chi-squares at the beginning and the end of the refinement
    0.4359    0.0281
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    3   -3    1   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -2    4    0   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    3   -1    1   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    2   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1    3    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    4   -2    0    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    3   -3   -1    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    0    2    2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    3   -1   -1    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    1    1    3   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    1   -1   -3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    3   -1   -3    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    2    0    2   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0    0   -2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    2    0   -2    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    4    0   -2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19   -1    1   -3    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    1    1   -3    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    1   -1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    0    2   -2    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23   -1    3   -1    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7309   -0.0566   -0.7310   -0.0567    0.0002    1          0.0662          0.0702
    2    3   -3    1   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -2    4    0   -0.0268    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4    3   -1    1   -0.1967   -0.5860   -0.1957   -0.5833    0.0028    1          0.1028          0.1078
    5    2   -2    0    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1    3    1   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    4   -2    0    0.1204   -0.5968    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    3   -3   -1    0.1440   -0.2199    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    0    2    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1   -1   -1    0.2256   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    3   -1   -1    0.5376   -0.6132    0.5303   -0.6130    0.0072    1          0.1237          0.1248
   12    1    1    3   -0.1810   -0.0381   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    1   -1   -3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3   -1   -3    0.5301   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15    2    0    2   -0.3358   -0.2359   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    0    0   -2    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2    0   -2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    4    0   -2    1.0632   -0.5090    1.0696   -0.4972    0.0134    1          0.2516          0.2483
   19   -1    1   -3    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    1    1   -3    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21    1   -1    1   -0.0331   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    0    2   -2    0.2995    0.3343    0.3053    0.3413    0.0091    1          0.0901          0.0899
   23   -1    3   -1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0806          0.0816

###            No.42                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3964    1.4477    0.9894   90.3545   90.8274   90.1783      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4113    1.4134    1.0027   90.0000   90.0000   90.0000      0.3563         1.4076    1.4096    3.9614    3.9673    2.8144
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0367    0.0182    0.0000    0.0000    0.0000      0.0235         0.0255    0.0279    0.2616    0.2816    0.1927
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4014    0.2270   -0.5479)
 a2 = (    0.5490    0.0426    0.4170)
 a3 = (    0.2542   -0.9516   -0.2272)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3863    0.2273   -0.5488) (    0.0057    0.0032    0.0041)
 a2 = (    0.5687    0.0441    0.4186) (    0.0180    0.0054    0.0068)
 a3 = (    0.2375   -0.9426   -0.2233) (    0.0074    0.0171    0.0055)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -52.6282  102.9360   14.1406    0.5440    0.2623    0.3318
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0004   -0.0008      0.0023    0.0022    0.0127

# Number of computed bands
            400            167
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.4500
# Chi-squares at the beginning and the end of the refinement
    0.2020    0.0239
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    1    1   -3   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -1    1    3   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    0    2   -2   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    0    0   -2    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6    0    2    2   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7   -1    1   -3    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8   -1   -1   -3    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    1    3    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10   -1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11   -2    0   -2    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    2    4    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13   -3   -3   -1    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14   -4   -2   -2    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1    3   -1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16   -2   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -3   -1   -1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18   -4    0   -2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -3   -3    1    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20   -4   -2    0    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1    1   -1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -3   -1    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    0    2    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7318   -0.0572   -0.7310   -0.0567    0.0009    1          0.0666          0.0702
    2    1    1   -3   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0995          0.0995
    3   -1    1    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0974          0.0967
    4    0    2   -2   -0.1961   -0.5854   -0.1957   -0.5833    0.0021    1          0.1033          0.1078
    5    0    0   -2    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0642          0.0654
    6    0    2    2   -0.1078    0.1201   -0.1085    0.1216    0.0016    1          0.0768          0.0778
    7   -1    1   -3    0.1197   -0.5960    0.1201   -0.5973    0.0014    1          0.1323          0.1302
    8   -1   -1   -3    0.1437   -0.2201    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9    1    3    1   -0.1951    0.0485   -0.1952    0.0486    0.0001    1          0.0780          0.0726
   10   -1   -1   -1    0.2257   -0.1272    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -2    0   -2    0.5355   -0.6140    0.5303   -0.6130    0.0052    1          0.1245          0.1248
   12    2    4    0   -0.1812   -0.0380   -0.1829   -0.0381    0.0016    1          0.1002          0.0984
   13   -3   -3   -1    0.1981   -0.0085    0.1990   -0.0092    0.0011    1          0.1007          0.0927
   14   -4   -2   -2    0.5305   -0.1494    0.5293   -0.1451    0.0044    1          0.1495          0.1473
   15    1    3   -1   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16   -2   -2    0    0.1267    0.0355    0.1275    0.0362    0.0010    1          0.0623          0.0679
   17   -3   -1   -1    0.7306   -0.0808    0.7293   -0.0807    0.0012    1          0.1155          0.1198
   18   -4    0   -2    1.0615   -0.5131    1.0696   -0.4972    0.0178    1          0.2542          0.2483
   19   -3   -3    1    0.0444    0.0291    0.0442    0.0295    0.0005    1          0.0972          0.0994
   20   -4   -2    0    0.4455    0.1652    0.4423    0.1634    0.0036    1          0.1189          0.1178
   21    1    1   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0434          0.0568
   22   -3   -1    1    0.2997    0.3349    0.3053    0.3413    0.0085    1          0.0902          0.0899
   23   -2    0    2    0.0352    0.2737    0.0347    0.2716    0.0021    1          0.0806          0.0816

###            No.44                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4114    1.4149    1.0016   90.1424   90.0751   90.3395      0.3967
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4064    1.4166    1.0039   90.0000   90.0000   90.0000      0.3549         1.4010    1.4111    3.9634    3.9919    2.8289
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0307    0.0154    0.0000    0.0000    0.0000      0.0226         0.0215    0.0265    0.2526    0.2687    0.1855
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3855   -0.2261    0.5498)
 a2 = (    0.5664    0.0439    0.4205)
 a3 = (   -0.2364    0.9438    0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3886   -0.2286    0.5498) (    0.0049    0.0031    0.0034)
 a2 = (    0.5667    0.0436    0.4187) (    0.0148    0.0051    0.0060)
 a3 = (   -0.2374    0.9413    0.2235) (    0.0072    0.0143    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   52.5143   77.0350 -165.8419    0.4530    0.2565    0.3300
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            147            165
# Figure of merit at the beginning and the end of the refinement
         6.6485         9.3730
# Chi-squares at the beginning and the end of the refinement
    0.1018    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7380   -0.0572   -0.7310   -0.0567    0.0070    1    0.0746    0.0702
    2   -1    1    3   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1110    0.0995
    3    1    1   -3   -0.0269    0.0910   -0.0262    0.0895    0.0017    1    0.1087    0.0967
    4    0    2    2   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1    0.1156    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0717    0.0654
    6    0    2   -2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0856    0.0778
    7    1    1    3    0.1189   -0.5963    0.1201   -0.5973    0.0016    1    0.1479    0.1302
    8    1   -1    3    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1151    0.1017
    9   -1    3   -1   -0.1975    0.0499   -0.1952    0.0486    0.0026    1    0.0868    0.0726
   10    1   -1    1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0513    0.0467
   11    2    0    2    0.5336   -0.6159    0.5303   -0.6130    0.0044    1    0.1392    0.1248
   12   -2    4    0   -0.1839   -0.0380   -0.1829   -0.0381    0.0011    1    0.1115    0.0984
   13    3   -3    1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1119    0.0927
   14    4   -2    2    0.5309   -0.1511    0.5293   -0.1451    0.0062    1    0.1667    0.1473
   15   -1    3    1   -0.3385   -0.2384   -0.3362   -0.2357    0.0035    1    0.0978    0.0881
   16    2   -2    0    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0692    0.0679
   17    3   -1    1    0.7323   -0.0828    0.7293   -0.0807    0.0036    1    0.1290    0.1198
   18    4    0    2    1.0613   -0.5180    1.0696   -0.4972    0.0224    1    0.2849    0.2483
   19    3   -3   -1    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1080    0.0994
   20    4   -2    0    0.4464    0.1656    0.4423    0.1634    0.0046    1    0.1323    0.1178
   21   -1    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0483    0.0568
   22    3   -1   -1    0.2997    0.3359    0.3053    0.3413    0.0079    1    0.1004    0.0899
   23    2    0   -2    0.0349    0.2740    0.0347    0.2716    0.0024    1    0.0898    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1    1    3   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1    1   -3   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    0    2    2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    0    2    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    0    2   -2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    1    1    3    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1   -1    3    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1    3   -1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1   -1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    0    2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12   -2    4    0   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3   -3    1    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    4   -2    2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1    3    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2   -2    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    3   -1    1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    4    0    2    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19    3   -3   -1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    4   -2    0    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    3   -1   -1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2    0   -2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.45                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4138    1.4142    1.0003   90.0704   89.9956   90.0317      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4064    1.4166    1.0039   90.0000   90.0000   90.0000      0.3549         1.4010    1.4111    3.9634    3.9920    2.8289
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0307    0.0154    0.0000    0.0000    0.0000      0.0226         0.0215    0.0265    0.2526    0.2687    0.1855
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3858   -0.2266    0.5478)
 a2 = (   -0.5686   -0.0441   -0.4181)
 a3 = (    0.2367   -0.9450   -0.2243)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3886   -0.2286    0.5498) (    0.0049    0.0031    0.0034)
 a2 = (   -0.5667   -0.0436   -0.4187) (    0.0148    0.0051    0.0060)
 a3 = (    0.2374   -0.9413   -0.2235) (    0.0072    0.0143    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  127.4857  102.9650   14.1581    0.4530    0.2565    0.3300
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            151            165
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.3729
# Chi-squares at the beginning and the end of the refinement
    0.2930    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2   -1   -1   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    1   -1    3   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    0   -2   -2   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    0   -2    2   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    1   -1   -3    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8    1    1   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9   -1   -3    1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10    1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    2    0   -2    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12   -2   -4    0   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13    3    3   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    4    2   -2    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15   -1   -3   -1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16    2    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17    3    1   -1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18    4    0   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19    3    3    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    4    2    0    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21   -1   -1   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    3    1    1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23    2    0    2    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1   -1   -3   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -1    3   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    0   -2   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    0   -2    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    0   -2    2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    1   -1   -3    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1    1   -3    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1   -3    1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1    1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    0   -2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12   -2   -4    0   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3    3   -1    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    4    2   -2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1   -3   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2    2    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    3    1   -1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    4    0   -2    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19    3    3    1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    4    2    0    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    3    1    1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2    0    2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.46                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3699    1.4496    1.0077   90.9237   90.8370   91.4199      0.7829
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4081    1.4147    1.0040   90.0000   90.0000   90.0000      0.3582         1.4025    1.4091    3.9312    3.9497    2.8030
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0390    0.0166    0.0000    0.0000    0.0000      0.0251         0.0232    0.0341    0.2758    0.2978    0.2020
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4093   -0.2243    0.5617)
 a2 = (    0.5370    0.0441    0.4314)
 a3 = (   -0.2350    0.9383    0.2227)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3879   -0.2283    0.5493) (    0.0067    0.0034    0.0044)
 a2 = (    0.5675    0.0441    0.4191) (    0.0190    0.0067    0.0077)
 a3 = (   -0.2380    0.9411    0.2231) (    0.0083    0.0155    0.0058)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   52.5279   77.0550 -165.8082    0.5954    0.2941    0.4030
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002   -0.0000    0.0006      0.0024    0.0034    0.0142

# Number of computed bands
            270            167
# Figure of merit at the beginning and the end of the refinement
         1.0365         9.3619
# Chi-squares at the beginning and the end of the refinement
    9.3582    0.0293
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7979   -0.0656   -0.7310   -0.0567    0.0675    0    0.1527    0.0702
    2   -1    1    2   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1528    0.0995
    3    2   -2   -1    0.0128    0.0114   -0.0262    0.0895    0.0873    1    0.1497    0.0967
    4    0    2    2   -0.1870   -0.6083   -0.1957   -0.5833    0.0265    0    0.2316    0.1078
    5    0    0    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0703    0.0654
    6    0    2   -2   -0.1154    0.1337   -0.1085    0.1216    0.0140    1    0.1669    0.0778
    7    1    1    3    0.1318   -0.6016    0.1201   -0.5973    0.0125    1    0.2968    0.1302
    8    1   -1    2    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1605    0.1017
    9   -1    3   -1   -0.2119    0.0546   -0.1952    0.0486    0.0177    1    0.1686    0.0726
   10    1   -1    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.1008    0.0467
   11    2    0    2    0.5464   -0.6055    0.5303   -0.6130    0.0177    1    0.2802    0.1248
   12   -2    4    0   -0.1943   -0.0409   -0.1829   -0.0381    0.0118    1    0.2173    0.0984
   13    2   -2    1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1571    0.0927
   14    4   -2    2    0.5333   -0.1494    0.5293   -0.1451    0.0058    1    0.3362    0.1473
   15   -1    3    1   -0.3506   -0.2543   -0.3362   -0.2357    0.0235    0    0.1928    0.0881
   16    1   -1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    3   -1    1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.2601    0.1198
   18    2    0    1    1.0506   -0.4884    1.0696   -0.4972    0.0209    1    0.2819    0.2483
   19    2   -2   -1    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1497    0.0994
   20    4   -2    0    0.4510    0.1639    0.4423    0.1634    0.0086    1    0.2669    0.1178
   21   -1    1    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0949    0.0568
   22    3   -1   -1    0.3105    0.3359    0.3053    0.3413    0.0075    1    0.2025    0.0899
   23    2    0   -2    0.0428    0.2852    0.0347    0.2716    0.0157    1    0.1789    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7334   -0.0571   -0.7310   -0.0567    0.0024    1          0.0671          0.0702
    2   -1    1    3   -0.0133   -0.1730   -0.0130   -0.1762    0.0032    1          0.1001          0.0995
    3    1    1   -3   -0.0269    0.0913   -0.0262    0.0895    0.0020    1          0.0980          0.0967
    4    0    2    2   -0.1957   -0.5859   -0.1957   -0.5833    0.0026    1          0.1041          0.1078
    5    0    0    2    0.0565   -0.2227    0.0560   -0.2234    0.0009    1          0.0646          0.0654
    6    0    2   -2   -0.1083    0.1209   -0.1085    0.1216    0.0007    1          0.0772          0.0778
    7    1    1    3    0.1209   -0.5958    0.1201   -0.5973    0.0017    1          0.1332          0.1302
    8    1   -1    3    0.1438   -0.2193    0.1454   -0.2240    0.0049    1          0.1038          0.1017
    9   -1    3   -1   -0.1957    0.0488   -0.1952    0.0486    0.0005    1          0.0785          0.0726
   10    1   -1    1    0.2254   -0.1262    0.2251   -0.1274    0.0013    1          0.0464          0.0467
   11    2    0    2    0.5372   -0.6115    0.5303   -0.6130    0.0070    1          0.1255          0.1248
   12   -2    4    0   -0.1815   -0.0378   -0.1829   -0.0381    0.0014    1          0.1009          0.0984
   13    3   -3    1    0.1975   -0.0079    0.1990   -0.0092    0.0019    1          0.1014          0.0927
   14    4   -2    2    0.5296   -0.1474    0.5293   -0.1451    0.0023    1          0.1506          0.1473
   15   -1    3    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0882          0.0881
   16    2   -2    0    0.1262    0.0359    0.1275    0.0362    0.0013    1          0.0628          0.0679
   17    3   -1    1    0.7286   -0.0784    0.7293   -0.0807    0.0024    1          0.1164          0.1198
   18    4    0    2    1.0609   -0.5068    1.0696   -0.4972    0.0130    1          0.2560          0.2483
   19    3   -3   -1    0.0442    0.0294    0.0442    0.0295    0.0001    1          0.0979          0.0994
   20    4   -2    0    0.4441    0.1655    0.4423    0.1634    0.0027    1          0.1198          0.1178
   21   -1    1    1   -0.0333   -0.0567   -0.0341   -0.0579    0.0015    1          0.0437          0.0568
   22    3   -1   -1    0.2992    0.3344    0.3053    0.3413    0.0092    1          0.0909          0.0899
   23    2    0   -2    0.0354    0.2742    0.0347    0.2716    0.0027    1          0.0811          0.0816

###            No.49                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4058    1.4205    1.0016   90.0739   90.1389   90.1856      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4166    1.4064    1.0039   90.0000   90.0000   90.0000      0.3549         1.4111    1.4010    3.9920    3.9634    2.8289
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0304    0.0189    0.0000    0.0000    0.0000      0.0230         0.0265    0.0215    0.2592    0.2712    0.1912
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5731   -0.0459   -0.4189)
 a2 = (    0.3801    0.2244   -0.5484)
 a3 = (    0.2364   -0.9438   -0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5667   -0.0436   -0.4187) (    0.0031    0.0045    0.0043)
 a2 = (    0.3886    0.2286   -0.5498) (    0.0127    0.0058    0.0093)
 a3 = (    0.2374   -0.9413   -0.2235) (    0.0070    0.0178    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -142.5143  102.9650   14.1581    0.4530    0.2565    0.3300
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            139            166
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.3541
# Chi-squares at the beginning and the end of the refinement
    0.3102    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2   -1    1   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1   -1    3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4   -2    0   -2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -2    0    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7   -1   -1   -3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    1   -1   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -3    1    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    0   -2   -2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12   -4    2    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    3   -3   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    2   -4   -2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15   -3    1   -1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    2   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -3   -1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    0   -4   -2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    3   -3    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    2   -4    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21   -1    1   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -3    1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    0   -2    2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1    1   -3   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1   -1    3   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4   -2    0   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    0   -2    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2    0    2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -1   -1   -3    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1   -1   -3    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -3    1    1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1   -1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    0   -2   -2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12   -4    2    0   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3   -3   -1    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2   -4   -2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -3    1   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2   -2    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -3   -1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    0   -4   -2    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19    3   -3    1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    2   -4    0    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1   -3    1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    0   -2    2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.50                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4097    1.4157    1.0022   90.0348   90.0874   90.2144      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4064    1.4166    1.0039   90.0000   90.0000   90.0000      0.3549         1.4010    1.4111    3.9634    3.9920    2.8289
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0307    0.0154    0.0000    0.0000    0.0000      0.0226         0.0215    0.0265    0.2526    0.2687    0.1855
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3858    0.2274   -0.5502)
 a2 = (   -0.5671   -0.0429   -0.4189)
 a3 = (   -0.2364    0.9436    0.2222)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3886    0.2286   -0.5498) (    0.0049    0.0031    0.0034)
 a2 = (   -0.5667   -0.0436   -0.4187) (    0.0148    0.0051    0.0060)
 a3 = (   -0.2374    0.9413    0.2235) (    0.0072    0.0143    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -127.4857   77.0350 -165.8419    0.4530    0.2565    0.3300
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            155            168
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.3168
# Chi-squares at the beginning and the end of the refinement
    1.8500    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    1   -1    3   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3   -1   -1   -3   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    0   -2    2   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0    0    2    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6    0   -2   -2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7   -1   -1    3    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8   -1    1    3    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    1   -3   -1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -2    0    2    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    2   -4    0   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13   -2    2    1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14   -4    2    2    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    1   -3    1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16   -2    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -3    1    1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18   -2    0    1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19   -3    3   -1    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20   -4    2    0    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    1   -1    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22   -3    1   -1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23   -2    0   -2    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    1   -1    3   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1   -1   -3   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    0   -2    2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    0    2    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    0   -2   -2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -1   -1    3    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -1    1    3    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9    1   -3   -1   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10   -1    1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11   -2    0    2    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    2   -4    0   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3    3    1    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -4    2    2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -3    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16   -2    2    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -3    1    1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -4    0    2    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19   -3    3   -1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20   -4    2    0    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -3    1   -1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2    0   -2    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.51                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9989    1.4160    1.4141   90.1300   90.3378   89.7289      0.5219
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0039    1.4064    1.4166   90.0000   90.0000   90.0000      0.3549         0.7087    0.9929    2.8288    3.9633    3.9918
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0216    0.0266    0.0000    0.0000    0.0000      0.0229         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2374   -0.9459   -0.2266)
 a2 = (   -0.3868   -0.2245    0.5466)
 a3 = (   -0.5679   -0.0466   -0.4189)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2374   -0.9413   -0.2235) (    0.0055    0.0016    0.0043)
 a2 = (   -0.3886   -0.2286    0.5498) (    0.0091    0.0046    0.0078)
 a3 = (   -0.5667   -0.0436   -0.4187) (    0.0129    0.0048    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -16.1794  126.3737  -85.6049    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            147            153
# Figure of merit at the beginning and the end of the refinement
         2.7487         9.2557
# Chi-squares at the beginning and the end of the refinement
    0.9107    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7327   -0.0601   -0.7310   -0.0567    0.0038    1    0.0488    0.0702
    2   -3   -1   -1   -0.0138   -0.1765   -0.0130   -0.1762    0.0008    1    0.1468    0.0995
    3    3    1   -1   -0.0258    0.0871   -0.0262    0.0895    0.0024    1    0.1431    0.0967
    4   -2    0   -2   -0.1950   -0.5855   -0.1957   -0.5833    0.0023    1    0.1525    0.1078
    5   -2    0    0    0.0566   -0.2254    0.0560   -0.2234    0.0021    1    0.0947    0.0654
    6    2    0   -2   -0.1063    0.1187   -0.1085    0.1216    0.0036    1    0.1125    0.0778
    7   -3    1   -1    0.1188   -0.5949    0.1201   -0.5973    0.0028    1    0.1954    0.1302
    8   -3    1    1    0.1437   -0.2213    0.1454   -0.2240    0.0032    1    0.1522    0.1017
    9    1   -1   -3   -0.1955    0.0489   -0.1952    0.0486    0.0004    1    0.1143    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0677    0.0467
   11   -1    1    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.0913    0.1248
   12    0   -2   -4   -0.1833   -0.0382   -0.1829   -0.0381    0.0004    1    0.1472    0.0984
   13   -1    3    3    0.1963   -0.0084    0.1990   -0.0092    0.0028    1    0.1477    0.0927
   14   -2    4    2    0.5277   -0.1505    0.5293   -0.1451    0.0056    1    0.2197    0.1473
   15   -1   -1   -3   -0.3370   -0.2383   -0.3362   -0.2357    0.0027    1    0.1290    0.0881
   16    0    2    2    0.1238    0.0352    0.1275    0.0362    0.0038    1    0.0913    0.0679
   17   -1    3    1    0.7269   -0.0835    0.7293   -0.0807    0.0038    1    0.1692    0.1198
   18   -2    4    0    1.0515   -0.5169    1.0696   -0.4972    0.0268    1    0.3733    0.2483
   19    1    3    3    0.0412    0.0276    0.0442    0.0295    0.0036    1    0.1426    0.0994
   20    0    2    1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0867    0.1178
   21   -1   -1   -1   -0.0355   -0.0603   -0.0341   -0.0579    0.0028    1    0.0638    0.0568
   22    1    3    1    0.2966    0.3315    0.3053    0.3413    0.0131    1    0.1316    0.0899
   23    1    1    0    0.0343    0.2691    0.0347    0.2716    0.0026    1    0.0588    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -3   -1   -1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3    1   -1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4   -2    0   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5   -2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    2    0   -2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -3    1   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -3    1    1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9    1   -1   -3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10   -1    1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11   -2    2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0   -2   -4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1    3    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2    4    2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1   -1   -3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1    3    1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -2    4    0    1.0611   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19    1    3    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0    4    2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1    3    1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2    2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.52                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9994    1.4168    1.4125   90.3190   89.9310   90.0693      0.3594
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0039    1.4064    1.4166   90.0000   90.0000   90.0000      0.3549         0.7087    0.9929    2.8289    3.9634    3.9920
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0216    0.0266    0.0000    0.0000    0.0000      0.0229         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2366   -0.9457   -0.2256)
 a2 = (    0.3862    0.2259   -0.5459)
 a3 = (    0.5706    0.0442    0.4168)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2374   -0.9413   -0.2235) (    0.0055    0.0016    0.0043)
 a2 = (    0.3886    0.2286   -0.5498) (    0.0091    0.0046    0.0078)
 a3 = (    0.5667    0.0436    0.4187) (    0.0129    0.0048    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -163.8206   53.6263   94.3951    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            155            153
# Figure of merit at the beginning and the end of the refinement
         8.5347         9.2555
# Chi-squares at the beginning and the end of the refinement
    0.0557    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7261   -0.0563   -0.7310   -0.0567    0.0049    1    0.0669    0.0702
    2   -3    1    1   -0.0139   -0.1751   -0.0130   -0.1762    0.0014    1    0.1008    0.0995
    3    3   -1    1   -0.0258    0.0871   -0.0262    0.0895    0.0024    1    0.0985    0.0967
    4   -2    0    2   -0.1965   -0.5826   -0.1957   -0.5833    0.0011    1    0.1045    0.1078
    5   -2    0    0    0.0562   -0.2245    0.0560   -0.2234    0.0011    1    0.0651    0.0654
    6    2    0    2   -0.1054    0.1177   -0.1085    0.1216    0.0049    1    0.0776    0.0778
    7   -3   -1    1    0.1175   -0.5941    0.1201   -0.5973    0.0041    1    0.1338    0.1302
    8   -3   -1   -1    0.1434   -0.2208    0.1454   -0.2240    0.0037    1    0.1046    0.1017
    9    1    1    3   -0.1929    0.0485   -0.1952    0.0486    0.0023    1    0.0788    0.0726
   10   -1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2   -2    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1255    0.1248
   12    0    2    4   -0.1807   -0.0372   -0.1829   -0.0381    0.0023    1    0.1014    0.0984
   13   -1   -3   -3    0.1969   -0.0086    0.1990   -0.0092    0.0021    1    0.1018    0.0927
   14   -2   -4   -2    0.5275   -0.1502    0.5293   -0.1451    0.0054    1    0.1508    0.1473
   15   -1    1    3   -0.3351   -0.2348   -0.3362   -0.2357    0.0014    1    0.0886    0.0881
   16    0   -2   -2    0.1250    0.0353    0.1275    0.0362    0.0026    1    0.0630    0.0679
   17   -1   -3   -1    0.7265   -0.0827    0.7293   -0.0807    0.0035    1    0.1163    0.1198
   18   -2   -4    0    1.0534   -0.5157    1.0696   -0.4972    0.0246    1    0.2553    0.2483
   19    1   -3   -3    0.0425    0.0284    0.0442    0.0295    0.0020    1    0.0982    0.0994
   20    0   -4   -2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1197    0.1178
   21   -1    1    1   -0.0348   -0.0587   -0.0341   -0.0579    0.0010    1    0.0439    0.0568
   22    1   -3   -1    0.2966    0.3315    0.3053    0.3413    0.0131    1    0.0907    0.0899
   23    2   -2    0    0.0343    0.2691    0.0347    0.2716    0.0026    1    0.0812    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -3    1    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3   -1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4   -2    0    2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5   -2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    2    0    2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7   -3   -1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -3   -1   -1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9    1    1    3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10   -1   -1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11   -2   -2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0    2    4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1   -3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -2   -4   -2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1    1    3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0   -2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1   -3   -1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -2   -4    0    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2540          0.2483
   19    1   -3   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -4   -2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1   -3   -1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    2   -2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.56                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0008    1.4172    1.4101   90.1140   89.9388   90.1151      0.5606
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0039    1.4064    1.4166   90.0000   90.0000   90.0000      0.3549         0.7087    0.9929    2.8288    3.9633    3.9918
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0216    0.0266    0.0000    0.0000    0.0000      0.0229         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2386    0.9443    0.2232)
 a2 = (   -0.3837   -0.2249    0.5478)
 a3 = (    0.5702    0.0442    0.4193)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2374    0.9413    0.2235) (    0.0055    0.0016    0.0043)
 a2 = (   -0.3886   -0.2286    0.5498) (    0.0091    0.0046    0.0078)
 a3 = (    0.5667    0.0436    0.4187) (    0.0129    0.0048    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   16.1794   53.6263   94.3951    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            141            155
# Figure of merit at the beginning and the end of the refinement
         2.3593         9.2158
# Chi-squares at the beginning and the end of the refinement
    1.3015    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0525    0.0702
    2    3   -1    1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1    0.1571    0.0995
    3   -3    1    1   -0.0271    0.0906   -0.0262    0.0895    0.0015    1    0.1540    0.0967
    4    2    0    2   -0.1960   -0.5843   -0.1957   -0.5833    0.0010    1    0.1632    0.1078
    5    2    0    0    0.0561   -0.2222    0.0560   -0.2234    0.0012    1    0.1014    0.0654
    6   -2    0    2   -0.1083    0.1206   -0.1085    0.1216    0.0010    1    0.1214    0.0778
    7    3    1    1    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.2090    0.1302
    8    3    1   -1    0.1424   -0.2186    0.1454   -0.2240    0.0062    1    0.1631    0.1017
    9   -1   -1    3   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1232    0.0726
   10    1    1   -1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0726    0.0467
   11    1    1    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.0978    0.1248
   12    0   -2    4   -0.1831   -0.0376   -0.1829   -0.0381    0.0005    1    0.1582    0.0984
   13    1    3   -3    0.1959   -0.0086    0.1990   -0.0092    0.0031    1    0.1586    0.0927
   14    2    4   -2    0.5276   -0.1507    0.5293   -0.1451    0.0058    1    0.2358    0.1473
   15    1   -1    3   -0.3371   -0.2365   -0.3362   -0.2357    0.0012    1    0.1384    0.0881
   16    0    2   -2    0.1248    0.0352    0.1275    0.0362    0.0029    1    0.0980    0.0679
   17    1    3   -1    0.7288   -0.0838    0.7293   -0.0807    0.0031    1    0.1819    0.1198
   18    2    4    0    1.0559   -0.5189    1.0696   -0.4972    0.0257    1    0.4026    0.2483
   19   -1    3   -3    0.0428    0.0286    0.0442    0.0295    0.0017    1    0.1529    0.0994
   20    0    2   -1    0.4449    0.1643    0.4423    0.1634    0.0027    1    0.0932    0.1178
   21    1   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0683    0.0568
   22   -1    3   -1    0.2989    0.3353    0.3053    0.3413    0.0088    1    0.1417    0.0899
   23   -1    1    0    0.0339    0.2734    0.0347    0.2716    0.0019    1    0.0633    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3   -1    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3    1    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2    0    2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2    0    2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3    1    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3    1   -1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1   -1    3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1    1   -1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2    2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0   -2    4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1    3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2    4   -2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -1    3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1    3   -1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2    4    0    1.0611   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19   -1    3   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0    4   -2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    3   -1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2    2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.62                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3990    1.4199    1.0070   90.0420   89.9885   91.0446      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3584    1.4487    1.0163   90.0000   90.0000   90.0000      0.3621         1.3365    1.4254    3.7518    4.0013    2.8071
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0311    0.0188    0.0000    0.0000    0.0000      0.0243         0.0247    0.0223    0.2520    0.2821    0.1955
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5748    0.0446    0.4227)
 a2 = (   -0.3736   -0.2245    0.5534)
 a3 = (    0.2352   -0.9391   -0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5960    0.0565    0.4284) (    0.0030    0.0048    0.0045)
 a2 = (   -0.3664   -0.2261    0.5396) (    0.0120    0.0060    0.0091)
 a3 = (    0.2465   -0.9266   -0.2208) (    0.0070    0.0172    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   36.6658  102.9701   14.9001    0.4479    0.2705    0.3319
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0034   -0.0092    0.0007      0.0023    0.0022    0.0118

# Number of computed bands
            133            400
# Figure of merit at the beginning and the end of the refinement
         2.7728         3.9438
# Chi-squares at the beginning and the end of the refinement
    2.9161    0.6961
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    1   -1   -2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3    1    1    3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    2    0   -2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0   -1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6    2    0    2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    1    1   -3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8   -1    1   -2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9    3   -1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10   -1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    0    2   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    4   -2    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13   -2    2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -2    4   -2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    3   -1   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16   -1    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -1    3   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    0    2   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19   -2    2    1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -2    4    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    1   -1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -1    3    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23    0    2    2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0    0   -0.7085   -0.0582   -0.7310   -0.0567    0.0226    1          0.0693          0.0702
    2    1   -1   -3   -0.0096   -0.1697   -0.0130   -0.1762    0.0073    1          0.1003          0.0995
    3    1    1    3   -0.0273    0.1027   -0.0262    0.0895    0.0133    1          0.0981          0.0967
    4    2    0   -2   -0.2049   -0.5767   -0.1957   -0.5833    0.0113    1          0.1062          0.1078
    5    0    0   -2    0.0626   -0.2132    0.0560   -0.2234    0.0122    1          0.0645          0.0654
    6    2    0    2   -0.1157    0.1323   -0.1085    0.1216    0.0129    1          0.0788          0.0778
    7    1    1   -3    0.1209   -0.5920    0.1201   -0.5973    0.0053    1          0.1338          0.1302
    8   -1    1   -3    0.1475   -0.2022    0.1454   -0.2240    0.0219    0          0.1036          0.1017
    9    3   -1    1   -0.2048    0.0553   -0.1952    0.0486    0.0117    1          0.0819          0.0726
   10   -1    1   -1    0.2172   -0.1046    0.2251   -0.1274    0.0241    0          0.0464          0.0467
   11    0    2   -2    0.5410   -0.6052    0.5303   -0.6130    0.0132    1          0.1249          0.1248
   12    4   -2    0   -0.1908   -0.0330   -0.1829   -0.0381    0.0094    1          0.1053          0.0984
   13   -2    2   -1    0.2019   -0.0238    0.1990   -0.0092    0.0149    1          0.0727          0.0927
   14   -2    4   -2    0.5200   -0.1278    0.5293   -0.1451    0.0197    1          0.1483          0.1473
   15    3   -1   -1   -0.3386   -0.2277   -0.3362   -0.2357    0.0083    1          0.0919          0.0881
   16   -2    2    0    0.1097    0.0405    0.1275    0.0362    0.0183    0          0.0636          0.0679
   17   -1    3   -1    0.7227   -0.0618    0.7293   -0.0807    0.0201    1          0.1143          0.1198
   18    0    4   -2    1.0778   -0.5112    1.0696   -0.4972    0.0163    1          0.2575          0.2483
   19   -3    3    1    0.0328    0.0290    0.0442    0.0295    0.0114    1          0.0993          0.0994
   20   -2    4    0    0.4303    0.1727    0.4423    0.1634    0.0152    1          0.1179          0.1178
   21    1   -1   -1   -0.0363   -0.0579   -0.0341   -0.0579    0.0022    1          0.0441          0.0568
   22   -1    3    1    0.2923    0.3405    0.3053    0.3413    0.0130    1          0.0895          0.0899
   23    0    2    2    0.0318    0.2826    0.0347    0.2716    0.0113    1          0.0805          0.0816

###            No.63                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5775    1.5921    0.7964   90.0217   90.6099   90.2189      0.5948
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5884    1.5927    0.7906   90.0000   90.0000   90.0000      0.2832         2.0091    2.0145    5.6087    5.6239    2.7917
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0599    0.0317    0.0000    0.0000    0.0000      0.0180         0.0805    0.0280    0.3558    0.4148    0.2094
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1231    0.1118   -0.6117)
 a2 = (    0.1487   -0.5938   -0.1410)
 a3 = (   -1.1976   -0.3397    0.1650)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1151    0.1149   -0.6082) (    0.0039    0.0036    0.0012)
 a2 = (    0.1499   -0.5933   -0.1405) (    0.0068    0.0230    0.0038)
 a3 = (   -1.2063   -0.3434    0.1634) (    0.0494    0.0138    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.0408   82.5766  -74.1105    0.3839    0.3018    0.3441
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            171            295
# Figure of merit at the beginning and the end of the refinement
         2.1182         3.9365
# Chi-squares at the beginning and the end of the refinement
    4.9300    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0   -1   -0.7285   -0.0585   -0.7310   -0.0567    0.0032    1    0.1409    0.0702
    2    0   -4   -1   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1468    0.0995
    3   -1    3    0   -0.0275    0.0915   -0.0262    0.0895    0.0024    1    0.1025    0.0967
    4   -2   -4   -1   -0.1988   -0.5835   -0.1957   -0.5833    0.0031    1    0.2191    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0676    0.0654
    6   -2    4   -1   -0.1089    0.1207   -0.1085    0.1216    0.0010    1    0.1622    0.0778
    7   -1   -3    0    0.1156   -0.5974    0.1201   -0.5973    0.0045    1    0.1396    0.1302
    8    0   -4    1    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1543    0.1017
    9   -1    1   -1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0822    0.0726
   10    0   -2    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0970    0.0467
   11   -2   -4    1    0.5321   -0.6234    0.5303   -0.6130    0.0106    1    0.2649    0.1248
   12   -1   -1   -2   -0.1439   -0.0705   -0.1829   -0.0381    0.0507    1    0.1404    0.0984
   13    0   -2    2    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1510    0.0927
   14   -1   -3    2    0.4432   -0.1614    0.5293   -0.1451    0.0877    1    0.2007    0.1473
   15   -1   -1   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    0    0    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0653    0.0679
   17   -1   -1    1    0.7402   -0.0861    0.7293   -0.0807    0.0120    1    0.1222    0.1198
   18   -2   -2    1    1.0701   -0.5348    1.0696   -0.4972    0.0376    1    0.2720    0.2483
   19    0    2    2    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1439    0.0994
   20   -2    0    3    0.4512    0.1676    0.4423    0.1634    0.0098    1    0.2512    0.1178
   21    0   -2   -1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0912    0.0568
   22   -1    1    1    0.3019    0.3408    0.3053    0.3413    0.0035    1    0.0947    0.0899
   23   -2    4    1    0.0336    0.2766    0.0347    0.2716    0.0050    1    0.1697    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0   -1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -6   -1   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -2    6    0   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -2   -4   -1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -4    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -2    4   -1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7   -2   -6    0    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0   -6    1    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -2    2   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -2    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2   -4    1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -2    0   -3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0   -2    3    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -2   -4    3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2   -2   -2   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0    2    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -2   -2    2    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -4   -4    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    2    3    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20   -2    0    3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -2   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -2    2    2    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2    4    1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.64                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5813    1.5959    0.7925   90.0248   90.2116   89.7811      0.5719
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5884    1.5927    0.7906   90.0000   90.0000   90.0000      0.2832         2.0091    2.0145    5.6087    5.6239    2.7917
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0599    0.0317    0.0000    0.0000    0.0000      0.0180         0.0805    0.0280    0.3558    0.4148    0.2094
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1141    0.1140   -0.6115)
 a2 = (   -0.1484    0.5923    0.1406)
 a3 = (    1.2034    0.3413   -0.1658)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1151    0.1149   -0.6082) (    0.0039    0.0036    0.0012)
 a2 = (   -0.1499    0.5933    0.1405) (    0.0068    0.0230    0.0038)
 a3 = (    1.2063    0.3434   -0.1634) (    0.0494    0.0138    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -76.9592   97.4234  105.8895    0.3839    0.3018    0.3441
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            181            295
# Figure of merit at the beginning and the end of the refinement
         2.3105         3.9365
# Chi-squares at the beginning and the end of the refinement
    4.5986    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    1   -0.7338   -0.0581   -0.7310   -0.0567    0.0031    1    0.1353    0.0702
    2    0    4    1   -0.0313   -0.1393   -0.0130   -0.1762    0.0412    1    0.1410    0.0995
    3   -1   -3    0   -0.0273    0.0922   -0.0262    0.0895    0.0030    1    0.0983    0.0967
    4   -2    4    1   -0.1977   -0.5856   -0.1957   -0.5833    0.0030    1    0.2102    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0648    0.0654
    6   -2   -4    1   -0.1090    0.1214   -0.1085    0.1216    0.0006    1    0.1554    0.0778
    7   -1    3    0    0.1190   -0.5977    0.1201   -0.5973    0.0012    1    0.1340    0.1302
    8    0    4   -1    0.1782   -0.2012    0.1454   -0.2240    0.0400    1    0.1482    0.1017
    9   -1   -1    1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0788    0.0726
   10    0    2   -1    0.2264   -0.1273    0.2251   -0.1274    0.0013    1    0.0933    0.0467
   11   -2    4   -1    0.5369   -0.6161    0.5303   -0.6130    0.0073    1    0.2543    0.1248
   12   -1    1    2   -0.1430   -0.0700   -0.1829   -0.0381    0.0511    1    0.1350    0.0984
   13    0    2   -2    0.2191   -0.0407    0.1990   -0.0092    0.0374    1    0.1456    0.0927
   14   -1    3   -2    0.4419   -0.1582    0.5293   -0.1451    0.0884    1    0.1934    0.1473
   15   -1    1    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0887    0.0881
   16    0    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0631    0.0679
   17   -1    1   -1    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1174    0.1198
   18   -2    2   -1    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.2589    0.2483
   19    0   -2   -2    0.0134    0.0118    0.0442    0.0295    0.0355    1    0.1388    0.0994
   20   -2    0   -3    0.4473    0.1656    0.4423    0.1634    0.0055    1    0.2426    0.1178
   21    0    2    1   -0.0332   -0.0559   -0.0341   -0.0579    0.0022    1    0.0878    0.0568
   22   -1   -1   -1    0.3021    0.3363    0.3053    0.3413    0.0059    1    0.0915    0.0899
   23   -2   -4   -1    0.0359    0.2765    0.0347    0.2716    0.0050    1    0.1634    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0    6    1   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -2   -6    0   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -2    4    1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    4    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -2   -4    1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7   -2    6    0    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0    6   -1    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -2   -2    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    2   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2    4   -1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -2    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0    2   -3    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -2    4   -3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -2    2    2   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -2    2   -2    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -4    4   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0   -2   -3    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20   -2    0   -3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    2    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -2   -2   -2    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2   -4   -1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.65                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5810    1.6013    0.7901   90.0755   89.9748   90.9223      0.3805
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5812    1.5884    0.7963   90.0000   90.0000   90.0000      0.2832         1.9856    1.9946    5.5834    5.6087    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0636    0.0111    0.0000    0.0000    0.0000      0.0218         0.0276    0.0751    0.4292    0.4861    0.2196
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6033   -0.1711    0.0831)
 a2 = (    0.1057   -0.1162    0.6045)
 a3 = (   -0.2997    1.1964    0.2840)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6032   -0.1717    0.0817) (    0.0012    0.0036    0.0033)
 a2 = (    0.1151   -0.1149    0.6082) (    0.0079    0.0074    0.0234)
 a3 = (   -0.2997    1.1867    0.2810) (    0.0084    0.0160    0.0096)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.6177   77.0704 -165.8246    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            183            180
# Figure of merit at the beginning and the end of the refinement
         3.2106         3.8514
# Chi-squares at the beginning and the end of the refinement
    1.8808    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0887    0.0702
    2   -2    0    3   -0.0136   -0.1734   -0.0130   -0.1762    0.0029    1    0.1351    0.0995
    3    0    2   -3   -0.0250    0.0861   -0.0262    0.0895    0.0035    1    0.1319    0.0967
    4   -2    2    2   -0.1902   -0.5814   -0.1957   -0.5833    0.0059    1    0.1389    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0872    0.0654
    6   -2    2   -2   -0.1032    0.1168   -0.1085    0.1216    0.0071    1    0.1034    0.0778
    7    0    2    3    0.1207   -0.5892    0.1201   -0.5973    0.0081    1    0.1786    0.1302
    8    2    0    3    0.1432   -0.2208    0.1454   -0.2240    0.0039    1    0.1402    0.1017
    9   -4    2   -1   -0.1903    0.0484   -0.1952    0.0486    0.0049    1    0.1045    0.0726
   10    2    0    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0625    0.0467
   11    1    1    1    0.5298   -0.6041    0.5303   -0.6130    0.0089    1    0.0835    0.1248
   12   -3    1    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0672    0.0984
   13    4    0    1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.0972    0.0927
   14    3    1    1    0.5257   -0.1487    0.5293   -0.1451    0.0051    1    0.1008    0.1473
   15   -4    2    1   -0.3322   -0.2355   -0.3362   -0.2357    0.0040    1    0.1174    0.0881
   16    4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0842    0.0679
   17    4    2    1    0.7207   -0.0806    0.7293   -0.0807    0.0086    1    0.1555    0.1198
   18    2    2    1    1.0412   -0.5000    1.0696   -0.4972    0.0285    1    0.1678    0.2483
   19    6    0   -1    0.0446    0.0299    0.0442    0.0295    0.0006    1    0.1314    0.0994
   20    3    1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0802    0.1178
   21   -2    0    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0588    0.0568
   22    4    2   -1    0.2959    0.3287    0.3053    0.3413    0.0158    1    0.1217    0.0899
   23    2    2   -2    0.0357    0.2673    0.0347    0.2716    0.0045    1    0.1089    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2   -2    0    3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0    2   -3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -2    2    2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0    2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -2    2   -2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0    2    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    2    0    3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -4    2   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    2    0    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    2    2    2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -6    2    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    6    0    1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    6    2    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -4    2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    4    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    4    2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    4    4    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    6    0   -1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20    6    2    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21   -2    0    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    4    2   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    2    2   -2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.67                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9950    1.4082    1.4275   90.6568   90.0147   90.4801      0.5002
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9690    1.4553    1.4183   90.0000   90.0000   90.0000      0.3581         0.6832    1.0261    2.7062    4.0643    3.9609
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0545    0.0511    0.0000    0.0000    0.0000      0.0230         0.0246    0.0139    0.1742    0.3027    0.2922
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1763   -0.1928    0.9705)
 a2 = (   -0.3531   -0.6140   -0.0516)
 a3 = (    0.5907   -0.3344   -0.1735)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1932   -0.1914    0.9955) (    0.0063    0.0058    0.0019)
 a2 = (   -0.3490   -0.5901   -0.0458) (    0.0138    0.0221    0.0032)
 a3 = (    0.5929   -0.3367   -0.1798) (    0.0220    0.0135    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   93.9484  104.7710   60.4086    0.2661    0.3936    0.3302
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0017    0.0070    0.0421      0.0023    0.0022    0.0349

# Number of computed bands
            137            400
# Figure of merit at the beginning and the end of the refinement
         3.0554         3.8445
# Chi-squares at the beginning and the end of the refinement
    1.9275    0.8210
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0951    0.0702
    2    0   -2   -1   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.0705    0.0995
    3    1    3    3   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.1381    0.0967
    4    1   -3   -1   -0.1926   -0.5922   -0.1957   -0.5833    0.0094    1    0.1469    0.1078
    5    0   -2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0909    0.0654
    6    1    1    3   -0.1092    0.1239   -0.1085    0.1216    0.0024    1    0.1081    0.0778
    7    1   -3   -3    0.1205   -0.5961    0.1201   -0.5973    0.0012    1    0.1872    0.1302
    8    0   -2   -3    0.1087   -0.2276    0.1454   -0.2240    0.0369    1    0.1167    0.1017
    9    1   -1    3   -0.2048    0.0518   -0.1952    0.0486    0.0102    1    0.1090    0.0726
   10    0    0   -1    0.2224   -0.1259    0.2251   -0.1274    0.0031    1    0.0321    0.0467
   11    1   -1   -3    0.5365   -0.6150    0.5303   -0.6130    0.0065    1    0.1752    0.1248
   12    1   -3    3   -0.1922   -0.0413   -0.1829   -0.0381    0.0099    1    0.1402    0.0984
   13    0    2   -3    0.1670    0.0151    0.1990   -0.0092    0.0402    1    0.1116    0.0927
   14    1    1   -5    0.5302   -0.1466    0.5293   -0.1451    0.0017    1    0.2085    0.1473
   15    1   -3    1   -0.3433   -0.2471   -0.3362   -0.2357    0.0134    1    0.1240    0.0881
   16    0    2   -2    0.1187    0.0352    0.1275    0.0362    0.0088    1    0.0866    0.0679
   17    1    1   -3    0.7311   -0.0737    0.7293   -0.0807    0.0073    1    0.1613    0.1198
   18    2    0   -4    1.0707   -0.5071    1.0696   -0.4972    0.0100    1    0.3598    0.2483
   19    0    2   -1    0.0367    0.0253    0.0442    0.0295    0.0086    1    0.0679    0.0994
   20    1    3   -3    0.4372    0.1699    0.4423    0.1634    0.0083    1    0.1654    0.1178
   21    0   -2    0   -0.0363   -0.0632   -0.0341   -0.0579    0.0057    1    0.0614    0.0568
   22    1    3   -1    0.2879    0.3322    0.3053    0.3413    0.0197    1    0.1262    0.0899
   23    1    3    1    0.0329    0.2669    0.0347    0.2716    0.0050    1    0.1141    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7232   -0.0466   -0.7310   -0.0567    0.0128    1          0.0720          0.0702
    2    0   -6   -2   -0.0280   -0.1447   -0.0130   -0.1762    0.0349    1          0.1430          0.0995
    3    1    3    3   -0.0275    0.0867   -0.0262    0.0895    0.0030    1          0.1014          0.0967
    4    1   -3   -1   -0.1974   -0.5960   -0.1957   -0.5833    0.0128    1          0.1100          0.1078
    5    0   -2   -2    0.0590   -0.2250    0.0560   -0.2234    0.0035    1          0.0666          0.0654
    6    1    1    3   -0.1075    0.1136   -0.1085    0.1216    0.0081    1          0.0809          0.0778
    7    1   -3   -3    0.1250   -0.5999    0.1201   -0.5973    0.0055    1          0.1407          0.1302
    8    0   -2   -4    0.1431   -0.2206    0.1454   -0.2240    0.0041    1          0.1079          0.1017
    9    1   -1    3   -0.1921    0.0441   -0.1952    0.0486    0.0055    1          0.0821          0.0726
   10    0    0   -2    0.2213   -0.1317    0.2251   -0.1274    0.0057    1          0.0483          0.0467
   11    1   -1   -3    0.5345   -0.6140    0.5303   -0.6130    0.0043    1          0.1347          0.1248
   12    1   -3    3   -0.1802   -0.0413   -0.1829   -0.0381    0.0042    1          0.1041          0.0984
   13    0    2   -4    0.1969   -0.0176    0.1990   -0.0092    0.0087    1          0.1049          0.0927
   14    1    1   -5    0.5254   -0.1584    0.5293   -0.1451    0.0138    1          0.1590          0.1473
   15    1   -3    1   -0.3396   -0.2383   -0.3362   -0.2357    0.0042    1          0.0917          0.0881
   16    0    2   -2    0.1288    0.0272    0.1275    0.0362    0.0090    1          0.0643          0.0679
   17    1    1   -3    0.7288   -0.0929    0.7293   -0.0807    0.0121    1          0.1247          0.1198
   18    2    0   -5    0.8576   -0.4388    1.0696   -0.4972    0.2199    0          0.2636          0.2483
   19    0    6   -2    0.0157    0.0053    0.0442    0.0295    0.0374    1          0.1400          0.0994
   20    1    3   -3    0.4514    0.1556    0.4423    0.1634    0.0119    1          0.1255          0.1178
   21    0   -2    0   -0.0309   -0.0620   -0.0341   -0.0579    0.0052    1          0.0443          0.0568
   22    1    3   -1    0.3055    0.3343    0.3053    0.3413    0.0070    1          0.0949          0.0899
   23    1    3    1    0.0334    0.2722    0.0347    0.2716    0.0014    1          0.0840          0.0816

###            No.69                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5813    1.6016    0.7898   90.2611   90.3111   89.0763      0.3914
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5812    1.5884    0.7963   90.0000   90.0000   90.0000      0.2832         1.9856    1.9946    5.5834    5.6087    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0636    0.0111    0.0000    0.0000    0.0000      0.0218         0.0276    0.0751    0.4292    0.4861    0.2196
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6032    0.1711   -0.0831)
 a2 = (    0.1057   -0.1161    0.6044)
 a3 = (    0.3081   -1.1963   -0.2779)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6032    0.1717   -0.0817) (    0.0012    0.0036    0.0033)
 a2 = (    0.1151   -0.1149    0.6082) (    0.0079    0.0074    0.0234)
 a3 = (    0.2997   -1.1867   -0.2810) (    0.0084    0.0160    0.0096)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6177  102.9296   14.1754    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            179            181
# Figure of merit at the beginning and the end of the refinement
         3.1429         3.8442
# Chi-squares at the beginning and the end of the refinement
    2.1581    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0912    0.0702
    2    2    0   -3   -0.0121   -0.1689   -0.0130   -0.1762    0.0073    1    0.1385    0.0995
    3    0    2    3   -0.0268    0.0902   -0.0262    0.0895    0.0010    1    0.1361    0.0967
    4    2    2   -2   -0.1855   -0.5793   -0.1957   -0.5833    0.0110    1    0.1420    0.1078
    5    0    0   -1    0.0561   -0.2179    0.0560   -0.2234    0.0055    1    0.0447    0.0654
    6    1    1    1   -0.1059    0.1189   -0.1085    0.1216    0.0037    1    0.0534    0.0778
    7    0    2   -3    0.1237   -0.5822    0.1201   -0.5973    0.0155    1    0.1825    0.1302
    8   -2    0   -2    0.1749   -0.1967    0.1454   -0.2240    0.0401    1    0.1021    0.1017
    9    4    2    1   -0.1918    0.0487   -0.1952    0.0486    0.0034    1    0.1079    0.0726
   10   -2    0   -1    0.2225   -0.1255    0.2251   -0.1274    0.0033    1    0.0643    0.0467
   11   -1    1   -1    0.5271   -0.5948    0.5303   -0.6130    0.0185    1    0.0852    0.1248
   12    3    1    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0691    0.0984
   13   -4    0   -1    0.2166   -0.0408    0.1990   -0.0092    0.0362    1    0.1000    0.0927
   14   -3    1   -1    0.5210   -0.1468    0.5293   -0.1451    0.0084    1    0.1034    0.1473
   15    4    2   -1   -0.3308   -0.2355   -0.3362   -0.2357    0.0054    1    0.1203    0.0881
   16   -4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0866    0.0679
   17   -4    2   -1    0.7159   -0.0798    0.7293   -0.0807    0.0134    1    0.1593    0.1198
   18   -2    2   -1    1.0331   -0.4929    1.0696   -0.4972    0.0367    1    0.1709    0.2483
   19   -4    0    1    0.0144    0.0129    0.0442    0.0295    0.0341    1    0.0950    0.0994
   20   -3    1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0824    0.1178
   21    2    0   -1   -0.0316   -0.0542   -0.0341   -0.0579    0.0045    1    0.0603    0.0568
   22   -4    2    1    0.2971    0.3316    0.3053    0.3413    0.0127    1    0.1253    0.0899
   23   -1    1    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0561    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    2    0   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0    2    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    2    2   -2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    2    2    2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0    2   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -2    0   -3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    4    2    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -2    0   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2    2   -2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    6    2    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13   -6    0   -1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -6    2   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    4    2   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16   -4    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -4    2   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -4    4   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -6    0    1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20   -6    2    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    2    0   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -4    2    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2    2    2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.71                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5554    1.6009    0.8041   90.1779   91.9476   91.9132      0.6026
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5812    1.5884    0.7963   90.0000   90.0000   90.0000      0.2832         1.9856    1.9946    5.5834    5.6087    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0636    0.0111    0.0000    0.0000    0.0000      0.0218         0.0276    0.0751    0.4292    0.4861    0.2196
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6139    0.1741   -0.0846)
 a2 = (   -0.0953    0.1191   -0.6061)
 a3 = (   -0.2555    1.1879    0.2683)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6032    0.1717   -0.0817) (    0.0012    0.0036    0.0033)
 a2 = (   -0.1151    0.1149   -0.6082) (    0.0079    0.0074    0.0234)
 a3 = (   -0.2997    1.1867    0.2810) (    0.0084    0.0160    0.0096)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -172.3823   77.0704 -165.8246    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            400            181
# Figure of merit at the beginning and the end of the refinement
         1.7427         3.8442
# Chi-squares at the beginning and the end of the refinement
    4.1973    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0702    0.0702
    2    2    0    2   -0.0332   -0.1261   -0.0130   -0.1762    0.0540    1    0.1499    0.0995
    3   -1   -1   -2    0.0002    0.0578   -0.0262    0.0895    0.0412    1    0.1392    0.0967
    4    1   -1    1   -0.2047   -0.5607   -0.1957   -0.5833    0.0243    1    0.1083    0.1078
    5    0    0    1    0.0464   -0.2158    0.0560   -0.2234    0.0122    1    0.0676    0.0654
    6    1   -1   -1   -0.1104    0.1296   -0.1085    0.1216    0.0082    1    0.0805    0.0778
    7    0   -2    3    0.1020   -0.5889    0.1201   -0.5973    0.0200    1    0.2787    0.1302
    8   -2    0    2    0.1720   -0.2005    0.1454   -0.2240    0.0354    1    0.1534    0.1017
    9    4   -2   -1   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1650    0.0726
   10   -2    0    1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0972    0.0467
   11   -1   -1    1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1308    0.1248
   12    3   -1    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1075    0.0984
   13   -4    0    1    0.2166   -0.0393    0.1990   -0.0092    0.0349    1    0.1535    0.0927
   14   -3   -1    1    0.5244   -0.1432    0.5293   -0.1451    0.0052    1    0.1588    0.1473
   15    4   -2    1   -0.3241   -0.2232   -0.3362   -0.2357    0.0174    1    0.1872    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0678    0.0679
   17   -4   -2    1    0.7144   -0.0718    0.7293   -0.0807    0.0174    1    0.2462    0.1198
   18   -2   -2    1    1.0491   -0.4881    1.0696   -0.4972    0.0224    1    0.2655    0.2483
   19   -4    0   -1    0.0183    0.0157    0.0442    0.0295    0.0293    1    0.1505    0.0994
   20   -3   -1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1290    0.1178
   21    2    0    1   -0.0292   -0.0461   -0.0341   -0.0579    0.0129    1    0.0946    0.0568
   22   -4   -2   -1    0.3016    0.3186    0.3053    0.3413    0.0230    0    0.1979    0.0899
   23   -1   -1   -1    0.0491    0.2765    0.0347    0.2716    0.0152    1    0.0873    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    2    0    3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0   -2   -3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    2   -2    2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0    2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    2   -2   -2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0   -2    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -2    0    3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    4   -2   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -2    0    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2   -2    2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    6   -2    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13   -6    0    1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -6   -2    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    4   -2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16   -4    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -4   -2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -4   -4    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -6    0   -1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20   -6   -2    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    2    0    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -4   -2   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2   -2   -2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.72                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5580    1.6037    0.8014   90.3364   91.7992   88.0701      0.6045
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5812    1.5884    0.7963   90.0000   90.0000   90.0000      0.2832         1.9856    1.9946    5.5834    5.6087    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0636    0.0111    0.0000    0.0000    0.0000      0.0218         0.0276    0.0751    0.4292    0.4861    0.2196
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6128   -0.1738    0.0844)
 a2 = (   -0.0952    0.1189   -0.6051)
 a3 = (    0.2577   -1.1890   -0.2805)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6032   -0.1717    0.0817) (    0.0012    0.0036    0.0033)
 a2 = (   -0.1151    0.1149   -0.6082) (    0.0079    0.0074    0.0234)
 a3 = (    0.2997   -1.1867   -0.2810) (    0.0084    0.0160    0.0096)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  172.3823  102.9296   14.1754    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            400            181
# Figure of merit at the beginning and the end of the refinement
         1.7419         3.8442
# Chi-squares at the beginning and the end of the refinement
    4.2390    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -2    0   -2   -0.0351   -0.1347   -0.0130   -0.1762    0.0470    1    0.1509    0.0995
    3    1   -1    2    0.0000    0.0481   -0.0262    0.0895    0.0489    1    0.1395    0.0967
    4   -1   -1   -1   -0.2061   -0.5694   -0.1957   -0.5833    0.0173    1    0.1099    0.1078
    5    0    0   -1    0.0488   -0.2253    0.0560   -0.2234    0.0074    1    0.0683    0.0654
    6   -1   -1    1   -0.1045    0.1228   -0.1085    0.1216    0.0041    1    0.0804    0.0778
    7    0   -2   -3    0.1047   -0.5979    0.1201   -0.5973    0.0155    1    0.2835    0.1302
    8    2    0   -2    0.1776   -0.2071    0.1454   -0.2240    0.0364    1    0.1551    0.1017
    9   -4   -2    1   -0.1920    0.0484   -0.1952    0.0486    0.0032    1    0.1650    0.0726
   10    2    0   -1    0.2292   -0.1300    0.2251   -0.1274    0.0048    1    0.0980    0.0467
   11    1   -1   -1    0.5355   -0.6189    0.5303   -0.6130    0.0079    1    0.1330    0.1248
   12   -3   -1    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    4    0   -1    0.2208   -0.0403    0.1990   -0.0092    0.0380    1    0.1543    0.0927
   14    3   -1   -1    0.5293   -0.1451    0.5293   -0.1451    0.0000    1    0.1604    0.1473
   15   -4   -2   -1   -0.3275   -0.2262   -0.3362   -0.2357    0.0130    1    0.1883    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    4   -2   -1    0.7185   -0.0730    0.7293   -0.0807    0.0133    1    0.2483    0.1198
   18    2   -2   -1    1.0538   -0.4918    1.0696   -0.4972    0.0166    1    0.2689    0.2483
   19    4    0    1    0.0150    0.0129    0.0442    0.0295    0.0336    1    0.1506    0.0994
   20    3   -1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -2    0   -1   -0.0328   -0.0520   -0.0341   -0.0579    0.0061    1    0.0949    0.0568
   22    4   -2    1    0.2981    0.3158    0.3053    0.3413    0.0265    0    0.1972    0.0899
   23    1   -1    1    0.0470    0.2678    0.0347    0.2716    0.0129    1    0.0870    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2   -2    0   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0   -2    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -2   -2   -2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -2   -2    2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0   -2   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    2    0   -3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -4   -2    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    2    0   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    2   -2   -2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -6   -2    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    6    0   -1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    6   -2   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -4   -2   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    4    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    4   -2   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    4   -4   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    6    0    1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20    6   -2    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21   -2    0   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    4   -2    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    2   -2    2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.73                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9974    1.4155    1.4167   90.0932   90.0809   90.3992      0.4654
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9650    1.4557    1.4238   90.0000   90.0000   90.0000      0.3402         0.6778    1.0224    2.8363    4.2784    4.1847
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0543    0.0511    0.0000    0.0000    0.0000      0.0215         0.0243    0.0139    0.1793    0.3141    0.3042
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1802    0.1871   -0.9684)
 a2 = (    0.3586    0.6070    0.0455)
 a3 = (    0.5947   -0.3367   -0.1768)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1946    0.1917   -0.9996) (    0.0063    0.0058    0.0019)
 a2 = (    0.3496    0.5896    0.0450) (    0.0138    0.0219    0.0033)
 a3 = (    0.5900   -0.3362   -0.1793) (    0.0217    0.0135    0.0044)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -86.1130  104.7942   60.3289    0.2671    0.3919    0.3306
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0011    0.0074    0.0490      0.0023    0.0022    0.0345

# Number of computed bands
            151            400
# Figure of merit at the beginning and the end of the refinement
         3.7968         3.5123
# Chi-squares at the beginning and the end of the refinement
    1.1495    0.4957
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7346   -0.0540   -0.7310   -0.0567    0.0045    1    0.0871    0.0702
    2    0    4   -2   -0.0135   -0.1715   -0.0130   -0.1762    0.0047    1    0.1302    0.0995
    3   -1   -3    3   -0.0271    0.0920   -0.0262    0.0895    0.0027    1    0.1278    0.0967
    4   -1    3   -1   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1350    0.1078
    5    0    2   -2    0.0554   -0.2216    0.0560   -0.2234    0.0018    1    0.0840    0.0654
    6   -1   -1    3   -0.1081    0.1214   -0.1085    0.1216    0.0004    1    0.1005    0.0778
    7   -1    3   -3    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.1730    0.1302
    8    0    2   -4    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1350    0.1017
    9   -1    1    3   -0.1956    0.0497   -0.1952    0.0486    0.0011    1    0.1018    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0602    0.0467
   11   -1    1   -3    0.5348   -0.6141    0.5303   -0.6130    0.0046    1    0.1630    0.1248
   12   -1    3    3   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.1307    0.0984
   13    0   -2   -3    0.1745    0.0142    0.1990   -0.0092    0.0338    1    0.1051    0.0927
   14   -1   -1   -5    0.5310   -0.1498    0.5293   -0.1451    0.0050    1    0.1959    0.1473
   15   -1    3    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1143    0.0881
   16    0   -2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0814    0.0679
   17   -1   -1   -3    0.7317   -0.0805    0.7293   -0.0807    0.0024    1    0.1515    0.1198
   18   -2    0   -4    1.0632   -0.5123    1.0696   -0.4972    0.0164    1    0.3345    0.2483
   19    0   -4   -2    0.0452    0.0302    0.0442    0.0295    0.0013    1    0.1270    0.0994
   20   -1   -3   -3    0.4465    0.1663    0.4423    0.1634    0.0051    1    0.1558    0.1178
   21    0    2    0   -0.0328   -0.0555   -0.0341   -0.0579    0.0028    1    0.0567    0.0568
   22   -1   -3   -1    0.2998    0.3363    0.3053    0.3413    0.0075    1    0.1183    0.0899
   23   -1   -3    1    0.0353    0.2749    0.0347    0.2716    0.0033    1    0.1057    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7222   -0.0467   -0.7310   -0.0567    0.0133    1          0.0692          0.0702
    2    0    6   -2   -0.0285   -0.1430   -0.0130   -0.1762    0.0366    1          0.1366          0.0995
    3   -1   -3    3   -0.0284    0.0881   -0.0262    0.0895    0.0026    1          0.0969          0.0967
    4   -1    3   -1   -0.1987   -0.5922   -0.1957   -0.5833    0.0094    1          0.1053          0.1078
    5    0    2   -2    0.0571   -0.2233    0.0560   -0.2234    0.0012    1          0.0636          0.0654
    6   -1   -1    3   -0.1090    0.1146   -0.1085    0.1216    0.0070    1          0.0773          0.0778
    7   -1    3   -3    0.1214   -0.5981    0.1201   -0.5973    0.0014    1          0.1345          0.1302
    8    0    2   -4    0.1408   -0.2197    0.1454   -0.2240    0.0063    1          0.1028          0.1017
    9   -1    1    3   -0.1935    0.0440   -0.1952    0.0486    0.0049    1          0.0784          0.0726
   10    0    0   -2    0.2193   -0.1317    0.2251   -0.1274    0.0072    1          0.0461          0.0467
   11   -1    1   -3    0.5311   -0.6155    0.5303   -0.6130    0.0026    1          0.1292          0.1248
   12   -1    3    3   -0.1807   -0.0417   -0.1829   -0.0381    0.0042    1          0.0995          0.0984
   13    0   -2   -4    0.1955   -0.0179    0.1990   -0.0092    0.0094    1          0.1000          0.0927
   14   -1   -1   -5    0.5242   -0.1589    0.5293   -0.1451    0.0147    1          0.1520          0.1473
   15   -1    3    1   -0.3387   -0.2374   -0.3362   -0.2357    0.0030    1          0.0878          0.0881
   16    0   -2   -2    0.1278    0.0268    0.1275    0.0362    0.0093    1          0.0614          0.0679
   17   -1   -1   -3    0.7283   -0.0931    0.7293   -0.0807    0.0125    1          0.1196          0.1198
   18   -2    0   -5    0.8568   -0.4409    1.0696   -0.4972    0.2201    0          0.2536          0.2483
   19    0   -6   -2    0.0156    0.0054    0.0442    0.0295    0.0374    1          0.1338          0.0994
   20   -1   -3   -3    0.4502    0.1556    0.4423    0.1634    0.0111    1          0.1201          0.1178
   21    0    2    0   -0.0308   -0.0611   -0.0341   -0.0579    0.0046    1          0.0423          0.0568
   22   -1   -3   -1    0.3045    0.3339    0.3053    0.3413    0.0074    1          0.0910          0.0899
   23   -1   -3    1    0.0333    0.2726    0.0347    0.2716    0.0017    1          0.0805          0.0816

###            No.74                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5862    1.5904    0.7928   90.1870   89.9755   90.1575      0.3820
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5548    1.6178    0.7951   90.0000   90.0000   90.0000      0.3324         1.9554    2.0347    4.6775    4.8672    2.3921
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0677    0.0110    0.0000    0.0000    0.0000      0.0270         0.0270    0.0799    0.3795    0.4444    0.1969
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6013   -0.1705    0.0828)
 a2 = (    0.1141   -0.1135    0.6078)
 a3 = (   -0.2987    1.1923    0.2830)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6129   -0.1790    0.0776) (    0.0013    0.0036    0.0033)
 a2 = (    0.1086   -0.1127    0.5980) (    0.0078    0.0076    0.0241)
 a3 = (   -0.3110    1.1860    0.2799) (    0.0085    0.0159    0.0099)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.1099   77.1393 -165.3058    0.3102    0.3889    0.3246
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0002   -0.0084   -0.0316      0.0022    0.0023    0.0418

# Number of computed bands
            179            185
# Figure of merit at the beginning and the end of the refinement
         3.2721         3.2631
# Chi-squares at the beginning and the end of the refinement
    1.8487    1.1074
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7293   -0.0581   -0.7310   -0.0567    0.0023    1    0.0897    0.0702
    2   -2    0    3   -0.0136   -0.1734   -0.0130   -0.1762    0.0029    1    0.1351    0.0995
    3    0    2   -3   -0.0262    0.0886   -0.0262    0.0895    0.0008    1    0.1321    0.0967
    4   -2    2    2   -0.1941   -0.5820   -0.1957   -0.5833    0.0020    1    0.1399    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0872    0.0654
    6   -2    2   -2   -0.1059    0.1185   -0.1085    0.1216    0.0040    1    0.1038    0.0778
    7    0    2    3    0.1182   -0.5928    0.1201   -0.5973    0.0049    1    0.1795    0.1302
    8    2    0    3    0.1432   -0.2208    0.1454   -0.2240    0.0039    1    0.1402    0.1017
    9   -4    2   -1   -0.1929    0.0485   -0.1952    0.0486    0.0023    1    0.1053    0.0726
   10    2    0    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0625    0.0467
   11    1    1    1    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0841    0.1248
   12   -3    1    0   -0.1796   -0.0373   -0.1829   -0.0381    0.0033    1    0.0676    0.0984
   13    4    0    1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.0972    0.0927
   14    3    1    1    0.5299   -0.1512    0.5293   -0.1451    0.0061    1    0.1011    0.1473
   15   -4    2    1   -0.3338   -0.2356   -0.3362   -0.2357    0.0024    1    0.1184    0.0881
   16    4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0843    0.0679
   17    4    2    1    0.7297   -0.0835    0.7293   -0.0807    0.0028    1    0.1566    0.1198
   18    2    2    1    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1710    0.2483
   19    6    0   -1    0.0446    0.0299    0.0442    0.0295    0.0006    1    0.1315    0.0994
   20    3    1    0    0.4458    0.1649    0.4423    0.1634    0.0037    1    0.0803    0.1178
   21   -2    0    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0588    0.0568
   22    4    2   -1    0.2988    0.3344    0.3053    0.3413    0.0095    1    0.1219    0.0899
   23    1    1   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0544    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7379   -0.0594   -0.7310   -0.0567    0.0074    1          0.0748          0.0702
    2   -2    0    3   -0.0136   -0.1709   -0.0130   -0.1762    0.0053    1          0.1137          0.0995
    3    0    2   -3   -0.0272    0.0973   -0.0262    0.0895    0.0079    1          0.1108          0.0967
    4   -2    2    2   -0.1953   -0.5868   -0.1957   -0.5833    0.0035    1          0.1169          0.1078
    5    0    0    2    0.0596   -0.2194    0.0560   -0.2234    0.0054    1          0.0732          0.0654
    6   -2    2   -2   -0.1106    0.1281   -0.1085    0.1216    0.0069    1          0.0875          0.0778
    7    0    2    3    0.1292   -0.5939    0.1201   -0.5973    0.0097    1          0.1493          0.1302
    8    2    0    3    0.1486   -0.2120    0.1454   -0.2240    0.0124    1          0.1177          0.1017
    9   -4    2   -1   -0.1990    0.0548   -0.1952    0.0486    0.0073    1          0.0897          0.0726
   10    2    0    1    0.2262   -0.1135    0.2251   -0.1274    0.0139    1          0.0528          0.0467
   11    2    2    2    0.5486   -0.5935    0.5303   -0.6130    0.0267    1          0.1387          0.1248
   12   -6    2    0   -0.1848   -0.0318   -0.1829   -0.0381    0.0065    1          0.1160          0.0984
   13    4    0    1    0.2141   -0.0280    0.1990   -0.0092    0.0242    1          0.0828          0.0927
   14    6    2    2    0.5250   -0.1296    0.5293   -0.1451    0.0162    1          0.1690          0.1473
   15   -4    2    1   -0.3388   -0.2324   -0.3362   -0.2357    0.0042    1          0.1004          0.0881
   16    4    0    0    0.1202    0.0436    0.1275    0.0362    0.0104    1          0.0722          0.0679
   17    4    2    1    0.7172   -0.0605    0.7293   -0.0807    0.0236    1          0.1286          0.1198
   18    4    4    2    1.0550   -0.4735    1.0696   -0.4972    0.0278    1          0.2752          0.2483
   19    6    0   -1    0.0391    0.0348    0.0442    0.0295    0.0073    1          0.1126          0.0994
   20    6    2    0    0.4340    0.1715    0.4423    0.1634    0.0116    1          0.1350          0.1178
   21   -2    0    1   -0.0367   -0.0532   -0.0341   -0.0579    0.0053    1          0.0500          0.0568
   22    4    2   -1    0.2957    0.3357    0.3053    0.3413    0.0111    1          0.1021          0.0899
   23    2    2   -2    0.0353    0.2800    0.0347    0.2716    0.0084    1          0.0914          0.0816

###            No.75                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9806    2.0819    0.9798   90.6437   89.9994   90.4213      0.2787
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9656    2.1418    0.9670   90.0000   90.0000   90.0000      0.2576         0.9985    2.2147    3.7491    8.3154    3.7546
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0839    0.0137    0.0000    0.0000    0.0000      0.0206         0.0142    0.0832    0.3004    0.7415    0.3055
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5167   -0.8766   -0.0684)
 a2 = (    0.0817   -0.0886    0.4650)
 a3 = (   -0.8599    0.4868    0.2556)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5279   -0.8881   -0.0706) (    0.0054    0.0033    0.0048)
 a2 = (    0.0846   -0.0862    0.4510) (    0.0059    0.0056    0.0169)
 a3 = (   -0.8696    0.4964    0.2580) (    0.0132    0.0082    0.0085)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -4.0356   75.5510 -119.7206    0.2787    0.4279    0.3489
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0024   -0.0028   -0.0371      0.0025    0.0022    0.0402

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         3.0437         3.1840
# Chi-squares at the beginning and the end of the refinement
    1.0922    0.4679
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    3   -1   -0.7405   -0.0567   -0.7310   -0.0567    0.0095    1    0.0753    0.0702
    2   -4    0    2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1127    0.0995
    3    1    3   -4   -0.0492    0.0480   -0.0262    0.0895    0.0474    1    0.1068    0.0967
    4   -3    3    1   -0.1928   -0.5877   -0.1957   -0.5833    0.0053    1    0.1169    0.1078
    5   -2    0    2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0728    0.0654
    6    1    3   -3   -0.1068    0.1204   -0.1085    0.1216    0.0020    1    0.0866    0.0778
    7   -3    3    3    0.1218   -0.5939    0.1201   -0.5973    0.0038    1    0.1499    0.1302
    8   -2    0    4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1170    0.1017
    9   -1    3   -3   -0.1958    0.0498   -0.1952    0.0486    0.0013    1    0.0877    0.0726
   10    0    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0522    0.0467
   11   -1    3    3    0.5338   -0.6082    0.5303   -0.6130    0.0059    1    0.1407    0.1248
   12   -3    3   -3   -0.1827   -0.0377   -0.1829   -0.0381    0.0003    1    0.1127    0.0984
   13    2    0    4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1137    0.0927
   14    1    3    4    0.6045   -0.1311    0.5293   -0.1451    0.0765    0    0.1482    0.1473
   15   -3    3   -1   -0.3377   -0.2388   -0.3362   -0.2357    0.0034    1    0.0988    0.0881
   16    2    0    2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0703    0.0679
   17    1    3    3    0.7252   -0.0809    0.7293   -0.0807    0.0042    1    0.1305    0.1198
   18    0    6    4    1.0505   -0.5043    1.0696   -0.4972    0.0204    1    0.2855    0.2483
   19    3   -1    3    0.0215    0.0055    0.0442    0.0295    0.0330    1    0.1043    0.0994
   20    3    3    3    0.4432    0.1637    0.4423    0.1634    0.0009    1    0.1344    0.1178
   21   -2    0    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0491    0.0568
   22    3    3    1    0.2983    0.3319    0.3053    0.3413    0.0117    1    0.1019    0.0899
   23    3    3   -1    0.0357    0.2715    0.0347    0.2716    0.0011    1    0.0911    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    3   -1   -0.7248   -0.0559   -0.7310   -0.0567    0.0062    1          0.0645          0.0702
    2   -4    0    2   -0.0124   -0.1781   -0.0130   -0.1762    0.0020    1          0.1018          0.0995
    3    1    3   -4   -0.0390    0.0433   -0.0262    0.0895    0.0479    1          0.0960          0.0967
    4   -3    3    1   -0.1931   -0.5833   -0.1957   -0.5833    0.0026    1          0.1029          0.1078
    5   -2    0    2    0.0597   -0.2292    0.0560   -0.2234    0.0069    1          0.0657          0.0654
    6    1    3   -3   -0.0969    0.1149   -0.1085    0.1216    0.0134    1          0.0774          0.0778
    7   -3    3    3    0.1210   -0.5964    0.1201   -0.5973    0.0013    1          0.1325          0.1302
    8   -2    0    4    0.1496   -0.2258    0.1454   -0.2240    0.0046    1          0.1055          0.1017
    9   -1    3   -3   -0.1843    0.0501   -0.1952    0.0486    0.0110    1          0.0785          0.0726
   10    0    0    2    0.2345   -0.1297    0.2251   -0.1274    0.0096    1          0.0470          0.0467
   11   -1    3    3    0.5343   -0.6141    0.5303   -0.6130    0.0042    1          0.1228          0.1248
   12   -3    3   -3   -0.1745   -0.0337   -0.1829   -0.0381    0.0094    1          0.1013          0.0984
   13    2    0    4    0.2057   -0.0066    0.1990   -0.0092    0.0072    1          0.1025          0.0927
   14    1    3    4    0.6116   -0.1334    0.5293   -0.1451    0.0831    0          0.1305          0.1473
   15   -3    3   -1   -0.3319   -0.2330   -0.3362   -0.2357    0.0051    1          0.0878          0.0881
   16    2    0    2    0.1314    0.0389    0.1275    0.0362    0.0048    1          0.0634          0.0679
   17    1    3    3    0.7319   -0.0839    0.7293   -0.0807    0.0041    1          0.1140          0.1198
   18    0    6    4    1.0510   -0.5157    1.0696   -0.4972    0.0262    1          0.2431          0.2483
   19    3   -1    3    0.0277    0.0093    0.0442    0.0295    0.0261    1          0.0942          0.0994
   20    3    3    3    0.4477    0.1649    0.4423    0.1634    0.0056    1          0.1189          0.1178
   21   -2    0    0   -0.0338   -0.0581   -0.0341   -0.0579    0.0004    1          0.0443          0.0568
   22    3    3    1    0.3000    0.3311    0.3053    0.3413    0.0115    1          0.0898          0.0899
   23    3    3   -1    0.0378    0.2659    0.0347    0.2716    0.0065    1          0.0809          0.0816

###            No.76                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5718    1.6187    0.7865   90.0220   90.0365   91.9203      0.6101
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5476    1.6607    0.7782   90.0000   90.0000   90.0000      0.3848         1.9887    2.1340    4.0222    4.3161    2.0225
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0956    0.0118    0.0000    0.0000    0.0000      0.0420         0.0301    0.1192    0.4395    0.5330    0.2231
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6071    0.1722   -0.0836)
 a2 = (   -0.0943    0.1178   -0.5994)
 a3 = (   -0.3011    1.2023    0.2832)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6167    0.1750   -0.0811) (    0.0014    0.0042    0.0040)
 a2 = (   -0.1076    0.1094   -0.5823) (    0.0096    0.0090    0.0326)
 a3 = (   -0.3072    1.2148    0.2851) (    0.0095    0.0180    0.0115)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -172.6054   77.1829 -165.8070    0.3726    0.4422    0.3838
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0007   -0.0078   -0.0673      0.0028    0.0044    0.0590

# Number of computed bands
            400            182
# Figure of merit at the beginning and the end of the refinement
         1.6478         3.0376
# Chi-squares at the beginning and the end of the refinement
    8.8449    0.8243
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    2    0    2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1525    0.0995
    3   -1   -1   -2   -0.0014    0.0433   -0.0262    0.0895    0.0524    1    0.1420    0.0967
    4    1   -1    1   -0.1838   -0.5772   -0.1957   -0.5833    0.0133    1    0.1106    0.1078
    5    0    0    1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0701    0.0654
    6    1   -1   -1   -0.1004    0.1150   -0.1085    0.1216    0.0104    1    0.0827    0.0778
    7    0   -2    3    0.1233   -0.5815    0.1201   -0.5973    0.0162    1    0.2870    0.1302
    8   -2    0    2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1601    0.1017
    9    3   -1    0   -0.1744   -0.0363   -0.1952    0.0486    0.0874    1    0.1076    0.0726
   10   -2    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.1007    0.0467
   11   -1   -1    1    0.5262   -0.5897    0.5303   -0.6130    0.0237    1    0.1329    0.1248
   12    3   -1    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -4    0    1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1569    0.0927
   14   -3   -1    1    0.5182   -0.1451    0.5293   -0.1451    0.0111    1    0.1621    0.1473
   15    4   -2    1   -0.3279   -0.2344   -0.3362   -0.2357    0.0084    1    0.1878    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -4   -2    1    0.7064   -0.0772    0.7293   -0.0807    0.0232    1    0.2490    0.1198
   18   -2   -2    1    1.0190   -0.4779    1.0696   -0.4972    0.0542    0    0.2636    0.2483
   19   -4    0   -1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1496    0.0994
   20   -3   -1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    2    0    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0948    0.0568
   22   -4   -2   -1    0.2927    0.3211    0.3053    0.3413    0.0239    0    0.1964    0.0899
   23   -1   -1   -1    0.0373    0.2627    0.0347    0.2716    0.0093    1    0.0875    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7318   -0.0585   -0.7310   -0.0567    0.0020    1          0.0804          0.0702
    2    2    0    2   -0.0325   -0.1415   -0.0130   -0.1762    0.0398    1          0.0906          0.0995
    3    0   -2   -3   -0.0224    0.0864   -0.0262    0.0895    0.0048    1          0.1255          0.0967
    4    1   -1    1   -0.1923   -0.5848   -0.1957   -0.5833    0.0037    1          0.0645          0.1078
    5    0    0    1    0.0603   -0.2276    0.0560   -0.2234    0.0061    1          0.0417          0.0654
    6    1   -1   -1   -0.0991    0.1189   -0.1085    0.1216    0.0098    1          0.0490          0.0778
    7    0   -2    3    0.1252   -0.5959    0.1201   -0.5973    0.0053    1          0.1666          0.1302
    8   -2    0    2    0.1873   -0.2022    0.1454   -0.2240    0.0472    1          0.0949          0.1017
    9    4   -2   -1   -0.1862    0.0537   -0.1952    0.0486    0.0103    1          0.0997          0.0726
   10   -2    0    1    0.2363   -0.1245    0.2251   -0.1274    0.0116    1          0.0598          0.0467
   11   -1   -1    1    0.5401   -0.6070    0.5303   -0.6130    0.0115    1          0.0763          0.1248
   12    3   -1    0   -0.1761   -0.0298   -0.1829   -0.0381    0.0107    1          0.0644          0.0984
   13   -4    0    1    0.2274   -0.0343    0.1990   -0.0092    0.0380    1          0.0932          0.0927
   14   -3   -1    1    0.5361   -0.1438    0.5293   -0.1451    0.0069    1          0.0943          0.1473
   15    4   -2    1   -0.3342   -0.2314   -0.3362   -0.2357    0.0048    1          0.1109          0.0881
   16   -2    0    0    0.1306    0.0446    0.1275    0.0362    0.0090    1          0.0405          0.0679
   17   -4   -2    1    0.7309   -0.0767    0.7293   -0.0807    0.0043    1          0.1425          0.1198
   18   -2   -2    1    1.0495   -0.5033    1.0696   -0.4972    0.0210    1          0.1481          0.2483
   19   -4    0   -1    0.0116    0.0174    0.0442    0.0295    0.0348    1          0.0891          0.0994
   20   -3   -1    0    0.4472    0.1703    0.4423    0.1634    0.0084    1          0.0750          0.1178
   21    2    0    1   -0.0360   -0.0543   -0.0341   -0.0579    0.0041    1          0.0565          0.0568
   22   -4   -2   -1    0.3005    0.3368    0.3053    0.3413    0.0066    1          0.1134          0.0899
   23   -1   -1   -1    0.0363    0.2723    0.0347    0.2716    0.0018    1          0.0511          0.0816

###            No.77                ###
# Bravais type
 Orthorhombic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5727    1.6196    0.7856   90.0755   89.9735   91.9204      0.6105
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5476    1.6607    0.7782   90.0000   90.0000   90.0000      0.3848         1.9887    2.1340    4.0222    4.3161    2.0225
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0956    0.0118    0.0000    0.0000    0.0000      0.0420         0.0301    0.1192    0.4395    0.5330    0.2231
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6068   -0.1721    0.0836)
 a2 = (    0.0942   -0.1178    0.5991)
 a3 = (   -0.3014    1.2032    0.2856)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6167   -0.1750    0.0811) (    0.0014    0.0042    0.0040)
 a2 = (    0.1076   -0.1094    0.5823) (    0.0096    0.0090    0.0326)
 a3 = (   -0.3072    1.2148    0.2851) (    0.0095    0.0180    0.0115)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.3946   77.1829 -165.8070    0.3726    0.4422    0.3838
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0007   -0.0078   -0.0673      0.0028    0.0044    0.0590

# Number of computed bands
            400            183
# Figure of merit at the beginning and the end of the refinement
         1.6421         3.0320
# Chi-squares at the beginning and the end of the refinement
    8.8709    0.8243
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -2    0    2   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1528    0.0995
    3    1    1   -2   -0.0014    0.0413   -0.0262    0.0895    0.0542    1    0.1422    0.0967
    4   -1    1    1   -0.1839   -0.5786   -0.1957   -0.5833    0.0128    1    0.1109    0.1078
    5    0    0    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0703    0.0654
    6   -1    1   -1   -0.0991    0.1136   -0.1085    0.1216    0.0123    1    0.0828    0.0778
    7    0    2    3    0.1236   -0.5828    0.1201   -0.5973    0.0149    1    0.2880    0.1302
    8    2    0    2    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1605    0.1017
    9   -3    1    0   -0.1744   -0.0363   -0.1952    0.0486    0.0874    1    0.1076    0.0726
   10    2    0    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.1008    0.0467
   11    1    1    1    0.5266   -0.5909    0.5303   -0.6130    0.0224    1    0.1333    0.1248
   12   -3    1    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    4    0    1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1571    0.0927
   14    3    1    1    0.5191   -0.1457    0.5293   -0.1451    0.0102    1    0.1624    0.1473
   15   -4    2    1   -0.3285   -0.2351   -0.3362   -0.2357    0.0078    1    0.1880    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    4    2    1    0.7073   -0.0778    0.7293   -0.0807    0.0223    1    0.2494    0.1198
   18    2    2    1    1.0194   -0.4792    1.0696   -0.4972    0.0533    0    0.2642    0.2483
   19    4    0   -1    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1497    0.0994
   20    3    1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -2    0    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0949    0.0568
   22    4    2   -1    0.2918    0.3204    0.3053    0.3413    0.0249    0    0.1962    0.0899
   23    1    1   -1    0.0369    0.2607    0.0347    0.2716    0.0112    1    0.0875    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7318   -0.0585   -0.7310   -0.0567    0.0020    1          0.0804          0.0702
    2   -2    0    2   -0.0325   -0.1415   -0.0130   -0.1762    0.0398    1          0.0906          0.0995
    3    0    2   -3   -0.0224    0.0864   -0.0262    0.0895    0.0048    1          0.1255          0.0967
    4   -1    1    1   -0.1923   -0.5848   -0.1957   -0.5833    0.0037    1          0.0645          0.1078
    5    0    0    1    0.0603   -0.2276    0.0560   -0.2234    0.0061    1          0.0417          0.0654
    6   -1    1   -1   -0.0991    0.1189   -0.1085    0.1216    0.0098    1          0.0490          0.0778
    7    0    2    3    0.1252   -0.5959    0.1201   -0.5973    0.0053    1          0.1666          0.1302
    8    2    0    2    0.1873   -0.2022    0.1454   -0.2240    0.0472    1          0.0949          0.1017
    9   -4    2   -1   -0.1862    0.0537   -0.1952    0.0486    0.0103    1          0.0997          0.0726
   10    2    0    1    0.2363   -0.1245    0.2251   -0.1274    0.0116    1          0.0598          0.0467
   11    1    1    1    0.5401   -0.6070    0.5303   -0.6130    0.0115    1          0.0763          0.1248
   12   -3    1    0   -0.1761   -0.0298   -0.1829   -0.0381    0.0107    1          0.0644          0.0984
   13    4    0    1    0.2274   -0.0343    0.1990   -0.0092    0.0380    1          0.0932          0.0927
   14    3    1    1    0.5361   -0.1438    0.5293   -0.1451    0.0069    1          0.0943          0.1473
   15   -4    2    1   -0.3342   -0.2314   -0.3362   -0.2357    0.0048    1          0.1109          0.0881
   16    2    0    0    0.1306    0.0446    0.1275    0.0362    0.0090    1          0.0405          0.0679
   17    4    2    1    0.7309   -0.0767    0.7293   -0.0807    0.0043    1          0.1425          0.1198
   18    2    2    1    1.0495   -0.5033    1.0696   -0.4972    0.0210    1          0.1481          0.2483
   19    4    0   -1    0.0116    0.0174    0.0442    0.0295    0.0348    1          0.0891          0.0994
   20    3    1    0    0.4472    0.1703    0.4423    0.1634    0.0084    1          0.0750          0.1178
   21   -2    0    1   -0.0360   -0.0543   -0.0341   -0.0579    0.0041    1          0.0565          0.0568
   22    4    2   -1    0.3005    0.3368    0.3053    0.3413    0.0066    1          0.1134          0.0899
   23    1    1   -1    0.0363    0.2723    0.0347    0.2716    0.0018    1          0.0511          0.0816

###                                ###
### Candidates for Orthorhombic(P) ###
###                                ###

###            No.1                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9875    1.0057    1.0070   89.9624   89.9780   89.1504      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    0.9980    1.0021   90.0000   90.0000   90.0000      0.3572         0.9979    0.9959    2.7995    2.7939    2.8054
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0448    0.0422    0.0000    0.0000    0.0000      0.0245         0.0420    0.0147    0.1922    0.2292    0.2259
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2012    0.1799   -0.9761)
 a2 = (    0.9484    0.2690   -0.1306)
 a3 = (    0.2352   -0.9391   -0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1830    0.1821   -0.9661) (    0.0068    0.0061    0.0021)
 a2 = (    0.9558    0.2716   -0.1298) (    0.0439    0.0121    0.0049)
 a3 = (    0.2377   -0.9432   -0.2228) (    0.0117    0.0408    0.0066)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.6365  102.9024   14.1467    0.3437    0.4035    0.3346
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0027      0.0023    0.0023    0.0428

# Number of computed bands
            133            158
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.6277
# Chi-squares at the beginning and the end of the refinement
    3.3976    0.0245
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    0    1   -2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -1    0    3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4   -1    1   -2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0   -1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -1    1    2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7   -1    0   -3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    0   -1   -2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -1    2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -1   -1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -1    3    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    0   -2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -1   -3   -2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15   -1    2   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0   -1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -1   -2   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18   -1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    0   -2    1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -1   -3    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    0    1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -1   -2    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -1   -1    2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7315   -0.0577   -0.7310   -0.0567    0.0012    1          0.0666          0.0702
    2    0    1   -3   -0.0131   -0.1734   -0.0130   -0.1762    0.0028    1          0.0996          0.0995
    3   -1    0    3   -0.0267    0.0908   -0.0262    0.0895    0.0014    1          0.0976          0.0967
    4   -1    1   -2   -0.1958   -0.5849   -0.1957   -0.5833    0.0016    1          0.1033          0.1078
    5    0    0   -2    0.0566   -0.2230    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6   -1    1    2   -0.1080    0.1204   -0.1085    0.1216    0.0013    1          0.0769          0.0778
    7   -1    0   -3    0.1196   -0.5954    0.1201   -0.5973    0.0020    1          0.1322          0.1302
    8    0   -1   -3    0.1436   -0.2197    0.1454   -0.2240    0.0046    1          0.1033          0.1017
    9   -1    2    1   -0.1953    0.0486   -0.1952    0.0486    0.0001    1          0.0781          0.0726
   10    0   -1   -1    0.2254   -0.1269    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1   -1   -2    0.5347   -0.6135    0.5303   -0.6130    0.0044    1          0.1243          0.1248
   12   -1    3    0   -0.1814   -0.0380   -0.1829   -0.0381    0.0015    1          0.1004          0.0984
   13    0   -3   -1    0.1978   -0.0084    0.1990   -0.0092    0.0014    1          0.1008          0.0927
   14   -1   -3   -2    0.5300   -0.1494    0.5293   -0.1451    0.0043    1          0.1494          0.1473
   15   -1    2   -1   -0.3356   -0.2363   -0.3362   -0.2357    0.0008    1          0.0877          0.0881
   16    0   -2    0    0.1264    0.0355    0.1275    0.0362    0.0012    1          0.0624          0.0679
   17   -1   -2   -1    0.7301   -0.0812    0.7293   -0.0807    0.0009    1          0.1154          0.1198
   18   -2   -2   -2    1.0602   -0.5137    1.0696   -0.4972    0.0190    1          0.2535          0.2483
   19    0   -3    1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0973          0.0994
   20   -1   -3    0    0.4454    0.1650    0.4423    0.1634    0.0034    1          0.1189          0.1178
   21    0    1   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -1   -2    1    0.2999    0.3349    0.3053    0.3413    0.0084    1          0.0902          0.0899
   23   -1   -1    2    0.0352    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.2                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9996    1.0001    1.0003   89.9471   89.9533   89.9836      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9961    1.0006    1.0033   90.0000   90.0000   90.0000      0.3568         0.9928    0.9973    2.7917    2.8044    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0401    0.0139    0.0000    0.0000    0.0000      0.0274         0.0138    0.0375    0.2146    0.2431    0.2196
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9543    0.2707   -0.1297)
 a2 = (    0.1828   -0.1826    0.9659)
 a3 = (    0.2367   -0.9450   -0.2243)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9575    0.2726   -0.1297) (    0.0020    0.0057    0.0052)
 a2 = (    0.1827   -0.1825    0.9655) (    0.0125    0.0118    0.0372)
 a3 = (    0.2379   -0.9418   -0.2230) (    0.0067    0.0127    0.0076)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6177  102.9296   14.1754    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            151            159
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.5945
# Chi-squares at the beginning and the end of the refinement
    0.2932    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    1    0   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    0    1    3   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    1    1   -2   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    1    1    2   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    0    1   -3    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8   -1    0   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    2    1    1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1   -2    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    3    1    0   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13   -3    0   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -3    1   -2    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    2    1   -1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -2    1   -1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18   -2    2   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19   -3    0    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -3    1    0    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    1    0   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -2    1    1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23   -1    1    2    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    1    0   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    0    1    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1    1   -2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    1    2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    0    1   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8   -1    0   -3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    2    1    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1    0   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    1   -2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    3    1    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13   -3    0   -1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -3    1   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    2    1   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16   -2    0    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -2    1   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2    2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -3    0    1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20   -3    1    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    1    0   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -2    1    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    1    2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.3                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0042    1.0073   92.0664   90.3187   90.8309      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0033    0.9961    1.0006   90.0000   90.0000   90.0000      0.3568         1.0027    0.9955    2.8119    2.7917    2.8044
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0138    0.0377    0.0000    0.0000    0.0000      0.0268         0.0377    0.0399    0.2116    0.2136    0.2359
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2542    0.9516    0.2272)
 a2 = (   -0.9505   -0.2696    0.1309)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2379    0.9418    0.2230) (    0.0054    0.0019    0.0064)
 a2 = (   -0.9575   -0.2726    0.1297) (    0.0138    0.0062    0.0054)
 a3 = (    0.1827   -0.1825    0.9655) (    0.0120    0.0113    0.0349)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.9968   14.9737   45.0431    0.9427    0.4203    1.0491
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            400            159
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.5945
# Chi-squares at the beginning and the end of the refinement
    0.2189    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3   -1    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    0    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3    0    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    1    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -1   -2    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    2    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    3    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    2    3    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1   -2    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    2    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1    3    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1   -1    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -1    2    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    1    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    3   -1    0   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -3    0    1   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    2   -1    1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    2    0    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -2   -1    1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    3    0    1    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    3    1    0    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -1   -2    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    1    1    0    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    2    1    1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    0   -3    1   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    1    3    0    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    2    3    1    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1    2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2    2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19   -1    3    0    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    0    3    1    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    1   -1    0   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -1    2    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -2    1    1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.4                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9839    1.0078    1.0085   89.9502   89.6990   89.4065      0.4460
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0006    0.9961    1.0033   90.0000   90.0000   90.0000      0.3568         0.9973    0.9928    2.8044    2.7917    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0399    0.0378    0.0000    0.0000    0.0000      0.0226         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1750    0.1842   -0.9842)
 a2 = (   -0.9466   -0.2685    0.1286)
 a3 = (   -0.2348    0.9373    0.2225)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1827    0.1825   -0.9655) (    0.0063    0.0058    0.0019)
 a2 = (   -0.9575   -0.2726    0.1297) (    0.0392    0.0110    0.0048)
 a3 = (   -0.2379    0.9418    0.2230) (    0.0107    0.0365    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.3823   77.0704 -165.8246    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            151            159
# Figure of merit at the beginning and the end of the refinement
         4.0522         9.5945
# Chi-squares at the beginning and the end of the refinement
    0.5339    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0855    0.0702
    2    0   -1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1    0   -3   -0.0286    0.0973   -0.0262    0.0895    0.0082    1    0.1217    0.0967
    4   -1   -1    2   -0.1989   -0.5977   -0.1957   -0.5833    0.0147    1    0.1308    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1   -1   -2   -0.1139    0.1281   -0.1085    0.1216    0.0085    1    0.0959    0.0778
    7   -1    0    3    0.1217   -0.6040    0.1201   -0.5973    0.0069    1    0.1669    0.1302
    8    0    1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -1   -2   -1   -0.2058    0.0522   -0.1952    0.0486    0.0112    1    0.0973    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1    2    0.5428   -0.6218    0.5303   -0.6130    0.0152    1    0.1580    0.1248
   12   -1   -3    0   -0.1904   -0.0392   -0.1829   -0.0381    0.0076    1    0.1249    0.0984
   13    0    3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -1    3    2    0.5364   -0.1514    0.5293   -0.1451    0.0095    1    0.1879    0.1473
   15   -1   -2    1   -0.3463   -0.2437   -0.3362   -0.2357    0.0129    1    0.1101    0.0881
   16    0    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -1    2    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1463    0.1198
   18   -2    2    2    1.0771   -0.5187    1.0696   -0.4972    0.0228    1    0.3268    0.2483
   19    0    3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -1    3    0    0.4518    0.1678    0.4423    0.1634    0.0105    1    0.1493    0.1178
   21    0   -1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1    2   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1136    0.0899
   23   -1    1   -2    0.0366    0.2822    0.0347    0.2716    0.0107    1    0.1012    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -1    3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3   -1    0   -3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4   -1   -1    2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0    2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6   -1   -1   -2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7   -1    0    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0    1    3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9   -1   -2   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    1    2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12   -1   -3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0    3    1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14   -1    3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15   -1   -2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17   -1    2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18   -2    2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    3   -1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20   -1    3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22   -1    2   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23   -1    1   -2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.5                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0009    1.0016   90.0451   90.1505   90.5950      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0006    0.9961    1.0033   90.0000   90.0000   90.0000      0.3568         0.9973    0.9928    2.8044    2.7917    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0399    0.0378    0.0000    0.0000    0.0000      0.0226         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1930   -0.1785    0.9674)
 a2 = (    0.9532    0.2704   -0.1295)
 a3 = (   -0.2364    0.9438    0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1827   -0.1825    0.9655) (    0.0063    0.0058    0.0019)
 a2 = (    0.9575    0.2726   -0.1297) (    0.0392    0.0110    0.0048)
 a3 = (   -0.2379    0.9418    0.2230) (    0.0107    0.0365    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.6177   77.0704 -165.8246    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            139            159
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.5945
# Chi-squares at the beginning and the end of the refinement
    0.4181    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0    1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    1    0   -3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    1    1    2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    1    0    3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -1    2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    1    3    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1   -3    2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    1    2    1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -2    1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0   -3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    1   -3    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -2   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    1   -1   -2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0    1    3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    0   -3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1    1    2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0    2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    1   -2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1    0    3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0   -1    3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1    2   -1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1    1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -1    2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1    3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0   -3    1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1   -3    2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1    2    1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0   -2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1   -2    1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2    2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0   -3   -1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    1   -3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0    1    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1   -2   -1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1   -1   -2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.6                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9963    1.0016    1.0022   89.9524   89.8587   89.8456      0.3967
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0006    1.0033    0.9961   90.0000   90.0000   90.0000      0.3568         1.0045    1.0072    2.8044    2.8119    2.7917
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0378    0.0399    0.0000    0.0000    0.0000      0.0226         0.0402    0.0140    0.1779    0.2074    0.2094
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1809   -0.1822    0.9704)
 a2 = (    0.2364   -0.9438   -0.2241)
 a3 = (    0.9519    0.2700   -0.1293)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1827   -0.1825    0.9655) (    0.0063    0.0058    0.0019)
 a2 = (    0.2379   -0.9418   -0.2230) (    0.0107    0.0365    0.0060)
 a3 = (    0.9575    0.2726   -0.1297) (    0.0392    0.0110    0.0048)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0408   97.4234  105.8895    0.3839    0.3018    0.3441
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            147            159
# Figure of merit at the beginning and the end of the refinement
         6.6485         9.5945
# Chi-squares at the beginning and the end of the refinement
    0.1115    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7380   -0.0572   -0.7310   -0.0567    0.0070    1    0.0746    0.0702
    2    0   -3    1   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1110    0.0995
    3    1    3    0   -0.0269    0.0910   -0.0262    0.0895    0.0017    1    0.1087    0.0967
    4    1   -2    1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1    0.1156    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0717    0.0654
    6    1    2    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0856    0.0778
    7    1   -3    0    0.1189   -0.5963    0.1201   -0.5973    0.0016    1    0.1479    0.1302
    8    0   -3   -1    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1151    0.1017
    9    1    1    2   -0.1975    0.0499   -0.1952    0.0486    0.0026    1    0.0868    0.0726
   10    0   -1   -1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0513    0.0467
   11    1   -2   -1    0.5336   -0.6159    0.5303   -0.6130    0.0044    1    0.1392    0.1248
   12    1    0    3   -0.1839   -0.0380   -0.1829   -0.0381    0.0011    1    0.1115    0.0984
   13    0   -1   -3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1119    0.0927
   14    1   -2   -3    0.5309   -0.1511    0.5293   -0.1451    0.0062    1    0.1667    0.1473
   15    1   -1    2   -0.3385   -0.2384   -0.3362   -0.2357    0.0035    1    0.0978    0.0881
   16    0    0   -2    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0692    0.0679
   17    1   -1   -2    0.7323   -0.0828    0.7293   -0.0807    0.0036    1    0.1290    0.1198
   18    2   -2   -2    1.0613   -0.5180    1.0696   -0.4972    0.0224    1    0.2849    0.2483
   19    0    1   -3    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1080    0.0994
   20    1    0   -3    0.4464    0.1656    0.4423    0.1634    0.0046    1    0.1323    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0483    0.0568
   22    1    1   -2    0.2997    0.3359    0.3053    0.3413    0.0079    1    0.1004    0.0899
   23    1    2   -1    0.0349    0.2740    0.0347    0.2716    0.0024    1    0.0898    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -3    1   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    3    0   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1   -2    1   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0   -2    0    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1    2    1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1   -3    0    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0   -3   -1    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1    1    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0   -1   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1   -2   -1    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1    0    3   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0   -1   -3    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1   -2   -3    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -1    2   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    0   -2    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1   -1   -2    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2   -2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    1   -3    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0972          0.0994
   20    1    0   -3    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1    1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1    1   -2    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    2   -1    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.7                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9971    1.0008    1.0022   90.0369   90.0865   90.2460      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0006    0.9961    1.0033   90.0000   90.0000   90.0000      0.3568         0.9973    0.9928    2.8044    2.7917    2.8119
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0399    0.0378    0.0000    0.0000    0.0000      0.0226         0.0375    0.0138    0.1779    0.2094    0.2074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1813   -0.1844    0.9691)
 a2 = (   -0.9530   -0.2703    0.1313)
 a3 = (    0.2364   -0.9436   -0.2222)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1827   -0.1825    0.9655) (    0.0063    0.0058    0.0019)
 a2 = (   -0.9575   -0.2726    0.1297) (    0.0392    0.0110    0.0048)
 a3 = (    0.2379   -0.9419   -0.2230) (    0.0107    0.0365    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.3824  102.9295   14.1754    0.3150    0.3765    0.3255
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0003   -0.0036      0.0022    0.0022    0.0390

# Number of computed bands
            155            160
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.5744
# Chi-squares at the beginning and the end of the refinement
    1.7816    0.0291
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    0   -1   -3   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3    1    0    3   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    1   -1   -2   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0    0   -2    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6    1   -1    2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    1    0   -3    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    0    1   -3    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    1   -2    1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    1    1   -2    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    1   -3    0   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13    0    2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14    1    3   -2    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    1   -2   -1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    1    2   -1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    1    1   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19    0    3    1    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20    1    3    0    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    0   -1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22    1    2    1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23    1    1    2    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7307   -0.0581   -0.7310   -0.0567    0.0015    1          0.0664          0.0702
    2    0   -1   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    1    0    3   -0.0267    0.0905   -0.0262    0.0895    0.0012    1          0.0972          0.0967
    4    1   -1   -2   -0.1967   -0.5857   -0.1957   -0.5833    0.0025    1          0.1031          0.1078
    5    0    0   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    1   -1    2   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0767          0.0778
    7    1    0   -3    0.1202   -0.5968    0.1201   -0.5973    0.0005    1          0.1319          0.1302
    8    0    1   -3    0.1443   -0.2201    0.1454   -0.2240    0.0040    1          0.1030          0.1017
    9    1   -2    1   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    1   -1    0.2258   -0.1265    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    1    1   -2    0.5369   -0.6133    0.5303   -0.6130    0.0066    1          0.1241          0.1248
   12    1   -3    0   -0.1811   -0.0380   -0.1829   -0.0381    0.0018    1          0.1003          0.0984
   13    0    3   -1    0.1976   -0.0082    0.1990   -0.0092    0.0017    1          0.1007          0.0927
   14    1    3   -2    0.5300   -0.1481    0.5293   -0.1451    0.0031    1          0.1492          0.1473
   15    1   -2   -1   -0.3356   -0.2360   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0    2    0    0.1261    0.0355    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1    2   -1    0.7293   -0.0796    0.7293   -0.0807    0.0011    1          0.1151          0.1198
   18    2    2   -2    1.0615   -0.5105    1.0696   -0.4972    0.0156    1          0.2527          0.2483
   19    0    3    1    0.0441    0.0289    0.0442    0.0295    0.0006    1          0.0973          0.0994
   20    1    3    0    0.4444    0.1648    0.4423    0.1634    0.0025    1          0.1187          0.1178
   21    0   -1   -1   -0.0334   -0.0574   -0.0341   -0.0579    0.0009    1          0.0434          0.0568
   22    1    2    1    0.2997    0.3341    0.3053    0.3413    0.0092    1          0.0900          0.0899
   23    1    1    2    0.0354    0.2738    0.0347    0.2716    0.0022    1          0.0804          0.0816

###            No.9                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7964    1.1185    1.1228   90.5251   90.4131   90.4455      0.5948
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7897    1.1288    1.1219   90.0000   90.0000   90.0000      0.2848         0.7039    1.0062    2.7726    3.9632    3.9390
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0183    0.0191    0.0000    0.0000    0.0000      0.0186         0.0120    0.0186    0.1813    0.2670    0.2661
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.1976    0.3397   -0.1650)
 a2 = (   -0.0257    0.4819    0.7527)
 a3 = (    0.2718   -0.7056    0.4708)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.2083    0.3425   -0.1621) (    0.0023    0.0071    0.0054)
 a2 = (   -0.0354    0.4777    0.7453) (    0.0040    0.0102    0.0117)
 a3 = (    0.2643   -0.7109    0.4682) (    0.0075    0.0141    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -8.6500   58.3118   20.3945    0.2878    0.3921    0.4094
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0000   -0.0103      0.0021    0.0023    0.0139

# Number of computed bands
            171            295
# Figure of merit at the beginning and the end of the refinement
         2.1182         3.8970
# Chi-squares at the beginning and the end of the refinement
    5.1338    0.1578
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7285   -0.0585   -0.7310   -0.0567    0.0032    1    0.1409    0.0702
    2    1    2   -2   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1468    0.0995
    3    0   -1    2   -0.0275    0.0915   -0.0262    0.0895    0.0024    1    0.1025    0.0967
    4    1    3   -1   -0.1988   -0.5835   -0.1957   -0.5833    0.0031    1    0.2191    0.1078
    5    0    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0676    0.0654
    6    1   -1    3   -0.1089    0.1207   -0.1085    0.1216    0.0010    1    0.1622    0.0778
    7    0    2   -1    0.1156   -0.5974    0.1201   -0.5973    0.0045    1    0.1396    0.1302
    8   -1    2   -2    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1543    0.1017
    9    1    0    1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0822    0.0726
   10   -1    1   -1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0970    0.0467
   11   -1    3   -1    0.5321   -0.6234    0.5303   -0.6130    0.0106    1    0.2649    0.1248
   12    2    1    0   -0.1439   -0.0705   -0.1829   -0.0381    0.0507    1    0.1404    0.0984
   13   -2    1   -1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1510    0.0927
   14   -2    2   -1    0.4432   -0.1614    0.5293   -0.1451    0.0877    1    0.2007    0.1473
   15    1    1    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16   -1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0653    0.0679
   17   -1    1    0    0.7402   -0.0861    0.7293   -0.0807    0.0120    1    0.1222    0.1198
   18   -1    2    0    1.0701   -0.5348    1.0696   -0.4972    0.0376    1    0.2720    0.2483
   19   -2   -1    1    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1439    0.0994
   20   -3    1    1    0.4512    0.1676    0.4423    0.1634    0.0098    1    0.2512    0.1178
   21    1    1   -1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0912    0.0568
   22   -1    0    1    0.3019    0.3408    0.3053    0.3413    0.0035    1    0.0947    0.0899
   23   -1   -1    3    0.0336    0.2766    0.0347    0.2716    0.0050    1    0.1697    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7340   -0.0559   -0.7310   -0.0567    0.0031    1          0.0662          0.0702
    2    1    3   -3   -0.0127   -0.1719   -0.0130   -0.1762    0.0043    1          0.0992          0.0995
    3    1   -2    4   -0.0290    0.0442   -0.0262    0.0895    0.0453    1          0.1016          0.0967
    4    1    3   -1   -0.1965   -0.5859   -0.1957   -0.5833    0.0027    1          0.1025          0.1078
    5    0    2   -2    0.0567   -0.2214    0.0560   -0.2234    0.0021    1          0.0640          0.0654
    6    1   -1    3   -0.1092    0.1226   -0.1085    0.1216    0.0013    1          0.0768          0.0778
    7    0    4   -2    0.1208   -0.5958    0.1201   -0.5973    0.0017    1          0.1310          0.1302
    8   -1    3   -3    0.1435   -0.2181    0.1454   -0.2240    0.0062    1          0.1028          0.1017
    9    2    0    2   -0.1968    0.0494   -0.1952    0.0486    0.0018    1          0.0781          0.0726
   10   -1    1   -1    0.2246   -0.1255    0.2251   -0.1274    0.0020    1          0.0460          0.0467
   11   -1    3   -1    0.5373   -0.6120    0.5303   -0.6130    0.0071    1          0.1230          0.1248
   12    3    1    1   -0.1820   -0.0377   -0.1829   -0.0381    0.0009    1          0.1003          0.0984
   13   -3    1   -1    0.1970   -0.0081    0.1990   -0.0092    0.0022    1          0.1007          0.0927
   14   -3    3   -1    0.5295   -0.1477    0.5293   -0.1451    0.0026    1          0.1484          0.1473
   15    2    2    0   -0.3365   -0.2359   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16   -2    0    0    0.1263    0.0355    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -2    2    0    0.7293   -0.0792    0.7293   -0.0807    0.0015    1          0.1144          0.1198
   18   -2    4    0    1.0625   -0.5086    1.0696   -0.4972    0.0135    1          0.2499          0.2483
   19   -3   -1    1    0.0449    0.0293    0.0442    0.0295    0.0008    1          0.0973          0.0994
   20   -3    1    1    0.4453    0.1650    0.4423    0.1634    0.0033    1          0.1184          0.1178
   21    1    1   -1   -0.0324   -0.0561   -0.0341   -0.0579    0.0025    1          0.0434          0.0568
   22   -2    0    2    0.3013    0.3353    0.3053    0.3413    0.0072    1          0.0900          0.0899
   23   -1   -1    3    0.0365    0.2765    0.0347    0.2716    0.0051    1          0.0805          0.0816

###            No.10                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7925    1.1212    1.1255   90.5251   90.1662   90.1315      0.5719
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7897    1.1288    1.1219   90.0000   90.0000   90.0000      0.2848         0.7039    1.0062    2.7726    3.9632    3.9390
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0183    0.0191    0.0000    0.0000    0.0000      0.0186         0.0120    0.0186    0.1813    0.2670    0.2661
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.2034    0.3413   -0.1658)
 a2 = (    0.0342   -0.4783   -0.7521)
 a3 = (   -0.2625    0.7063   -0.4708)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.2083    0.3425   -0.1621) (    0.0023    0.0071    0.0054)
 a2 = (    0.0354   -0.4777   -0.7453) (    0.0040    0.0102    0.0117)
 a3 = (   -0.2643    0.7109   -0.4682) (    0.0075    0.0141    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -171.3500  121.6882 -159.6055    0.2878    0.3921    0.4094
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0000   -0.0103      0.0021    0.0023    0.0139

# Number of computed bands
            181            295
# Figure of merit at the beginning and the end of the refinement
         2.3105         3.8970
# Chi-squares at the beginning and the end of the refinement
    4.7724    0.1578
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7338   -0.0581   -0.7310   -0.0567    0.0031    1    0.1353    0.0702
    2    1   -2    2   -0.0313   -0.1393   -0.0130   -0.1762    0.0412    1    0.1410    0.0995
    3    0    1   -2   -0.0273    0.0922   -0.0262    0.0895    0.0030    1    0.0983    0.0967
    4    1   -3    1   -0.1977   -0.5856   -0.1957   -0.5833    0.0030    1    0.2102    0.1078
    5    0   -1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0648    0.0654
    6    1    1   -3   -0.1090    0.1214   -0.1085    0.1216    0.0006    1    0.1554    0.0778
    7    0   -2    1    0.1190   -0.5977    0.1201   -0.5973    0.0012    1    0.1340    0.1302
    8   -1   -2    2    0.1782   -0.2012    0.1454   -0.2240    0.0400    1    0.1482    0.1017
    9    1    0   -1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0788    0.0726
   10   -1   -1    1    0.2264   -0.1273    0.2251   -0.1274    0.0013    1    0.0933    0.0467
   11   -1   -3    1    0.5369   -0.6161    0.5303   -0.6130    0.0073    1    0.2543    0.1248
   12    2   -1    0   -0.1430   -0.0700   -0.1829   -0.0381    0.0511    1    0.1350    0.0984
   13   -2   -1    1    0.2191   -0.0407    0.1990   -0.0092    0.0374    1    0.1456    0.0927
   14   -2   -2    1    0.4419   -0.1582    0.5293   -0.1451    0.0884    1    0.1934    0.1473
   15    1   -1    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0887    0.0881
   16   -1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0631    0.0679
   17   -1   -1    0    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1174    0.1198
   18   -1   -2    0    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.2589    0.2483
   19   -2    1   -1    0.0134    0.0118    0.0442    0.0295    0.0355    1    0.1388    0.0994
   20   -3   -1   -1    0.4473    0.1656    0.4423    0.1634    0.0055    1    0.2426    0.1178
   21    1   -1    1   -0.0332   -0.0559   -0.0341   -0.0579    0.0022    1    0.0878    0.0568
   22   -1    0   -1    0.3021    0.3363    0.3053    0.3413    0.0059    1    0.0915    0.0899
   23   -1    1   -3    0.0359    0.2765    0.0347    0.2716    0.0050    1    0.1634    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7340   -0.0559   -0.7310   -0.0567    0.0031    1          0.0662          0.0702
    2    1   -3    3   -0.0127   -0.1719   -0.0130   -0.1762    0.0043    1          0.0992          0.0995
    3    1    2   -4   -0.0290    0.0442   -0.0262    0.0895    0.0453    1          0.1016          0.0967
    4    1   -3    1   -0.1965   -0.5859   -0.1957   -0.5833    0.0027    1          0.1025          0.1078
    5    0   -2    2    0.0567   -0.2214    0.0560   -0.2234    0.0021    1          0.0640          0.0654
    6    1    1   -3   -0.1092    0.1226   -0.1085    0.1216    0.0013    1          0.0768          0.0778
    7    0   -4    2    0.1208   -0.5958    0.1201   -0.5973    0.0017    1          0.1310          0.1302
    8   -1   -3    3    0.1435   -0.2181    0.1454   -0.2240    0.0062    1          0.1028          0.1017
    9    2    0   -2   -0.1968    0.0494   -0.1952    0.0486    0.0018    1          0.0781          0.0726
   10   -1   -1    1    0.2246   -0.1255    0.2251   -0.1274    0.0020    1          0.0460          0.0467
   11   -1   -3    1    0.5373   -0.6120    0.5303   -0.6130    0.0071    1          0.1230          0.1248
   12    3   -1   -1   -0.1820   -0.0377   -0.1829   -0.0381    0.0009    1          0.1003          0.0984
   13   -3   -1    1    0.1970   -0.0081    0.1990   -0.0092    0.0022    1          0.1007          0.0927
   14   -3   -3    1    0.5295   -0.1477    0.5293   -0.1451    0.0026    1          0.1484          0.1473
   15    2   -2    0   -0.3365   -0.2359   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16   -2    0    0    0.1263    0.0355    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -2   -2    0    0.7293   -0.0792    0.7293   -0.0807    0.0015    1          0.1144          0.1198
   18   -2   -4    0    1.0625   -0.5086    1.0696   -0.4972    0.0135    1          0.2499          0.2483
   19   -3    1   -1    0.0449    0.0293    0.0442    0.0295    0.0008    1          0.0973          0.0994
   20   -3   -1   -1    0.4453    0.1650    0.4423    0.1634    0.0033    1          0.1184          0.1178
   21    1   -1    1   -0.0324   -0.0561   -0.0341   -0.0579    0.0025    1          0.0434          0.0568
   22   -2    0   -2    0.3013    0.3353    0.3053    0.3413    0.0072    1          0.0900          0.0899
   23   -1    1   -3    0.0365    0.2765    0.0347    0.2716    0.0051    1          0.0805          0.0816

###            No.11                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7893    1.1166    1.1348   89.2690   89.9292   89.9637      0.2976
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7968    1.1163    1.1243   90.0000   90.0000   90.0000      0.2816         0.7087    0.9929    2.8289    3.9634    3.9919
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0171    0.0211    0.0000    0.0000    0.0000      0.0182         0.0133    0.0215    0.1823    0.2626    0.2680
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3000    1.1977    0.2843)
 a2 = (    0.4974    0.2871   -0.6873)
 a3 = (   -0.7086   -0.0549   -0.5211)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2992    1.1859    0.2816) (    0.0069    0.0020    0.0055)
 a2 = (    0.4896    0.2880   -0.6927) (    0.0114    0.0057    0.0098)
 a3 = (   -0.7140   -0.0549   -0.5275) (    0.0162    0.0061    0.0076)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  163.8206  126.3737  -85.6049    0.3288    0.4366    0.4488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0011      0.0023    0.0021    0.0116

# Number of computed bands
            183            183
# Figure of merit at the beginning and the end of the refinement
         3.6665         3.8038
# Chi-squares at the beginning and the end of the refinement
    0.1109    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0693    0.0702
    2    3    1   -1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1    0.1056    0.0995
    3   -3   -1   -1   -0.0249    0.0857   -0.0262    0.0895    0.0040    1    0.1032    0.0967
    4    2    0   -2   -0.1896   -0.5812   -0.1957   -0.5833    0.0065    1    0.1086    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0682    0.0654
    6   -2    0   -2   -0.1028    0.1165   -0.1085    0.1216    0.0076    1    0.0808    0.0778
    7    3   -1   -1    0.1206   -0.5886    0.1201   -0.5973    0.0087    1    0.1395    0.1302
    8    3   -1    1    0.1430   -0.2208    0.1454   -0.2240    0.0040    1    0.1096    0.1017
    9   -1    1   -3   -0.1901    0.0485   -0.1952    0.0486    0.0051    1    0.0817    0.0726
   10    1   -1    1    0.2261   -0.1285    0.2251   -0.1274    0.0014    1    0.0489    0.0467
   11    2   -2    0    0.5288   -0.6039    0.5303   -0.6130    0.0092    1    0.1307    0.1248
   12    0    2   -4   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.1051    0.0984
   13    1   -3    3    0.1994   -0.0087    0.1990   -0.0092    0.0006    1    0.1064    0.0927
   14    2   -4    2    0.5256   -0.1491    0.5293   -0.1451    0.0055    1    0.1580    0.1473
   15    1    1   -3   -0.3321   -0.2358   -0.3362   -0.2357    0.0041    1    0.0918    0.0881
   16    0   -2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0658    0.0679
   17    1   -3    1    0.7206   -0.0811    0.7293   -0.0807    0.0087    1    0.1214    0.1198
   18    2   -4    0    1.0401   -0.5008    1.0696   -0.4972    0.0297    1    0.2632    0.2483
   19   -1   -3    3    0.0445    0.0298    0.0442    0.0295    0.0004    1    0.1027    0.0994
   20    0   -4    2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.1255    0.1178
   21    1    1   -1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0460    0.0568
   22   -1   -3    1    0.2955    0.3286    0.3053    0.3413    0.0161    1    0.0951    0.0899
   23   -2   -2    0    0.0354    0.2667    0.0347    0.2716    0.0051    1    0.0851    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7334   -0.0569   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    3    1   -1   -0.0134   -0.1735   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3   -1   -1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0972          0.0967
    4    2    0   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    2    0    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6   -2    0   -2   -0.1078    0.1200   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3   -1   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    3   -1    1    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1030          0.1017
    9   -1    1   -3   -0.1949    0.0483   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    1   -1    1    0.2261   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    2   -2    0    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    0    2   -4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1   -3    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2   -4    2    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1    1   -3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0   -2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -3    1    0.7291   -0.0790    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2   -4    0    1.0612   -0.5068    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19   -1   -3    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -4    2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1   -3    1    0.2995    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23   -2   -2    0    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.12                ###
# Bravais type
 Orthorhombic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7898    1.1163    1.1344   90.7307   90.4012   90.0331      0.3914
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8045    1.1345    1.0957   90.0000   90.0000   90.0000      0.3466         0.7342    1.0354    2.3210    3.2732    3.1613
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0175    0.0198    0.0000    0.0000    0.0000      0.0232         0.0132    0.0215    0.1554    0.2249    0.2192
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3081   -1.1963   -0.2779)
 a2 = (    0.4975    0.2872   -0.6875)
 a3 = (    0.7088    0.0549    0.5213)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3076   -1.1721   -0.2772) (    0.0068    0.0020    0.0054)
 a2 = (    0.4723    0.2864   -0.6869) (    0.0112    0.0057    0.0098)
 a3 = (    0.7368    0.0670    0.5344) (    0.0160    0.0062    0.0075)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -164.0334   54.1557   95.1938    0.3264    0.4304    0.4399
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0013   -0.0081    0.0031      0.0023    0.0022    0.0117

# Number of computed bands
            179            176
# Figure of merit at the beginning and the end of the refinement
         3.1429         3.3400
# Chi-squares at the beginning and the end of the refinement
    2.0888    1.4530
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0912    0.0702
    2   -3    1    1   -0.0121   -0.1689   -0.0130   -0.1762    0.0073    1    0.1385    0.0995
    3    3   -1    1   -0.0268    0.0902   -0.0262    0.0895    0.0010    1    0.1361    0.0967
    4   -2    0    2   -0.1855   -0.5793   -0.1957   -0.5833    0.0110    1    0.1420    0.1078
    5   -1    0    0    0.0561   -0.2179    0.0560   -0.2234    0.0055    1    0.0447    0.0654
    6    1    0    1   -0.1059    0.1189   -0.1085    0.1216    0.0037    1    0.0534    0.0778
    7   -3   -1    1    0.1237   -0.5822    0.1201   -0.5973    0.0155    1    0.1825    0.1302
    8   -2   -1   -1    0.1749   -0.1967    0.1454   -0.2240    0.0401    1    0.1021    0.1017
    9    1    1    3   -0.1918    0.0487   -0.1952    0.0486    0.0034    1    0.1079    0.0726
   10   -1   -1   -1    0.2225   -0.1255    0.2251   -0.1274    0.0033    1    0.0643    0.0467
   11   -1   -1    0    0.5271   -0.5948    0.5303   -0.6130    0.0185    1    0.0852    0.1248
   12    0    1    2   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0691    0.0984
   13   -1   -2   -2    0.2166   -0.0408    0.1990   -0.0092    0.0362    1    0.1000    0.0927
   14   -1   -2   -1    0.5210   -0.1468    0.5293   -0.1451    0.0084    1    0.1034    0.1473
   15   -1    1    3   -0.3308   -0.2355   -0.3362   -0.2357    0.0054    1    0.1203    0.0881
   16    0   -2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0866    0.0679
   17   -1   -3   -1    0.7159   -0.0798    0.7293   -0.0807    0.0134    1    0.1593    0.1198
   18   -1   -2    0    1.0331   -0.4929    1.0696   -0.4972    0.0367    1    0.1709    0.2483
   19    1   -2   -2    0.0144    0.0129    0.0442    0.0295    0.0341    1    0.0950    0.0994
   20    0   -2   -1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0824    0.1178
   21   -1    1    1   -0.0316   -0.0542   -0.0341   -0.0579    0.0045    1    0.0603    0.0568
   22    1   -3   -1    0.2971    0.3316    0.3053    0.3413    0.0127    1    0.1253    0.0899
   23    1   -1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0561    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7159   -0.0571   -0.7310   -0.0567    0.0151    1          0.0830          0.0702
    2   -3    1    1   -0.0116   -0.1659   -0.0130   -0.1762    0.0104    1          0.1214          0.0995
    3    3   -1    1   -0.0287    0.1026   -0.0262    0.0895    0.0134    1          0.1190          0.0967
    4   -2    0    2   -0.2006   -0.5750   -0.1957   -0.5833    0.0097    1          0.1276          0.1078
    5   -2    0    0    0.0592   -0.2125    0.0560   -0.2234    0.0114    1          0.0782          0.0654
    6    2    0    2   -0.1145    0.1307   -0.1085    0.1216    0.0109    1          0.0948          0.0778
    7   -3   -1    1    0.1205   -0.5889    0.1201   -0.5973    0.0084    1          0.1620          0.1302
    8   -3   -1   -1    0.1451   -0.2052    0.1454   -0.2240    0.0188    1          0.1257          0.1017
    9    1    1    3   -0.2012    0.0544   -0.1952    0.0486    0.0083    1          0.0977          0.0726
   10   -1   -1   -1    0.2200   -0.1100    0.2251   -0.1274    0.0182    1          0.0564          0.0467
   11   -2   -2    0    0.5396   -0.6032    0.5303   -0.6130    0.0134    1          0.1521          0.1248
   12    0    2    4   -0.1856   -0.0323   -0.1829   -0.0381    0.0064    1          0.1258          0.0984
   13   -1   -2   -2    0.2082   -0.0273    0.1990   -0.0092    0.0203    1          0.0882          0.0927
   14   -2   -4   -2    0.5236   -0.1317    0.5293   -0.1451    0.0146    1          0.1817          0.1473
   15   -1    1    3   -0.3353   -0.2271   -0.3362   -0.2357    0.0086    1          0.1096          0.0881
   16    0   -2   -2    0.1172    0.0419    0.1275    0.0362    0.0118    1          0.0769          0.0679
   17   -1   -3   -1    0.7247   -0.0642    0.7293   -0.0807    0.0172    1          0.1403          0.1198
   18   -2   -4    0    1.0709   -0.5038    1.0696   -0.4972    0.0068    1          0.3135          0.2483
   19    1   -3   -3    0.0386    0.0332    0.0442    0.0295    0.0066    1          0.1200          0.0994
   20    0   -4   -2    0.4361    0.1735    0.4423    0.1634    0.0119    1          0.1447          0.1178
   21   -1    1    1   -0.0344   -0.0523   -0.0341   -0.0579    0.0056    1          0.0533          0.0568
   22    1   -3   -1    0.2957    0.3427    0.3053    0.3413    0.0097    1          0.1098          0.0899
   23    2   -2    0    0.0325    0.2846    0.0347    0.2716    0.0132    1          0.0982          0.0816

###                                ###
### Candidates for   Monoclinic(C) ###
###                                ###

###            No.1                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2752    1.7884    1.0830   89.0140  125.8931   91.5196      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2553    1.7896    1.0876   90.0000  125.0566   90.0000      0.4497         1.1542    1.6454    2.7917    3.9798    2.4188
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0116    0.0348    0.0229    0.0000    0.7518    0.0000      0.0306         0.0205    0.0302    0.1916    0.2815    0.1722
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9203   -0.2292    0.1947)
 a2 = (   -0.0134    0.2995    0.4723)
 a3 = (    0.3517   -0.9124    0.5858)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9256   -0.2317    0.1914) (    0.0028    0.0090    0.0052)
 a2 = (   -0.0222    0.3001    0.4708) (    0.0029    0.0071    0.0091)
 a3 = (    0.3321   -0.8976    0.5879) (    0.0131    0.0216    0.0099)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.1370   59.9075  -20.7250    0.3500    0.4700    0.5732
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0006   -0.0034      0.0021    0.0024    0.0164

# Number of computed bands
            400             79
# Figure of merit at the beginning and the end of the refinement
         8.6014        31.8758
# Chi-squares at the beginning and the end of the refinement
    0.2279    0.0225
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    1    3   -2   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    0   -2    2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    1    3   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    0    2   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    1   -1    1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    0    4   -1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -1    3   -1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    2    0    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -1    3    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    3    1   -1   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -3    1    1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -3    3    1    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    2    2   -1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16   -2    0    1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -2    2    1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    4    1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19   -3   -1    2    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20   -3    1    2    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    1    1   -1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22   -2    0    2    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -1   -1    2    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0561   -0.7310   -0.0567    0.0006    1          0.0663          0.0702
    2    1    3   -2   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0996          0.0995
    3    0   -2    2   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    3   -1   -0.1963   -0.5853   -0.1957   -0.5833    0.0021    1          0.1030          0.1078
    5    0    2   -1    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0642          0.0654
    6    1   -1    1   -0.1072    0.1195   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    0    4   -1    0.1199   -0.5962    0.1201   -0.5973    0.0012    1          0.1318          0.1302
    8   -1    3   -1    0.1436   -0.2202    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    2    0    0   -0.1949    0.0482   -0.1952    0.0486    0.0005    1          0.0780          0.0726
   10   -1    1    0    0.2254   -0.1269    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    3    0    0.5369   -0.6127    0.5303   -0.6130    0.0065    1          0.1239          0.1248
   12    3    1   -1   -0.1811   -0.0383   -0.1829   -0.0381    0.0017    1          0.1003          0.0984
   13   -3    1    1    0.1971   -0.0084    0.1990   -0.0092    0.0020    1          0.1007          0.0927
   14   -3    3    1    0.5294   -0.1476    0.5293   -0.1451    0.0025    1          0.1490          0.1473
   15    2    2   -1   -0.3355   -0.2363   -0.3362   -0.2357    0.0009    1          0.0875          0.0881
   16   -2    0    1    0.1256    0.0352    0.1275    0.0362    0.0021    1          0.0624          0.0679
   17   -2    2    1    0.7281   -0.0779    0.7293   -0.0807    0.0031    1          0.1149          0.1198
   18   -2    4    1    1.0624   -0.5067    1.0696   -0.4972    0.0119    1          0.2522          0.2483
   19   -3   -1    2    0.0437    0.0284    0.0442    0.0295    0.0012    1          0.0973          0.0994
   20   -3    1    2    0.4423    0.1650    0.4423    0.1634    0.0016    1          0.1186          0.1178
   21    1    1   -1   -0.0335   -0.0578   -0.0341   -0.0579    0.0007    1          0.0435          0.0568
   22   -2    0    2    0.2971    0.3323    0.3053    0.3413    0.0122    1          0.0901          0.0899
   23   -1   -1    2    0.0353    0.2714    0.0347    0.2716    0.0006    1          0.0806          0.0816

###            No.2                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2292    1.8061    1.0616   90.5464  121.9203   90.6976      0.4715
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2530    1.7905    1.0870   90.0000  124.9024   90.0000      0.4500         1.1528    1.6473    2.7845    3.9790    2.4155
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0169    0.0411    0.0274    0.0000    1.1085    0.0000      0.0338         0.0244    0.0318    0.2124    0.3124    0.1913
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9112   -0.2269    0.1928)
 a2 = (   -0.0133    0.2965    0.4676)
 a3 = (    0.2679   -0.8947    0.5997)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9255   -0.2317    0.1916) (    0.0030    0.0094    0.0057)
 a2 = (   -0.0222    0.3002    0.4704) (    0.0031    0.0080    0.0110)
 a3 = (    0.3286   -0.8971    0.5880) (    0.0218    0.0248    0.0121)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.1547   59.8853  -20.7410    0.3890    0.5113    0.6085
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0007    0.0006   -0.0055      0.0029    0.0024    0.0229

# Number of computed bands
            400             86
# Figure of merit at the beginning and the end of the refinement
         5.7306        30.5919
# Chi-squares at the beginning and the end of the refinement
    0.4143    0.0251
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0696    0.0702
    2    1    3   -2   -0.0217   -0.1586   -0.0130   -0.1762    0.0196    1    0.1042    0.0995
    3    0   -2    2   -0.0248    0.1051   -0.0262    0.0895    0.0157    1    0.1010    0.0967
    4    1    3   -1   -0.2154   -0.5560   -0.1957   -0.5833    0.0337    0    0.1069    0.1078
    5    0    2   -1    0.0430   -0.2170    0.0560   -0.2234    0.0145    1    0.0660    0.0654
    6    1   -1    1   -0.1129    0.1342   -0.1085    0.1216    0.0134    1    0.0786    0.0778
    7    0    4   -1    0.0920   -0.5965    0.1201   -0.5973    0.0281    0    0.1361    0.1302
    8   -1    3   -1    0.1345   -0.2219    0.1454   -0.2240    0.0111    1    0.1052    0.1017
    9    2    0    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0810    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0474    0.0467
   11   -1    3    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1296    0.1248
   12    3    1   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1065    0.0984
   13   -3    1    1    0.1970   -0.0066    0.1990   -0.0092    0.0032    1    0.1065    0.0927
   14   -3    3    1    0.5299   -0.1428    0.5293   -0.1451    0.0023    1    0.1564    0.1473
   15    2    2   -1   -0.3237   -0.2190   -0.3362   -0.2357    0.0209    1    0.0926    0.0881
   16   -2    0    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0672    0.0679
   17   -2    2    1    0.7203   -0.0693    0.7293   -0.0807    0.0146    1    0.1211    0.1198
   18   -2    4    1    1.0674   -0.4947    1.0696   -0.4972    0.0033    1    0.2656    0.2483
   19   -3   -1    2    0.0497    0.0320    0.0442    0.0295    0.0060    1    0.1059    0.0994
   20   -3    1    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1278    0.1178
   21    1    1   -1   -0.0288   -0.0441   -0.0341   -0.0579    0.0148    1    0.0468    0.0568
   22   -2    0    2    0.3044    0.3161    0.3053    0.3413    0.0253    0    0.0979    0.0899
   23   -1   -1    2    0.0544    0.2794    0.0347    0.2716    0.0212    0    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7320   -0.0562   -0.7310   -0.0567    0.0011    1          0.0662          0.0702
    2    1    3   -2   -0.0134   -0.1738   -0.0130   -0.1762    0.0024    1          0.0994          0.0995
    3    0   -2    2   -0.0259    0.0903   -0.0262    0.0895    0.0009    1          0.0973          0.0967
    4    1    3   -1   -0.1972   -0.5853   -0.1957   -0.5833    0.0025    1          0.1028          0.1078
    5    0    2   -1    0.0563   -0.2238    0.0560   -0.2234    0.0005    1          0.0641          0.0654
    6    1   -1    1   -0.1073    0.1203   -0.1085    0.1216    0.0017    1          0.0766          0.0778
    7    0    4   -1    0.1195   -0.5971    0.1201   -0.5973    0.0007    1          0.1315          0.1302
    8   -1    3   -1    0.1439   -0.2205    0.1454   -0.2240    0.0038    1          0.1029          0.1017
    9    2    0    0   -0.1951    0.0484   -0.1952    0.0486    0.0002    1          0.0779          0.0726
   10   -1    1    0    0.2257   -0.1269    0.2251   -0.1274    0.0008    1          0.0460          0.0467
   11   -1    3    0    0.5377   -0.6134    0.5303   -0.6130    0.0073    1          0.1236          0.1248
   12    3    1   -1   -0.1810   -0.0383   -0.1829   -0.0381    0.0019    1          0.1002          0.0984
   13   -3    1    1    0.1973   -0.0084    0.1990   -0.0092    0.0018    1          0.1006          0.0927
   14   -3    3    1    0.5296   -0.1475    0.5293   -0.1451    0.0024    1          0.1487          0.1473
   15    2    2   -1   -0.3355   -0.2359   -0.3362   -0.2357    0.0008    1          0.0874          0.0881
   16   -2    0    1    0.1259    0.0350    0.1275    0.0362    0.0020    1          0.0624          0.0679
   17   -2    2    1    0.7278   -0.0780    0.7293   -0.0807    0.0032    1          0.1146          0.1198
   18   -2    4    1    1.0623   -0.5060    1.0696   -0.4972    0.0114    1          0.2511          0.2483
   19   -3   -1    2    0.0441    0.0283    0.0442    0.0295    0.0012    1          0.0974          0.0994
   20   -3    1    2    0.4424    0.1642    0.4423    0.1634    0.0008    1          0.1186          0.1178
   21    1    1   -1   -0.0332   -0.0576   -0.0341   -0.0579    0.0010    1          0.0435          0.0568
   22   -2    0    2    0.2985    0.3313    0.3053    0.3413    0.0121    1          0.0900          0.0899
   23   -1   -1    2    0.0367    0.2720    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.3                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2850    1.7648    1.0790   89.1943  125.1594   91.3421      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2624    1.7813    1.0887   90.0000  125.2214   90.0000      0.4498         1.1596    1.6362    2.8065    3.9601    2.4203
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0183    0.0677    0.0385    0.0000    1.1783    0.0000      0.0309         0.0470    0.0321    0.1971    0.3111    0.1871
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4060   -0.3388   -0.7917)
 a2 = (    0.4775   -0.2703   -0.1419)
 a3 = (   -0.5744   -0.9745   -0.0732)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4278   -0.3364   -0.8025) (    0.0051    0.0191    0.0094)
 a2 = (    0.4732   -0.2675   -0.1402) (    0.0186    0.0117    0.0031)
 a3 = (   -0.5688   -0.9670   -0.0750) (    0.0239    0.0396    0.0063)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -106.7868   59.8235  -20.8523    0.4454    1.2457    0.4370
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0029      0.0024    0.0024    0.0468

# Number of computed bands
            400             78
# Figure of merit at the beginning and the end of the refinement
         5.8773        30.5839
# Chi-squares at the beginning and the end of the refinement
    0.4740    0.0200
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    0   -2   -2   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -1    3    2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -1   -1   -1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0   -2   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -1    3    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -1   -3   -1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    0   -4   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -1    3    0   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -1   -3    0    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -1    3   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    0   -4    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -1   -5    1    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1    1   -1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0   -2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1   -3    1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -2   -4    1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    0   -2    2    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -1   -3    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    0    0   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -1   -1    2    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -1    1    2    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7327   -0.0564   -0.7310   -0.0567    0.0017    1          0.0664          0.0702
    2    0   -2   -2   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0999          0.0995
    3   -1    3    2   -0.0261    0.0888   -0.0262    0.0895    0.0006    1          0.0978          0.0967
    4   -1   -1   -1   -0.1946   -0.5851   -0.1957   -0.5833    0.0021    1          0.1033          0.1078
    5    0   -2   -1    0.0563   -0.2235    0.0560   -0.2234    0.0004    1          0.0645          0.0654
    6   -1    3    1   -0.1065    0.1193   -0.1085    0.1216    0.0030    1          0.0769          0.0778
    7   -1   -3   -1    0.1196   -0.5945    0.1201   -0.5973    0.0029    1          0.1322          0.1302
    8    0   -4   -1    0.1432   -0.2203    0.1454   -0.2240    0.0043    1          0.1035          0.1017
    9   -1    3    0   -0.1947    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0   -2    0    0.2253   -0.1276    0.2251   -0.1274    0.0003    1          0.0461          0.0467
   11   -1   -3    0    0.5336   -0.6127    0.5303   -0.6130    0.0033    1          0.1242          0.1248
   12   -1    3   -1   -0.1816   -0.0380   -0.1829   -0.0381    0.0012    1          0.1001          0.0984
   13    0   -4    1    0.1977   -0.0086    0.1990   -0.0092    0.0013    1          0.1006          0.0927
   14   -1   -5    1    0.5295   -0.1495    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15   -1    1   -1   -0.3359   -0.2372   -0.3362   -0.2357    0.0016    1          0.0875          0.0881
   16    0   -2    1    0.1259    0.0355    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1   -3    1    0.7291   -0.0806    0.7293   -0.0807    0.0003    1          0.1152          0.1198
   18   -2   -4    1    1.0588   -0.5115    1.0696   -0.4972    0.0180    1          0.2527          0.2483
   19    0   -2    2    0.0435    0.0287    0.0442    0.0295    0.0011    1          0.0972          0.0994
   20   -1   -3    2    0.4437    0.1653    0.4423    0.1634    0.0023    1          0.1186          0.1178
   21    0    0   -1   -0.0338   -0.0581   -0.0341   -0.0579    0.0004    1          0.0435          0.0568
   22   -1   -1    2    0.2970    0.3334    0.3053    0.3413    0.0115    1          0.0900          0.0899
   23   -1    1    2    0.0346    0.2708    0.0347    0.2716    0.0008    1          0.0807          0.0816

###            No.4                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2752    1.7546    1.0844   89.8043  124.4796   90.1746      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2546    1.7819    1.0936   90.0000  125.1054   90.0000      0.4501         1.1472    1.6294    2.7875    3.9591    2.4298
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0126    0.0350    0.0165    0.0000    0.8158    0.0000      0.0297         0.0145    0.0281    0.1860    0.2725    0.1645
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7579    0.0724    0.5704)
 a2 = (    0.1759   -0.4562    0.2929)
 a3 = (   -0.0268    0.5989    0.9445)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7831    0.0843    0.5736) (    0.0047    0.0081    0.0061)
 a2 = (    0.1670   -0.4480    0.2938) (    0.0057    0.0102    0.0040)
 a3 = (   -0.0454    0.6006    0.9416) (    0.0122    0.0114    0.0117)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   48.3511   51.9850  139.1542    0.5167    0.5015    0.5116
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005   -0.0044      0.0023    0.0023    0.0151

# Number of computed bands
            400             87
# Figure of merit at the beginning and the end of the refinement
         8.6014        30.4972
# Chi-squares at the beginning and the end of the refinement
    0.1969    0.0227
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -1   -3    2   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    0    4   -1   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -1   -1    2   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    0   -2    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -1    3    0   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    0   -2    2    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    1   -3    1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9   -2    2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    1   -1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12   -3    1    2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    3   -1   -1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    3   -1    0    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -2    0    2   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    2    0   -1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    2    0    0    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    2    0    1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    3    1   -2    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    3    1   -1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1   -1    1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    2    2   -1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    1    3   -1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7304   -0.0557   -0.7310   -0.0567    0.0012    1          0.0662          0.0702
    2   -1   -3    2   -0.0133   -0.1742   -0.0130   -0.1762    0.0020    1          0.0994          0.0995
    3    0    4   -1   -0.0267    0.0896   -0.0262    0.0895    0.0005    1          0.0975          0.0967
    4   -1   -1    2   -0.1964   -0.5865   -0.1957   -0.5833    0.0032    1          0.1030          0.1078
    5    0   -2    1    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1    3    0   -0.1074    0.1192   -0.1085    0.1216    0.0026    1          0.0768          0.0778
    7    0   -2    2    0.1209   -0.5965    0.1201   -0.5973    0.0011    1          0.1318          0.1302
    8    1   -3    1    0.1440   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9   -2    2    1   -0.1945    0.0482   -0.1952    0.0486    0.0008    1          0.0781          0.0726
   10    1   -1    0    0.2253   -0.1267    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    1   -1    1    0.5371   -0.6115    0.5303   -0.6130    0.0069    1          0.1239          0.1248
   12   -3    1    2   -0.1810   -0.0379   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    3   -1   -1    0.1972   -0.0085    0.1990   -0.0092    0.0019    1          0.1008          0.0927
   14    3   -1    0    0.5288   -0.1478    0.5293   -0.1451    0.0027    1          0.1491          0.1473
   15   -2    0    2   -0.3361   -0.2359   -0.3362   -0.2357    0.0003    1          0.0875          0.0881
   16    2    0   -1    0.1259    0.0352    0.1275    0.0362    0.0019    1          0.0624          0.0679
   17    2    0    0    0.7275   -0.0788    0.7293   -0.0807    0.0026    1          0.1149          0.1198
   18    2    0    1    1.0605   -0.5066    1.0696   -0.4972    0.0131    1          0.2518          0.2483
   19    3    1   -2    0.0439    0.0286    0.0442    0.0295    0.0010    1          0.0973          0.0994
   20    3    1   -1    0.4432    0.1644    0.4423    0.1634    0.0013    1          0.1187          0.1178
   21   -1   -1    1   -0.0336   -0.0577   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    2    2   -1    0.2983    0.3331    0.3053    0.3413    0.0108    1          0.0900          0.0899
   23    1    3   -1    0.0349    0.2723    0.0347    0.2716    0.0007    1          0.0805          0.0816

###            No.5                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2478    1.7917    1.0790   90.5928  123.9371   91.3791      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2566    1.7851    1.0902   90.0000  125.1284   90.0000      0.4497         1.1526    1.6374    2.7945    3.9699    2.4244
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0119    0.0359    0.0236    0.0000    0.7686    0.0000      0.0316         0.0209    0.0341    0.1979    0.2899    0.1781
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9193    0.2361   -0.1829)
 a2 = (   -0.0358    0.3046    0.4668)
 a3 = (   -0.3091    0.9060   -0.5765)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9255    0.2316   -0.1914) (    0.0028    0.0091    0.0053)
 a2 = (   -0.0220    0.3016    0.4715) (    0.0030    0.0078    0.0093)
 a3 = (   -0.3329    0.8951   -0.5881) (    0.0132    0.0223    0.0099)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.1520  120.1843  159.2518    0.3538    0.5075    0.5781
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0004   -0.0025      0.0021    0.0024    0.0167

# Number of computed bands
            400             87
# Figure of merit at the beginning and the end of the refinement
         5.8773        30.4700
# Chi-squares at the beginning and the end of the refinement
    0.2453    0.0189
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -1    3    2   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    0   -2   -2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -1    3    1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0    2    1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -1   -1   -1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    0    4    1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    1    3    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -2    0    0   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    1    3    0    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -3    1    1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    3    1   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    3    3   -1    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -2    2    1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    2    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    2    2   -1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    2    4   -1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    3   -1   -2    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    3    1   -2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1    1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    2    0   -2    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    1   -1   -2    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7309   -0.0571   -0.7310   -0.0567    0.0004    1          0.0664          0.0702
    2   -1    3    2   -0.0133   -0.1742   -0.0130   -0.1762    0.0020    1          0.0997          0.0995
    3    0   -2   -2   -0.0263    0.0894   -0.0262    0.0895    0.0001    1          0.0975          0.0967
    4   -1    3    1   -0.1960   -0.5851   -0.1957   -0.5833    0.0018    1          0.1033          0.1078
    5    0    2    1    0.0565   -0.2237    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6   -1   -1   -1   -0.1071    0.1195   -0.1085    0.1216    0.0025    1          0.0768          0.0778
    7    0    4    1    0.1196   -0.5956    0.1201   -0.5973    0.0018    1          0.1322          0.1302
    8    1    3    1    0.1437   -0.2203    0.1454   -0.2240    0.0041    1          0.1033          0.1017
    9   -2    0    0   -0.1948    0.0484   -0.1952    0.0486    0.0005    1          0.0780          0.0726
   10    1    1    0    0.2254   -0.1270    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    1    3    0    0.5348   -0.6130    0.5303   -0.6130    0.0045    1          0.1242          0.1248
   12   -3    1    1   -0.1813   -0.0380   -0.1829   -0.0381    0.0015    1          0.1003          0.0984
   13    3    1   -1    0.1974   -0.0085    0.1990   -0.0092    0.0017    1          0.1008          0.0927
   14    3    3   -1    0.5293   -0.1489    0.5293   -0.1451    0.0037    1          0.1493          0.1473
   15   -2    2    1   -0.3357   -0.2363   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    2    0   -1    0.1258    0.0353    0.1275    0.0362    0.0019    1          0.0624          0.0679
   17    2    2   -1    0.7286   -0.0802    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    2    4   -1    1.0594   -0.5111    1.0696   -0.4972    0.0173    1          0.2529          0.2483
   19    3   -1   -2    0.0436    0.0286    0.0442    0.0295    0.0011    1          0.0973          0.0994
   20    3    1   -2    0.4436    0.1646    0.4423    0.1634    0.0017    1          0.1187          0.1178
   21   -1    1    1   -0.0337   -0.0579   -0.0341   -0.0579    0.0004    1          0.0435          0.0568
   22    2    0   -2    0.2981    0.3331    0.3053    0.3413    0.0109    1          0.0901          0.0899
   23    1   -1   -2    0.0351    0.2718    0.0347    0.2716    0.0004    1          0.0806          0.0816

###            No.6                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7364    1.2643    1.2292   88.0831  132.1368   91.3732      0.4715
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7813    1.2612    1.2533   90.0000  134.7412   90.0000      0.4488         1.4212    1.0063    3.9688    2.8101    2.7925
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0266    0.0517    0.0269    0.0000    0.8641    0.0000      0.0372         0.0194    0.0479    0.3343    0.2598    0.2391
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1473    0.7439    0.1677)
 a2 = (   -0.1207    0.1509   -0.7674)
 a3 = (   -0.9245    0.5234    0.2748)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1881    0.7469    0.1773) (    0.0120    0.0037    0.0065)
 a2 = (   -0.1443    0.1454   -0.7660) (    0.0114    0.0102    0.0300)
 a3 = (   -0.9494    0.5312    0.2797) (    0.0175    0.0071    0.0098)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  166.9302   82.6295  -74.1582    0.4930    0.3665    0.9502
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0006    0.0004   -0.0035      0.0031    0.0023    0.0464

# Number of computed bands
            400             87
# Figure of merit at the beginning and the end of the refinement
         5.7306        30.4408
# Chi-squares at the beginning and the end of the refinement
    1.4335    0.0270
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0696    0.0702
    2    4    0   -1   -0.0217   -0.1586   -0.0130   -0.1762    0.0196    1    0.1042    0.0995
    3   -3   -1    0   -0.0248    0.1051   -0.0262    0.0895    0.0157    1    0.1010    0.0967
    4    3   -1   -1   -0.2154   -0.5560   -0.1957   -0.5833    0.0337    0    0.1069    0.1078
    5    2    0    0    0.0430   -0.2170    0.0560   -0.2234    0.0145    1    0.0660    0.0654
    6   -1   -1   -1   -0.1129    0.1342   -0.1085    0.1216    0.0134    1    0.0786    0.0778
    7    3   -1    0    0.0920   -0.5965    0.1201   -0.5973    0.0281    0    0.1361    0.1302
    8    2    0    1    0.1345   -0.2219    0.1454   -0.2240    0.0111    1    0.1052    0.1017
    9    1   -1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0810    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0474    0.0467
   11    1   -1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1296    0.1248
   12    3   -1   -3   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1065    0.0984
   13   -2    0    3    0.1970   -0.0066    0.1990   -0.0092    0.0032    1    0.1065    0.0927
   14   -1   -1    3    0.5299   -0.1428    0.5293   -0.1451    0.0023    1    0.1564    0.1473
   15    3   -1   -2   -0.3237   -0.2190   -0.3362   -0.2357    0.0209    1    0.0926    0.0881
   16   -2    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0672    0.0679
   17   -1   -1    2    0.7203   -0.0693    0.7293   -0.0807    0.0146    1    0.1211    0.1198
   18    0   -2    2    1.0674   -0.4947    1.0696   -0.4972    0.0033    1    0.2656    0.2483
   19   -4    0    3    0.0497    0.0320    0.0442    0.0295    0.0060    1    0.1059    0.0994
   20   -3   -1    3    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1278    0.1178
   21    2    0   -1   -0.0288   -0.0441   -0.0341   -0.0579    0.0148    1    0.0468    0.0568
   22   -3   -1    2    0.3044    0.3161    0.3053    0.3413    0.0253    0    0.0979    0.0899
   23   -3   -1    1    0.0544    0.2794    0.0347    0.2716    0.0212    0    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7303   -0.0571   -0.7310   -0.0567    0.0008    1          0.0663          0.0702
    2    4    0   -1   -0.0134   -0.1746   -0.0130   -0.1762    0.0016    1          0.0991          0.0995
    3   -3   -1    0   -0.0263    0.0901   -0.0262    0.0895    0.0007    1          0.0970          0.0967
    4    3   -1   -1   -0.1978   -0.5864   -0.1957   -0.5833    0.0037    1          0.1030          0.1078
    5    2    0    0    0.0570   -0.2243    0.0560   -0.2234    0.0014    1          0.0640          0.0654
    6   -1   -1   -1   -0.1077    0.1199   -0.1085    0.1216    0.0018    1          0.0765          0.0778
    7    3   -1    0    0.1204   -0.5979    0.1201   -0.5973    0.0006    1          0.1317          0.1302
    8    2    0    1    0.1446   -0.2204    0.1454   -0.2240    0.0037    1          0.1028          0.1017
    9    1   -1   -2   -0.1950    0.0482   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10    0    0    1    0.2257   -0.1263    0.2251   -0.1274    0.0013    1          0.0460          0.0467
   11    1   -1    1    0.5377   -0.6128    0.5303   -0.6130    0.0073    1          0.1238          0.1248
   12    3   -1   -3   -0.1812   -0.0379   -0.1829   -0.0381    0.0016    1          0.1003          0.0984
   13   -2    0    3    0.1970   -0.0083    0.1990   -0.0092    0.0022    1          0.1007          0.0927
   14   -1   -1    3    0.5290   -0.1477    0.5293   -0.1451    0.0026    1          0.1489          0.1473
   15    3   -1   -2   -0.3362   -0.2356   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -2    0    2    0.1256    0.0350    0.1275    0.0362    0.0022    1          0.0624          0.0679
   17   -1   -1    2    0.7275   -0.0793    0.7293   -0.0807    0.0024    1          0.1148          0.1198
   18    0   -2    2    1.0605   -0.5082    1.0696   -0.4972    0.0143    1          0.2518          0.2483
   19   -4    0    3    0.0438    0.0283    0.0442    0.0295    0.0013    1          0.0972          0.0994
   20   -3   -1    3    0.4432    0.1636    0.4423    0.1634    0.0009    1          0.1185          0.1178
   21    2    0   -1   -0.0337   -0.0580   -0.0341   -0.0579    0.0004    1          0.0433          0.0568
   22   -3   -1    2    0.2997    0.3323    0.3053    0.3413    0.0106    1          0.0898          0.0899
   23   -3   -1    1    0.0361    0.2730    0.0347    0.2716    0.0020    1          0.0802          0.0816

###            No.7                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7678    1.2539    1.2515   91.0908  133.8470   89.9213      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7825    1.2597    1.2643   90.0000  135.2104   90.0000      0.4479         1.4099    0.9964    3.9796    2.8124    2.8226
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0197    0.0519    0.0185    0.0000    0.6295    0.0000      0.0352         0.0131    0.0381    0.3158    0.2496    0.2256
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7445    0.2270   -0.0982)
 a2 = (    0.1625   -0.1567    0.7651)
 a3 = (    0.9338   -0.5286   -0.2776)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7595    0.2160   -0.1027) (    0.0020    0.0067    0.0046)
 a2 = (    0.1451   -0.1457    0.7667) (    0.0103    0.0098    0.0304)
 a3 = (    0.9485   -0.5312   -0.2804) (    0.0079    0.0110    0.0092)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6021  102.9822   14.1593    0.3433    0.4045    0.5039
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0004   -0.0002      0.0023    0.0022    0.0401

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         8.6014        30.4150
# Chi-squares at the beginning and the end of the refinement
    0.5304    0.0239
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    4    0   -3   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3   -3    1    3   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    3    1   -2   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    2    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -1    1    2   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    3    1   -3    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    2    0   -3    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    1    1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    1    1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    3    1    0   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -2    0   -1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -1    1   -2    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    3    1   -1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16   -2    0    0    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1    1   -1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    0    2   -2    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19   -4    0    1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20   -3    1    0    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    2    0   -1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22   -3    1    1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -3    1    2    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7295   -0.0571   -0.7310   -0.0567    0.0016    1          0.0664          0.0702
    2    4    0   -3   -0.0133   -0.1745   -0.0130   -0.1762    0.0017    1          0.0993          0.0995
    3   -3    1    3   -0.0265    0.0895   -0.0262    0.0895    0.0003    1          0.0972          0.0967
    4    3    1   -2   -0.1967   -0.5858   -0.1957   -0.5833    0.0027    1          0.1032          0.1078
    5    2    0   -2    0.0569   -0.2240    0.0560   -0.2234    0.0011    1          0.0641          0.0654
    6   -1    1    2   -0.1074    0.1193   -0.1085    0.1216    0.0025    1          0.0767          0.0778
    7    3    1   -3    0.1204   -0.5966    0.1201   -0.5973    0.0008    1          0.1321          0.1302
    8    2    0   -3    0.1442   -0.2201    0.1454   -0.2240    0.0040    1          0.1031          0.1017
    9    1    1    1   -0.1947    0.0481   -0.1952    0.0486    0.0007    1          0.0780          0.0726
   10    0    0   -1    0.2254   -0.1264    0.2251   -0.1274    0.0011    1          0.0461          0.0467
   11    1    1   -2    0.5365   -0.6122    0.5303   -0.6130    0.0062    1          0.1243          0.1248
   12    3    1    0   -0.1812   -0.0380   -0.1829   -0.0381    0.0017    1          0.1003          0.0984
   13   -2    0   -1    0.1969   -0.0083    0.1990   -0.0092    0.0022    1          0.1007          0.0927
   14   -1    1   -2    0.5288   -0.1478    0.5293   -0.1451    0.0027    1          0.1492          0.1473
   15    3    1   -1   -0.3358   -0.2359   -0.3362   -0.2357    0.0004    1          0.0876          0.0881
   16   -2    0    0    0.1254    0.0352    0.1275    0.0362    0.0023    1          0.0623          0.0679
   17   -1    1   -1    0.7276   -0.0792    0.7293   -0.0807    0.0023    1          0.1152          0.1198
   18    0    2   -2    1.0600   -0.5087    1.0696   -0.4972    0.0150    1          0.2531          0.2483
   19   -4    0    1    0.0434    0.0284    0.0442    0.0295    0.0014    1          0.0971          0.0994
   20   -3    1    0    0.4429    0.1643    0.4423    0.1634    0.0010    1          0.1186          0.1178
   21    2    0   -1   -0.0339   -0.0581   -0.0341   -0.0579    0.0003    1          0.0434          0.0568
   22   -3    1    1    0.2983    0.3328    0.3053    0.3413    0.0111    1          0.0899          0.0899
   23   -3    1    2    0.0350    0.2721    0.0347    0.2716    0.0006    1          0.0803          0.0816

###            No.8                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2515    1.7733    1.0830   90.7449  123.6671   90.0974      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2639    1.7860    1.0875   90.0000  125.4431   90.0000      0.4463         1.1623    1.6423    2.8324    4.0022    2.4370
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0152    0.0336    0.0188    0.0000    0.9656    0.0000      0.0290         0.0138    0.0386    0.1873    0.2709    0.1640
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4803   -0.5638   -0.6110)
 a2 = (   -0.4535   -0.0351   -0.3335)
 a3 = (    0.5820    0.3837   -0.8633)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4967   -0.5653   -0.6139) (    0.0057    0.0069    0.0048)
 a2 = (   -0.4494   -0.0340   -0.3323) (    0.0104    0.0043    0.0044)
 a3 = (    0.6171    0.3646   -0.8719) (    0.0121    0.0167    0.0087)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -133.1922  119.8821  159.2604    0.4279    0.5311    0.5443
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0031      0.0024    0.0023    0.0125

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         8.6014        30.0852
# Chi-squares at the beginning and the end of the refinement
    0.1757    0.0217
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -3   -1    2   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    3   -1   -2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -2   -2    1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -2    0    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    2   -2   -1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -3   -1    1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -3    1    1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    1   -3    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -2    0    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    0   -4    1   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -1    3   -1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -2    2   -1    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1   -3    1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0    2   -1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17   -1    1   -1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18   -2    0   -1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1    3   -2    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    0    2   -2    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1   -1    1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    1    1   -2    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    2    0   -2    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7328   -0.0561   -0.7310   -0.0567    0.0019    1          0.0665          0.0702
    2   -3   -1    2   -0.0135   -0.1739   -0.0130   -0.1762    0.0023    1          0.0993          0.0995
    3    3   -1   -2   -0.0264    0.0893   -0.0262    0.0895    0.0003    1          0.0972          0.0967
    4   -2   -2    1   -0.1955   -0.5860   -0.1957   -0.5833    0.0027    1          0.1032          0.1078
    5   -2    0    1    0.0563   -0.2238    0.0560   -0.2234    0.0005    1          0.0641          0.0654
    6    2   -2   -1   -0.1070    0.1193   -0.1085    0.1216    0.0027    1          0.0765          0.0778
    7   -3   -1    1    0.1206   -0.5960    0.1201   -0.5973    0.0014    1          0.1322          0.1302
    8   -3    1    1    0.1437   -0.2206    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    1   -3    0   -0.1945    0.0483   -0.1952    0.0486    0.0008    1          0.0777          0.0726
   10   -1    1    0    0.2257   -0.1273    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11   -2    0    0    0.5370   -0.6115    0.5303   -0.6130    0.0068    1          0.1246          0.1248
   12    0   -4    1   -0.1809   -0.0381   -0.1829   -0.0381    0.0020    1          0.0999          0.0984
   13   -1    3   -1    0.1978   -0.0085    0.1990   -0.0092    0.0013    1          0.1005          0.0927
   14   -2    2   -1    0.5293   -0.1478    0.5293   -0.1451    0.0027    1          0.1494          0.1473
   15   -1   -3    1   -0.3356   -0.2366   -0.3362   -0.2357    0.0010    1          0.0873          0.0881
   16    0    2   -1    0.1262    0.0354    0.1275    0.0362    0.0015    1          0.0622          0.0679
   17   -1    1   -1    0.7275   -0.0781    0.7293   -0.0807    0.0032    1          0.1155          0.1198
   18   -2    0   -1    1.0601   -0.5047    1.0696   -0.4972    0.0121    1          0.2541          0.2483
   19    1    3   -2    0.0440    0.0288    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    0    2   -2    0.4427    0.1648    0.4423    0.1634    0.0015    1          0.1188          0.1178
   21   -1   -1    1   -0.0335   -0.0575   -0.0341   -0.0579    0.0007    1          0.0433          0.0568
   22    1    1   -2    0.2975    0.3322    0.3053    0.3413    0.0120    1          0.0902          0.0899
   23    2    0   -2    0.0354    0.2714    0.0347    0.2716    0.0007    1          0.0805          0.0816

###            No.9                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2480    1.7609    1.1036   91.3815  124.4133   90.0142      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2629    1.7764    1.0928   90.0000  125.3344   90.0000      0.4475         1.1556    1.6255    2.8218    3.9692    2.4418
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0116    0.0351    0.0181    0.0000    0.7418    0.0000      0.0305         0.0185    0.0400    0.1937    0.2812    0.1710
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2514   -0.7918   -0.5034)
 a2 = (   -0.3230   -0.1827    0.4302)
 a3 = (   -0.8835   -0.0685   -0.6497)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2622   -0.7829   -0.5103) (    0.0104    0.0048    0.0050)
 a2 = (   -0.3074   -0.1810    0.4355) (    0.0098    0.0050    0.0066)
 a3 = (   -0.9009   -0.0694   -0.6646) (    0.0201    0.0111    0.0074)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -34.1983  110.7070 -122.0249    0.4165    0.6448    0.5412
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0004    0.0020      0.0024    0.0022    0.0141

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.9567
# Chi-squares at the beginning and the end of the refinement
    0.3495    0.0188
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -3   -1    1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    3    1   -2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4   -2    0    0   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5   -2    0    1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    2    0   -2   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7   -3    1    1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8   -3    1    2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    1   -1   -2   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -2    2    1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    0   -2   -2   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -1    3    2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -2    4    2    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1   -1   -1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0    2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1    3    1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -2    4    1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    1    3    1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    0    4    1    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1   -1    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    1    3    0    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    2    2   -1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7317   -0.0568   -0.7310   -0.0567    0.0006    1          0.0666          0.0702
    2   -3   -1    1   -0.0134   -0.1741   -0.0130   -0.1762    0.0021    1          0.0996          0.0995
    3    3    1   -2   -0.0263    0.0893   -0.0262    0.0895    0.0002    1          0.0974          0.0967
    4   -2    0    0   -0.1956   -0.5853   -0.1957   -0.5833    0.0020    1          0.1035          0.1078
    5   -2    0    1    0.0564   -0.2237    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6    2    0   -2   -0.1070    0.1194   -0.1085    0.1216    0.0026    1          0.0767          0.0778
    7   -3    1    1    0.1198   -0.5955    0.1201   -0.5973    0.0018    1          0.1324          0.1302
    8   -3    1    2    0.1436   -0.2204    0.1454   -0.2240    0.0040    1          0.1033          0.1017
    9    1   -1   -2   -0.1947    0.0485   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    1    1    0.2255   -0.1272    0.2251   -0.1274    0.0004    1          0.0461          0.0467
   11   -2    2    1    0.5350   -0.6125    0.5303   -0.6130    0.0047    1          0.1247          0.1248
   12    0   -2   -2   -0.1812   -0.0380   -0.1829   -0.0381    0.0017    1          0.1001          0.0984
   13   -1    3    2    0.1976   -0.0085    0.1990   -0.0092    0.0015    1          0.1007          0.0927
   14   -2    4    2    0.5292   -0.1488    0.5293   -0.1451    0.0037    1          0.1496          0.1473
   15   -1   -1   -1   -0.3357   -0.2365   -0.3362   -0.2357    0.0009    1          0.0876          0.0881
   16    0    2    1    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17   -1    3    1    0.7283   -0.0800    0.7293   -0.0807    0.0013    1          0.1156          0.1198
   18   -2    4    1    1.0589   -0.5098    1.0696   -0.4972    0.0165    1          0.2543          0.2483
   19    1    3    1    0.0438    0.0287    0.0442    0.0295    0.0009    1          0.0971          0.0994
   20    0    4    1    0.4435    0.1646    0.4423    0.1634    0.0017    1          0.1189          0.1178
   21   -1   -1    0   -0.0337   -0.0578   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    1    3    0    0.2980    0.3330    0.3053    0.3413    0.0111    1          0.0902          0.0899
   23    2    2   -1    0.0351    0.2717    0.0347    0.2716    0.0004    1          0.0806          0.0816

###            No.10                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2606    1.7805    1.0908   90.1369  125.2223   89.9110      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2538    1.7902    1.0889   90.0000  125.0864   90.0000      0.4427         1.1514    1.6440    2.8319    4.0435    2.4596
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0147    0.0298    0.0181    0.0000    0.9558    0.0000      0.0288         0.0145    0.0308    0.1871    0.2714    0.1651
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5890    0.6618   -0.3975)
 a2 = (    0.0207   -0.3025   -0.4728)
 a3 = (   -0.3353    0.8942   -0.5893)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5932    0.6638   -0.3969) (    0.0086    0.0072    0.0045)
 a2 = (    0.0219   -0.3008   -0.4702) (    0.0027    0.0073    0.0070)
 a3 = (   -0.3352    0.8951   -0.5882) (    0.0173    0.0129    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -154.1833  110.7585 -122.0547    0.3174    0.4856    0.5787
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0074      0.0021    0.0024    0.0151

# Number of computed bands
            175             87
# Figure of merit at the beginning and the end of the refinement
         3.4923        29.9550
# Chi-squares at the beginning and the end of the refinement
    0.4945    0.0470
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2    1   -3    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3    0    2   -2   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4    2   -6    0   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5    0   -2    1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6    1    1   -2   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7    0   -4    1    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8   -1   -3    2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9    2    0   -2   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1   -3    1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12    3   -1   -2   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13   -3   -1    2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14   -3   -3    2    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15    2   -2   -1   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16   -4    0    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17   -4   -4    2    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18   -2   -4    1    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19   -5    1    2    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20   -3   -1    1    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21    2   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22   -2    0    0    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23   -1    1   -1    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7305   -0.0565   -0.7310   -0.0567    0.0005    1          0.0649          0.0702
    2    1   -3    1   -0.0132   -0.1736   -0.0130   -0.1762    0.0026    1          0.0975          0.0995
    3    0    2   -2   -0.0269    0.0908   -0.0262    0.0895    0.0015    1          0.0956          0.0967
    4    1   -3    0   -0.1969   -0.5862   -0.1957   -0.5833    0.0031    1          0.1008          0.1078
    5    0   -2    1    0.0568   -0.2233    0.0560   -0.2234    0.0008    1          0.0629          0.0654
    6    1    1   -2   -0.1082    0.1200   -0.1085    0.1216    0.0016    1          0.0754          0.0778
    7    0   -4    1    0.1206   -0.5969    0.1201   -0.5973    0.0006    1          0.1290          0.1302
    8   -1   -3    2    0.1441   -0.2198    0.1454   -0.2240    0.0044    1          0.1011          0.1017
    9    2    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0005    1          0.0766          0.0726
   10   -1   -1    1    0.2255   -0.1265    0.2251   -0.1274    0.0010    1          0.0452          0.0467
   11   -1   -3    1    0.5376   -0.6130    0.5303   -0.6130    0.0072    1          0.1212          0.1248
   12    3   -1   -2   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.0985          0.0984
   13   -3   -1    2    0.1975   -0.0084    0.1990   -0.0092    0.0016    1          0.0989          0.0927
   14   -3   -3    2    0.5299   -0.1480    0.5293   -0.1451    0.0030    1          0.1461          0.1473
   15    2   -2   -1   -0.3359   -0.2358   -0.3362   -0.2357    0.0003    1          0.0858          0.0881
   16   -2    0    1    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0613          0.0679
   17   -2   -2    1    0.7294   -0.0792    0.7293   -0.0807    0.0015    1          0.1126          0.1198
   18   -2   -4    1    1.0629   -0.5092    1.0696   -0.4972    0.0138    1          0.2465          0.2483
   19   -3    1    1    0.0444    0.0289    0.0442    0.0295    0.0007    1          0.0955          0.0994
   20   -3   -1    1    0.4446    0.1649    0.4423    0.1634    0.0027    1          0.1163          0.1178
   21    1   -1    0   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0426          0.0568
   22   -2    0    0    0.2997    0.3344    0.3053    0.3413    0.0089    1          0.0883          0.0899
   23   -1    1   -1    0.0352    0.2740    0.0347    0.2716    0.0024    1          0.0790          0.0816

###            No.12                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2480    1.8209    1.0790   91.3643  125.3162   90.0174      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2630    1.7828    1.0900   90.0000  125.4235   90.0000      0.4476         1.1587    1.6355    2.8217    3.9830    2.4353
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0162    0.0376    0.0202    0.0000    1.0362    0.0000      0.0302         0.0160    0.0425    0.1938    0.2816    0.1704
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5133    0.5749    0.6087)
 a2 = (   -0.4417   -0.0342   -0.3249)
 a3 = (   -0.6460   -0.3653    0.8604)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4959    0.5672    0.6135) (    0.0070    0.0083    0.0051)
 a2 = (   -0.4506   -0.0345   -0.3323) (    0.0120    0.0046    0.0045)
 a3 = (   -0.6146   -0.3617    0.8711) (    0.0148    0.0181    0.0091)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  133.1735   59.9733  -20.7646    0.4640    0.6724    0.5478
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0004    0.0019      0.0024    0.0023    0.0140

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.9490
# Chi-squares at the beginning and the end of the refinement
    0.2774    0.0188
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    3   -1   -2   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -3   -1    2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    2   -2   -1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    2    0   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -2   -2    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    3   -1   -1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    3    1   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -1   -3    0   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    2    0    0    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    0   -4   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    1    3    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    2    2    1    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    1   -3   -1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0    2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    1    1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    2    0    1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19   -1    3    2    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    0    2    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    1   -1   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -1    1    2    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -2    0    2    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7315   -0.0565   -0.7310   -0.0567    0.0005    1          0.0666          0.0702
    2    3   -1   -2   -0.0134   -0.1741   -0.0130   -0.1762    0.0021    1          0.0995          0.0995
    3   -3   -1    2   -0.0264    0.0894   -0.0262    0.0895    0.0003    1          0.0974          0.0967
    4    2   -2   -1   -0.1957   -0.5855   -0.1957   -0.5833    0.0022    1          0.1034          0.1078
    5    2    0   -1    0.0565   -0.2236    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6   -2   -2    1   -0.1071    0.1194   -0.1085    0.1216    0.0026    1          0.0767          0.0778
    7    3   -1   -1    0.1201   -0.5955    0.1201   -0.5973    0.0018    1          0.1324          0.1302
    8    3    1   -1    0.1436   -0.2203    0.1454   -0.2240    0.0041    1          0.1033          0.1017
    9   -1   -3    0   -0.1946    0.0485   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10    1    1    0    0.2254   -0.1272    0.2251   -0.1274    0.0004    1          0.0461          0.0467
   11    2    0    0    0.5351   -0.6123    0.5303   -0.6130    0.0048    1          0.1247          0.1248
   12    0   -4   -1   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1001          0.0984
   13    1    3    1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1          0.1007          0.0927
   14    2    2    1    0.5291   -0.1488    0.5293   -0.1451    0.0037    1          0.1496          0.1473
   15    1   -3   -1   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    0    2    1    0.1260    0.0353    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    1    1    1    0.7282   -0.0801    0.7293   -0.0807    0.0013    1          0.1156          0.1198
   18    2    0    1    1.0588   -0.5096    1.0696   -0.4972    0.0165    1          0.2543          0.2483
   19   -1    3    2    0.0438    0.0287    0.0442    0.0295    0.0009    1          0.0971          0.0994
   20    0    2    2    0.4437    0.1646    0.4423    0.1634    0.0018    1          0.1189          0.1178
   21    1   -1   -1   -0.0337   -0.0578   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22   -1    1    2    0.2982    0.3331    0.3053    0.3413    0.0108    1          0.0902          0.0899
   23   -2    0    2    0.0350    0.2719    0.0347    0.2716    0.0004    1          0.0805          0.0816

###            No.13                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7776    1.2624    1.2572   90.1350  134.8519   90.0011      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7847    1.2649    1.2572   90.0000  135.1946   90.0000      0.4469         1.4195    1.0061    3.9932    2.8302    2.8130
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0361    0.0186    0.0545    0.0000    1.1515    0.0000      0.0356         0.0403    0.0396    0.3284    0.2294    0.2552
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7568    0.2147   -0.1042)
 a2 = (    0.1894   -0.7479   -0.1794)
 a3 = (    0.6078    0.3591   -0.8721)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7581    0.2160   -0.1041) (    0.0017    0.0045    0.0062)
 a2 = (    0.1884   -0.7470   -0.1774) (    0.0053    0.0107    0.0066)
 a3 = (    0.6167    0.3629   -0.8729) (    0.0146    0.0138    0.0373)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -149.7413  164.9419 -134.7046    1.2724    0.5088    1.3488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0015      0.0023    0.0024    0.0424

# Number of computed bands
             79             89
# Figure of merit at the beginning and the end of the refinement
         4.7313        29.9067
# Chi-squares at the beginning and the end of the refinement
    0.4783    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0   -1   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2    1   -3    0   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    1    3   -1   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4    2   -2   -1   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5    0   -2    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2    2   -1   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7    1   -3   -1    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8   -1   -3    0    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    3    1   -1   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10   -1   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    0   -2   -1    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12    4    0   -1   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13   -3   -1    0    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -2   -2   -1    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15    3   -1   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1   -1   -1    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18    0   -2   -2    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19   -3    1    0    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -2    0   -1    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1    1   -1    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23    0    2   -1    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0   -1   -0.7334   -0.0568   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    1   -3    0   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1    3   -1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    2   -2   -1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0   -2    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    2    2   -1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    1   -3   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -1   -3    0    0.1439   -0.2204    0.1454   -0.2240    0.0039    1          0.1029          0.1017
    9    3    1   -1   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10   -1   -1    0    0.2260   -0.1272    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    0   -2   -1    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1245          0.1248
   12    4    0   -1   -0.1808   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3   -1    0    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1005          0.0927
   14   -2   -2   -1    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    3   -1   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16   -2    0    0    0.1270    0.0356    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17   -1   -1   -1    0.7291   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    0   -2   -2    1.0613   -0.5068    1.0696   -0.4972    0.0127    1          0.2542          0.2483
   19   -3    1    0    0.0448    0.0293    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20   -2    0   -1    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    1   -1    0.2994    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    0    2   -1    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.14                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2620    1.8082    1.0749   91.2348  125.3237   90.5912      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2633    1.7784    1.0910   90.0000  125.3123   90.0000      0.4490         1.1580    1.6301    2.8136    3.9609    2.4298
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0115    0.0347    0.0176    0.0000    0.7375    0.0000      0.0300         0.0181    0.0389    0.1895    0.2754    0.1668
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2593    0.7816    0.5157)
 a2 = (   -0.2865   -0.1758    0.4396)
 a3 = (    0.9173    0.0711    0.6746)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2627    0.7828    0.5092) (    0.0103    0.0047    0.0048)
 a2 = (   -0.3065   -0.1805    0.4355) (    0.0096    0.0050    0.0066)
 a3 = (    0.9032    0.0694    0.6643) (    0.0195    0.0111    0.0073)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   34.1263   69.3388   57.9991    0.3951    0.6381    0.5227
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0004   -0.0010      0.0023    0.0022    0.0131

# Number of computed bands
            400             86
# Figure of merit at the beginning and the end of the refinement
         7.5123        29.8884
# Chi-squares at the beginning and the end of the refinement
    0.3941    0.0242
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    3   -1   -1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -3    1    2   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    2    0    0   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    2    0   -1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -2    0    2   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    3    1   -1    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    3    1   -2    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9   -1   -1    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    2    2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    0   -2    2   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    1    3   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    2    4   -2    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    1   -1    1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0    2   -1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    1    3   -1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    2    4   -1    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19   -1    3   -1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    0    4   -1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    1   -1    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -1    3    0    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -2    2    1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7316   -0.0567   -0.7310   -0.0567    0.0006    1          0.0666          0.0702
    2    3   -1   -1   -0.0131   -0.1735   -0.0130   -0.1762    0.0027    1          0.0995          0.0995
    3   -3    1    2   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0975          0.0967
    4    2    0    0   -0.1961   -0.5857   -0.1957   -0.5833    0.0024    1          0.1033          0.1078
    5    2    0   -1    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -2    0    2   -0.1078    0.1201   -0.1085    0.1216    0.0016    1          0.0768          0.0778
    7    3    1   -1    0.1200   -0.5960    0.1201   -0.5973    0.0013    1          0.1322          0.1302
    8    3    1   -2    0.1437   -0.2200    0.1454   -0.2240    0.0044    1          0.1032          0.1017
    9   -1   -1    2   -0.1951    0.0485   -0.1952    0.0486    0.0002    1          0.0780          0.0726
   10    1    1   -1    0.2255   -0.1271    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    2    2   -1    0.5356   -0.6138    0.5303   -0.6130    0.0054    1          0.1245          0.1248
   12    0   -2    2   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1002          0.0984
   13    1    3   -2    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1007          0.0927
   14    2    4   -2    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1495          0.1473
   15    1   -1    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16    0    2   -1    0.1267    0.0355    0.1275    0.0362    0.0010    1          0.0623          0.0679
   17    1    3   -1    0.7305   -0.0809    0.7293   -0.0807    0.0012    1          0.1155          0.1198
   18    2    4   -1    1.0616   -0.5127    1.0696   -0.4972    0.0175    1          0.2542          0.2483
   19   -1    3   -1    0.0445    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    0    4   -1    0.4456    0.1651    0.4423    0.1634    0.0037    1          0.1189          0.1178
   21    1   -1    0   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0434          0.0568
   22   -1    3    0    0.2998    0.3351    0.3053    0.3413    0.0083    1          0.0902          0.0899
   23   -2    2    1    0.0351    0.2738    0.0347    0.2716    0.0022    1          0.0806          0.0816

###            No.15                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7722    1.2621    1.2578   90.0519  134.6894   90.0601      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7718    1.2650    1.2570   90.0000  134.7707   90.0000      0.4467         1.4096    1.0064    3.9661    2.8317    2.8137
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0502    0.0186    0.0544    0.0000    1.6371    0.0000      0.0356         0.0285    0.0396    0.3354    0.2295    0.2552
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7570   -0.2147    0.1043)
 a2 = (   -0.1895    0.7481    0.1794)
 a3 = (   -0.8976   -0.0653   -0.6639)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7580   -0.2159    0.1041) (    0.0017    0.0045    0.0062)
 a2 = (   -0.1884    0.7469    0.1774) (    0.0053    0.0107    0.0066)
 a3 = (   -0.8994   -0.0690   -0.6649) (    0.0144    0.0125    0.0290)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   30.2637  164.9379 -134.6993    1.2724    0.5087    1.3488
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0018      0.0023    0.0024    0.0424

# Number of computed bands
             91             89
# Figure of merit at the beginning and the end of the refinement
         7.8810        29.8527
# Chi-squares at the beginning and the end of the refinement
    0.1669    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2   -1    3    0   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3    1   -3   -1   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4    0    2   -1   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5    0    2    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6    0   -2   -1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7    1    3   -1    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8    1    3    0    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9   -1   -1   -1   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10    1    1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11    2    2   -1    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12   -2    0   -1   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13    3    1    0    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14    4    2   -1    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15   -1    1   -1   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17    3    1   -1    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18    4    2   -2    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19    3   -1    0    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20    4    0   -1    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22    3   -1   -1    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23    2   -2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7334   -0.0568   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1    3    0   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -3   -1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    0    2   -1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    2    0    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    0   -2   -1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    1    3   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1    3    0    0.1438   -0.2204    0.1454   -0.2240    0.0039    1          0.1029          0.1017
    9   -1   -1   -1   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    1    1    0    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    2    2   -1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -2    0   -1   -0.1808   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3    1    0    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1005          0.0927
   14    4    2   -1    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1    1   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2    0    0    0.1270    0.0356    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    3    1   -1    0.7291   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    4    2   -2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19    3   -1    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    4    0   -1    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    3   -1   -1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23    2   -2   -1    0.0356    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.16                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7796    1.2602    1.2595   90.0492  134.9220   90.0264      0.4144
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7717    1.2650    1.2569   90.0000  134.7677   90.0000      0.4467         1.4096    1.0065    3.9659    2.8317    2.8135
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0502    0.0186    0.0544    0.0000    1.6370    0.0000      0.0356         0.0285    0.0396    0.3353    0.2294    0.2551
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7569    0.2152   -0.1027)
 a2 = (   -0.1879    0.7501    0.1781)
 a3 = (    0.9005    0.0698    0.6645)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7580    0.2159   -0.1041) (    0.0017    0.0045    0.0062)
 a2 = (   -0.1884    0.7469    0.1774) (    0.0053    0.0107    0.0066)
 a3 = (    0.8994    0.0689    0.6649) (    0.0144    0.0125    0.0290)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -30.2665   15.0628   45.3038    1.2725    0.5087    1.3489
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0019      0.0023    0.0024    0.0424

# Number of computed bands
             75             89
# Figure of merit at the beginning and the end of the refinement
        16.2101        29.8421
# Chi-squares at the beginning and the end of the refinement
    0.0581    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0615    0.0702
    2    1    3    0   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0922    0.0995
    3   -1   -3    1   -0.0264    0.0894   -0.0262    0.0895    0.0002    1    0.0902    0.0967
    4    0    2    1   -0.1954   -0.5847   -0.1957   -0.5833    0.0014    1    0.0956    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0595    0.0654
    6    0   -2    1   -0.1071    0.1200   -0.1085    0.1216    0.0021    1    0.0709    0.0778
    7   -1    3    1    0.1187   -0.5946    0.1201   -0.5973    0.0031    1    0.1224    0.1302
    8   -1    3    0    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0955    0.1017
    9    1   -1    1   -0.1955    0.0493   -0.1952    0.0486    0.0007    1    0.0720    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0426    0.0467
   11   -2    2    1    0.5326   -0.6136    0.5303   -0.6130    0.0023    1    0.1150    0.1248
   12    2    0    1   -0.1823   -0.0378   -0.1829   -0.0381    0.0006    1    0.0925    0.0984
   13   -3    1    0    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0929    0.0927
   14   -4    2    1    0.5294   -0.1500    0.5293   -0.1451    0.0049    1    0.1380    0.1473
   15    1    1    1   -0.3365   -0.2370   -0.3362   -0.2357    0.0013    1    0.0810    0.0881
   16   -2    0    0    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0575    0.0679
   17   -3    1    1    0.7294   -0.0815    0.7293   -0.0807    0.0008    1    0.1066    0.1198
   18   -4    2    2    1.0580   -0.5142    1.0696   -0.4972    0.0206    1    0.2345    0.2483
   19   -3   -1    0    0.0431    0.0289    0.0442    0.0295    0.0013    1    0.0897    0.0994
   20   -4    0    1    0.4441    0.1652    0.4423    0.1634    0.0025    1    0.1096    0.1178
   21    1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0402    0.0568
   22   -3   -1    1    0.2976    0.3338    0.3053    0.3413    0.0107    1    0.0832    0.0899
   23   -2   -2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0745    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7334   -0.0568   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    1    3    0   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1   -3    1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    0    2    1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    2    0    0.0564   -0.2234    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    0   -2    1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7   -1    3    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -1    3    0    0.1438   -0.2204    0.1454   -0.2240    0.0039    1          0.1029          0.1017
    9    1   -1    1   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10   -1    1    0    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11   -2    2    1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    2    0    1   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3    1    0    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14   -4    2    1    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1    1    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16   -2    0    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -3    1    1    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -4    2    2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19   -3   -1    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20   -4    0    1    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1    1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -3   -1    1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23   -2   -2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.18                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7609    1.2480    1.2478   90.0027  133.1694   90.0142      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7775    1.2622    1.2573   90.0000  134.8444   90.0000      0.4486         1.4137    1.0039    3.9621    2.8135    2.8026
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0409    0.0551    0.0601    0.0000    1.3271    0.0000      0.0302         0.0449    0.0156    0.2817    0.2256    0.2313
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1188   -0.1484    0.7551)
 a2 = (    0.1903   -0.7576   -0.1785)
 a3 = (    0.8835    0.0685    0.6497)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1432   -0.1460    0.7667) (    0.0170    0.0085    0.0024)
 a2 = (    0.1886   -0.7487   -0.1778) (    0.0095    0.0337    0.0050)
 a3 = (    0.9018    0.0696    0.6636) (    0.0427    0.0163    0.0043)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.0743   97.2780  105.8263    0.4487    1.2665    0.4710
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0004   -0.0004      0.0024    0.0024    0.0469

# Number of computed bands
            400             93
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.8390
# Chi-squares at the beginning and the end of the refinement
    0.1642    0.0188
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -1   -3    1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    1    3    0   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    0   -2    1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0   -2    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    0    2    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    1   -3    0    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    1   -3   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -1    1    2   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    2   -2   -1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -2    0    3   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    3   -1   -3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    4   -2   -3    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15   -1   -1    2   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    2    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    3   -1   -2    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    4   -2   -2    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    3    1   -3    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    4    0   -3    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -1   -1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    3    1   -2    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    2    2   -1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7316   -0.0569   -0.7310   -0.0567    0.0006    1          0.0665          0.0702
    2   -1   -3    1   -0.0134   -0.1742   -0.0130   -0.1762    0.0021    1          0.0996          0.0995
    3    1    3    0   -0.0264    0.0893   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    0   -2    1   -0.1956   -0.5855   -0.1957   -0.5833    0.0021    1          0.1033          0.1078
    5    0   -2    0    0.0565   -0.2238    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6    0    2    1   -0.1070    0.1194   -0.1085    0.1216    0.0026    1          0.0768          0.0778
    7    1   -3    0    0.1200   -0.5955    0.1201   -0.5973    0.0018    1          0.1323          0.1302
    8    1   -3   -1    0.1437   -0.2204    0.1454   -0.2240    0.0040    1          0.1033          0.1017
    9   -1    1    2   -0.1946    0.0484   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1   -1   -1    0.2255   -0.1272    0.2251   -0.1274    0.0005    1          0.0461          0.0467
   11    2   -2   -1    0.5350   -0.6122    0.5303   -0.6130    0.0047    1          0.1244          0.1248
   12   -2    0    3   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1002          0.0984
   13    3   -1   -3    0.1976   -0.0085    0.1990   -0.0092    0.0015    1          0.1007          0.0927
   14    4   -2   -3    0.5291   -0.1488    0.5293   -0.1451    0.0037    1          0.1495          0.1473
   15   -1   -1    2   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    2    0   -2    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0623          0.0679
   17    3   -1   -2    0.7281   -0.0802    0.7293   -0.0807    0.0014    1          0.1154          0.1198
   18    4   -2   -2    1.0583   -0.5098    1.0696   -0.4972    0.0169    1          0.2534          0.2483
   19    3    1   -3    0.0438    0.0287    0.0442    0.0295    0.0009    1          0.0972          0.0994
   20    4    0   -3    0.4437    0.1645    0.4423    0.1634    0.0017    1          0.1188          0.1178
   21   -1   -1    1   -0.0337   -0.0578   -0.0341   -0.0579    0.0004    1          0.0434          0.0568
   22    3    1   -2    0.2983    0.3330    0.3053    0.3413    0.0109    1          0.0901          0.0899
   23    2    2   -1    0.0351    0.2719    0.0347    0.2716    0.0005    1          0.0806          0.0816

###            No.19                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2892    1.7926    1.0616   87.5024  125.3162   91.9437      0.4715
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2652    1.7866    1.0872   90.0000  125.5270   90.0000      0.4457         1.1637    1.6433    2.8385    4.0083    2.4392
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0184    0.0408    0.0216    0.0000    1.1649    0.0000      0.0313         0.0170    0.0433    0.2035    0.2959    0.1780
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4755   -0.5582   -0.6050)
 a2 = (   -0.4490   -0.0348   -0.3302)
 a3 = (    0.6566    0.3713   -0.8745)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4972   -0.5649   -0.6140) (    0.0070    0.0079    0.0057)
 a2 = (   -0.4490   -0.0336   -0.3326) (    0.0125    0.0050    0.0055)
 a3 = (    0.6191    0.3642   -0.8726) (    0.0152    0.0183    0.0112)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -133.2223  119.8197  159.2372    0.5009    0.6175    0.6051
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0007    0.0029      0.0028    0.0023    0.0128

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         5.7306        29.8250
# Chi-squares at the beginning and the end of the refinement
    1.1452    0.0241
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0696    0.0702
    2   -3   -1    2   -0.0217   -0.1586   -0.0130   -0.1762    0.0196    1    0.1042    0.0995
    3    3   -1   -2   -0.0248    0.1051   -0.0262    0.0895    0.0157    1    0.1010    0.0967
    4   -2   -2    1   -0.2154   -0.5560   -0.1957   -0.5833    0.0337    0    0.1069    0.1078
    5   -2    0    1    0.0430   -0.2170    0.0560   -0.2234    0.0145    1    0.0660    0.0654
    6    2   -2   -1   -0.1129    0.1342   -0.1085    0.1216    0.0134    1    0.0786    0.0778
    7   -3   -1    1    0.0920   -0.5965    0.1201   -0.5973    0.0281    0    0.1361    0.1302
    8   -3    1    1    0.1345   -0.2219    0.1454   -0.2240    0.0111    1    0.1052    0.1017
    9    1   -3    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0810    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0474    0.0467
   11   -2    0    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1296    0.1248
   12    0   -4    1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1065    0.0984
   13   -1    3   -1    0.1970   -0.0066    0.1990   -0.0092    0.0032    1    0.1065    0.0927
   14   -2    2   -1    0.5299   -0.1428    0.5293   -0.1451    0.0023    1    0.1564    0.1473
   15   -1   -3    1   -0.3237   -0.2190   -0.3362   -0.2357    0.0209    1    0.0926    0.0881
   16    0    2   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0672    0.0679
   17   -1    1   -1    0.7203   -0.0693    0.7293   -0.0807    0.0146    1    0.1211    0.1198
   18   -2    0   -1    1.0674   -0.4947    1.0696   -0.4972    0.0033    1    0.2656    0.2483
   19    1    3   -2    0.0497    0.0320    0.0442    0.0295    0.0060    1    0.1059    0.0994
   20    0    2   -2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1278    0.1178
   21   -1   -1    1   -0.0288   -0.0441   -0.0341   -0.0579    0.0148    1    0.0468    0.0568
   22    1    1   -2    0.3044    0.3161    0.3053    0.3413    0.0253    0    0.0979    0.0899
   23    2    0   -2    0.0544    0.2794    0.0347    0.2716    0.0212    0    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7341   -0.0557   -0.7310   -0.0567    0.0032    1          0.0665          0.0702
    2   -3   -1    2   -0.0134   -0.1739   -0.0130   -0.1762    0.0023    1          0.0991          0.0995
    3    3   -1   -2   -0.0262    0.0899   -0.0262    0.0895    0.0004    1          0.0970          0.0967
    4   -2   -2    1   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1031          0.1078
    5   -2    0    1    0.0564   -0.2238    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    2   -2   -1   -0.1071    0.1198   -0.1085    0.1216    0.0022    1          0.0764          0.0778
    7   -3   -1    1    0.1210   -0.5967    0.1201   -0.5973    0.0011    1          0.1320          0.1302
    8   -3    1    1    0.1439   -0.2206    0.1454   -0.2240    0.0037    1          0.1028          0.1017
    9    1   -3    0   -0.1947    0.0484   -0.1952    0.0486    0.0005    1          0.0776          0.0726
   10   -1    1    0    0.2259   -0.1273    0.2251   -0.1274    0.0008    1          0.0459          0.0467
   11   -2    0    0    0.5379   -0.6114    0.5303   -0.6130    0.0078    1          0.1244          0.1248
   12    0   -4    1   -0.1808   -0.0381   -0.1829   -0.0381    0.0020    1          0.0997          0.0984
   13   -1    3   -1    0.1980   -0.0087    0.1990   -0.0092    0.0011    1          0.1004          0.0927
   14   -2    2   -1    0.5294   -0.1477    0.5293   -0.1451    0.0026    1          0.1493          0.1473
   15   -1   -3    1   -0.3360   -0.2365   -0.3362   -0.2357    0.0009    1          0.0872          0.0881
   16    0    2   -1    0.1265    0.0352    0.1275    0.0362    0.0013    1          0.0622          0.0679
   17   -1    1   -1    0.7273   -0.0782    0.7293   -0.0807    0.0032    1          0.1154          0.1198
   18   -2    0   -1    1.0600   -0.5034    1.0696   -0.4972    0.0114    1          0.2536          0.2483
   19    1    3   -2    0.0445    0.0288    0.0442    0.0295    0.0008    1          0.0969          0.0994
   20    0    2   -2    0.4431    0.1643    0.4423    0.1634    0.0011    1          0.1188          0.1178
   21   -1   -1    1   -0.0332   -0.0574   -0.0341   -0.0579    0.0011    1          0.0433          0.0568
   22    1    1   -2    0.2987    0.3319    0.3053    0.3413    0.0115    1          0.0901          0.0899
   23    2    0   -2    0.0362    0.2721    0.0347    0.2716    0.0016    1          0.0804          0.0816

###            No.24                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7613    1.2673    1.2454   89.9461  133.9901   90.0429      0.5223
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7847    1.2651    1.2568   90.0000  135.1852   90.0000      0.4467         1.4200    1.0066    3.9957    2.8322    2.8137
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0361    0.0186    0.0544    0.0000    1.1508    0.0000      0.0356         0.0403    0.0396    0.3284    0.2294    0.2551
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7528   -0.2135    0.1023)
 a2 = (    0.1874   -0.7458   -0.1772)
 a3 = (   -0.5924   -0.3563    0.8761)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7580   -0.2159    0.1041) (    0.0017    0.0045    0.0062)
 a2 = (    0.1884   -0.7469   -0.1774) (    0.0053    0.0107    0.0066)
 a3 = (   -0.6165   -0.3630    0.8732) (    0.0146    0.0138    0.0373)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  149.7300   15.0640   45.3076    1.2725    0.5086    1.3489
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
             61             89
# Figure of merit at the beginning and the end of the refinement
         8.6151        29.8147
# Chi-squares at the beginning and the end of the refinement
    0.2390    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0784    0.0702
    2   -1   -3    0   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1155    0.0995
    3   -1    3    1   -0.0283    0.0932   -0.0262    0.0895    0.0043    1    0.1134    0.0967
    4   -2   -2    1   -0.2023   -0.5869   -0.1957   -0.5833    0.0075    1    0.1211    0.1078
    5    0   -2    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0746    0.0654
    6   -2    2    1   -0.1111    0.1226   -0.1085    0.1216    0.0028    1    0.0897    0.0778
    7   -1   -3    1    0.1153   -0.6011    0.1201   -0.5973    0.0061    1    0.1546    0.1302
    8    1   -3    0    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1199    0.1017
    9   -3    1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0912    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0534    0.0467
   11    0   -2    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1461    0.1248
   12   -4    0    1   -0.1852   -0.0381   -0.1829   -0.0381    0.0024    1    0.1170    0.0984
   13    3   -1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1165    0.0927
   14    2   -2    1    0.5363   -0.1536    0.5293   -0.1451    0.0110    1    0.1739    0.1473
   15   -3   -1    1   -0.3399   -0.2368   -0.3362   -0.2357    0.0038    1    0.1026    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0721    0.0679
   17    1   -1    1    0.7442   -0.0855    0.7293   -0.0807    0.0156    1    0.1352    0.1198
   18    0   -2    2    1.0810   -0.5400    1.0696   -0.4972    0.0443    1    0.3040    0.2483
   19    3    1    0    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1124    0.0994
   20    2    0    1    0.4521    0.1688    0.4423    0.1634    0.0111    1    0.1378    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0503    0.0568
   22    1    1    1    0.3021    0.3432    0.3053    0.3413    0.0037    1    0.1047    0.0899
   23    0    2    1    0.0328    0.2785    0.0347    0.2716    0.0071    1    0.0936    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    1   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1   -3    0   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1    3    1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4   -2   -2    1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0   -2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6   -2    2    1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7   -1   -3    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1   -3    0    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9   -3    1    1   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    1   -1    0    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    0   -2    1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -4    0    1   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3   -1    0    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14    2   -2    1    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15   -3   -1    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2    0    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -1    1    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    0   -2    2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19    3    1    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    2    0    1    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1    1    1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23    0    2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.30                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7817    1.2594    1.2593   90.0865  134.9463   90.1152      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7716    1.2651    1.2579   90.0000  134.8152   90.0000      0.4467         1.4084    1.0057    3.9664    2.8322    2.8163
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0358    0.0498    0.0546    0.0000    1.1660    0.0000      0.0284         0.0401    0.0149    0.2647    0.2118    0.2169
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1441    0.1423   -0.7667)
 a2 = (    0.1880   -0.7506   -0.1782)
 a3 = (   -0.9014   -0.0731   -0.6640)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1414    0.1470   -0.7691) (    0.0139    0.0072    0.0020)
 a2 = (    0.1884   -0.7469   -0.1774) (    0.0090    0.0302    0.0048)
 a3 = (   -0.8994   -0.0689   -0.6649) (    0.0383    0.0150    0.0042)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.0738   82.8827  -74.1940    0.3954    1.0232    0.4353
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
            195             89
# Figure of merit at the beginning and the end of the refinement
         3.3663        29.8147
# Chi-squares at the beginning and the end of the refinement
    0.5105    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    1   -3   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3   -1    3    0   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4    0   -4   -2   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6    0    2   -1   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7   -1   -3    0    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8   -1   -3    1    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9    1    1   -2   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -2   -2    1    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12    2    0   -3   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13   -3   -1    3    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14   -4   -2    3    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15    1   -1   -2   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16   -4    0    4    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17   -6   -2    4    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18   -4   -2    2    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19   -5    1    5    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20   -4    0    3    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    2   -2   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22   -3    1    2    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -2    2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    1   -3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1    3    0   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    0   -2   -1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0   -2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6    0    2   -1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7   -1   -3    0    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -1   -3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9    1    1   -2   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10   -1   -1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11   -2   -2    1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    2    0   -3   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3   -1    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14   -4   -2    3    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15    1   -1   -2   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16   -2    0    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -3   -1    2    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -4   -2    2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19   -3    1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20   -4    0    3    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -3    1    2    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23   -2    2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.35                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7836    1.2565    1.2564   89.9926  134.7397   90.1508      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7847    1.2651    1.2579   90.0000  135.2364   90.0000      0.4467         1.4188    1.0057    3.9957    2.8322    2.8163
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0509    0.0498    0.0546    0.0000    1.6192    0.0000      0.0284         0.0286    0.0149    0.2784    0.2118    0.2169
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1445   -0.1419    0.7629)
 a2 = (   -0.1890    0.7522    0.1787)
 a3 = (   -0.6147   -0.3573    0.8661)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1414   -0.1470    0.7691) (    0.0139    0.0072    0.0020)
 a2 = (   -0.1884    0.7469    0.1774) (    0.0090    0.0302    0.0048)
 a3 = (   -0.6165   -0.3630    0.8732) (    0.0347    0.0071    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   76.9262   82.8828  -74.1940    0.3954    1.0232    0.4353
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
             91             89
# Figure of merit at the beginning and the end of the refinement
        11.9806        29.8146
# Chi-squares at the beginning and the end of the refinement
    0.1075    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0   -1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2    1    3   -1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    1   -3    0   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4    2    2   -1   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0    2    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6    2   -2   -1   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    1    3    0    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8   -1    3    1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9    3   -1   -2   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11    0    2    1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12    4    0   -3   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13   -3    1    3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14   -2    2    3    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15    3    1   -2   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16   -2    0    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17   -1    1    2    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18    0    2    2    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19   -3   -1    3    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20   -2    0    3    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21    1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22   -1   -1    2    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23    0   -2    1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0   -1   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    1    3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -3    0   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    2    2   -1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6    2   -2   -1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    1    3    0    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -1    3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9    3   -1   -2   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10   -1    1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    0    2    1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    4    0   -3   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3    1    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14   -2    2    3    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15    3    1   -2   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16   -2    0    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1    1    2    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    0    2    2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19   -3   -1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20   -2    0    3    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1   -1    2    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23    0   -2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.45                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2515    1.8033    1.0844   89.8562  125.1460   91.6128      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2644    1.7719    1.0940   90.0000  125.3081   90.0000      0.4461         1.1557    1.6197    2.8342    3.9718    2.4523
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0129    0.0336    0.0162    0.0000    0.8277    0.0000      0.0296         0.0158    0.0291    0.1902    0.2740    0.1666
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6427    0.7205   -0.1541)
 a2 = (    0.2910    0.1919   -0.4317)
 a3 = (   -0.9069   -0.0703   -0.6670)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6380    0.7131   -0.1543) (    0.0085    0.0080    0.0056)
 a2 = (    0.3086    0.1818   -0.4361) (    0.0092    0.0038    0.0070)
 a3 = (   -0.8990   -0.0682   -0.6647) (    0.0150    0.0114    0.0100)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -168.3611  127.9106  -40.9665    0.4115    0.4756    0.7252
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0033      0.0023    0.0022    0.0129

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         8.6014        29.6911
# Chi-squares at the beginning and the end of the refinement
    0.1459    0.0218
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    3    1   -2   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3   -3   -1    1   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    2    0   -2   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    2    0   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6   -2    0    0   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    3   -1   -2    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    3   -1   -1    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9   -1    1   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    2   -2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    0    2   -2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    1   -3    1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    2   -4    0    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    1    1   -2   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0   -2    1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    1   -3    0    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    2   -4   -1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19   -1   -3    2    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    0   -4    1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    1    1   -1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22   -1   -3    1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23   -2   -2    1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7326   -0.0562   -0.7310   -0.0567    0.0017    1          0.0665          0.0702
    2    3    1   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1          0.0992          0.0995
    3   -3   -1    1   -0.0265    0.0893   -0.0262    0.0895    0.0003    1          0.0972          0.0967
    4    2    0   -2   -0.1956   -0.5863   -0.1957   -0.5833    0.0030    1          0.1032          0.1078
    5    2    0   -1    0.0564   -0.2239    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6   -2    0    0   -0.1071    0.1192   -0.1085    0.1216    0.0028    1          0.0765          0.0778
    7    3   -1   -2    0.1209   -0.5962    0.1201   -0.5973    0.0014    1          0.1322          0.1302
    8    3   -1   -1    0.1438   -0.2205    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9   -1    1   -1   -0.1944    0.0482   -0.1952    0.0486    0.0009    1          0.0777          0.0726
   10    1   -1    0    0.2258   -0.1272    0.2251   -0.1274    0.0007    1          0.0460          0.0467
   11    2   -2   -1    0.5370   -0.6112    0.5303   -0.6130    0.0069    1          0.1246          0.1248
   12    0    2   -2   -0.1808   -0.0380   -0.1829   -0.0381    0.0020    1          0.0999          0.0984
   13    1   -3    1    0.1978   -0.0085    0.1990   -0.0092    0.0013    1          0.1005          0.0927
   14    2   -4    0    0.5292   -0.1478    0.5293   -0.1451    0.0027    1          0.1495          0.1473
   15    1    1   -2   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0873          0.0881
   16    0   -2    1    0.1263    0.0354    0.1275    0.0362    0.0014    1          0.0622          0.0679
   17    1   -3    0    0.7272   -0.0785    0.7293   -0.0807    0.0031    1          0.1155          0.1198
   18    2   -4   -1    1.0592   -0.5047    1.0696   -0.4972    0.0128    1          0.2541          0.2483
   19   -1   -3    2    0.0441    0.0289    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    0   -4    1    0.4429    0.1646    0.4423    0.1634    0.0013    1          0.1189          0.1178
   21    1    1   -1   -0.0336   -0.0575   -0.0341   -0.0579    0.0007    1          0.0433          0.0568
   22   -1   -3    1    0.2980    0.3324    0.3053    0.3413    0.0116    1          0.0901          0.0899
   23   -2   -2    1    0.0353    0.2717    0.0347    0.2716    0.0006    1          0.0804          0.0816

###            No.48                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2617    1.7798    1.0908   89.9594  125.2580   90.1176      0.3212
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7727    1.0924   90.0000  125.2511   90.0000      0.4474         1.1578    1.6228    2.8269    3.9621    2.4415
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0111    0.0279    0.0175    0.0000    0.7101    0.0000      0.0287         0.0176    0.0340    0.1827    0.2613    0.1612
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2623    0.7826    0.5108)
 a2 = (   -0.3054   -0.1806    0.4357)
 a3 = (    0.9037    0.0684    0.6627)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2610    0.7809    0.5093) (    0.0095    0.0046    0.0042)
 a2 = (   -0.3081   -0.1815    0.4363) (    0.0078    0.0041    0.0057)
 a3 = (    0.9004    0.0680    0.6643) (    0.0186    0.0107    0.0068)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   34.2232   69.2771   57.9863    0.3309    0.5821    0.5210
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
             93             91
# Figure of merit at the beginning and the end of the refinement
         4.7664        29.6358
# Chi-squares at the beginning and the end of the refinement
    0.3608    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7292   -0.0552   -0.7310   -0.0567    0.0024    1    0.0475    0.0702
    2    3   -1   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0713    0.0995
    3   -3    1    2   -0.0262    0.0877   -0.0262    0.0895    0.0017    1    0.0698    0.0967
    4    2    0    0   -0.1967   -0.5868   -0.1957   -0.5833    0.0036    1    0.0741    0.1078
    5    2    0   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0461    0.0654
    6   -2    0    2   -0.1057    0.1177   -0.1085    0.1216    0.0047    1    0.0550    0.0778
    7    3    1   -1    0.1202   -0.5978    0.1201   -0.5973    0.0005    1    0.0950    0.1302
    8    3    1   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0741    0.1017
    9   -1   -1    2   -0.1926    0.0484   -0.1952    0.0486    0.0026    1    0.0558    0.0726
   10    1    1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0331    0.0467
   11    2    2   -1    0.5366   -0.6156    0.5303   -0.6130    0.0068    1    0.0895    0.1248
   12    0   -2    2   -0.1801   -0.0371   -0.1829   -0.0381    0.0029    1    0.0716    0.0984
   13    1    3   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0721    0.0927
   14    2    4   -2    0.5323   -0.1500    0.5293   -0.1451    0.0057    1    0.1073    0.1473
   15    1   -1    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0627    0.0881
   16    0    4   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0893    0.0679
   17    1    3   -1    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.0830    0.1198
   18    2    4   -1    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1825    0.2483
   19   -1    3   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0694    0.0994
   20    0    4   -1    0.4463    0.1661    0.4423    0.1634    0.0048    1    0.0851    0.1178
   21    2   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0621    0.0568
   22   -1    3    0    0.2985    0.3355    0.3053    0.3413    0.0089    1    0.0645    0.0899
   23   -2    2    1    0.0339    0.2715    0.0347    0.2716    0.0008    1    0.0576    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    3   -1   -1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3    1    2   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    2    0    0   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    2    0   -1    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6   -2    0    2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7    3    1   -1    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8    3    1   -2    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9   -1   -1    2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10    1    1   -1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    2    2   -1    0.5378   -0.6118    0.5303   -0.6130    0.0075    1          0.1245          0.1248
   12    0   -2    2   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1    3   -2    0.1983   -0.0087    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2    4   -2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -1    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    0    2   -1    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    1    3   -1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18    2    4   -1    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19   -1    3   -1    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    0    4   -1    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1   -1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22   -1    3    0    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -2    2    1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.52                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2560    1.7704    1.0968   90.4736  124.8996   90.2200      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7727    1.0946   90.0000  125.4151   90.0000      0.4474         1.1555    1.6195    2.8271    3.9623    2.4466
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0127    0.0329    0.0159    0.0000    0.8073    0.0000      0.0291         0.0157    0.0289    0.1859    0.2678    0.1629
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6373   -0.7171    0.1484)
 a2 = (    0.3137    0.1811   -0.4335)
 a3 = (    0.8939    0.0693    0.6574)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6394   -0.7130    0.1550) (    0.0083    0.0078    0.0055)
 a2 = (    0.3081    0.1815   -0.4363) (    0.0089    0.0037    0.0068)
 a3 = (    0.9004    0.0680    0.6643) (    0.0149    0.0114    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  168.3290   52.1561  139.1096    0.3988    0.4626    0.7120
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
             95             91
# Figure of merit at the beginning and the end of the refinement
         4.1659        29.6358
# Chi-squares at the beginning and the end of the refinement
    0.4878    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2   -3    1    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3    3   -1   -1   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4   -4    0    4   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5   -2    0    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6    2    0    0   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7   -3   -1    2    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8   -3   -1    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9    1    1    1   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10   -1   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11   -2   -2    1    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12    0    2    2   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13   -1   -3   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14   -2   -4    0    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15   -1    1    2   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16    0   -4   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17   -2   -6    0    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18   -2   -4    1    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19    1   -3   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20    0   -4   -1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21   -2    2    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22    1   -3   -1    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23    2   -2   -1    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -3    1    2   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3   -1   -1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2    0    2   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    1    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6    2    0    0   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7   -3   -1    2    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8   -3   -1    1    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9    1    1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10   -1   -1    0    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11   -2   -2    1    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12    0    2    2   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1   -3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2   -4    0    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1    1    2   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    0   -2   -1    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17   -1   -3    0    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18   -2   -4    1    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19    1   -3   -2    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    0   -4   -1    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22    1   -3   -1    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2   -2   -1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.54                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2636    1.7704    1.0900   89.2333  124.8839   90.6533      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2648    1.7727    1.0924   90.0000  125.2517   90.0000      0.4474         1.1578    1.6228    2.8271    3.9623    2.4417
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0111    0.0279    0.0175    0.0000    0.7101    0.0000      0.0287         0.0176    0.0340    0.1828    0.2613    0.1612
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2607   -0.7757   -0.5110)
 a2 = (   -0.3068   -0.1872    0.4358)
 a3 = (   -0.8963   -0.0550   -0.6667)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2610   -0.7810   -0.5093) (    0.0095    0.0046    0.0042)
 a2 = (   -0.3081   -0.1815    0.4363) (    0.0078    0.0041    0.0057)
 a3 = (   -0.9004   -0.0680   -0.6643) (    0.0186    0.0107    0.0068)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -34.2231  110.7229 -122.0139    0.3309    0.5821    0.5210
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
             77             91
# Figure of merit at the beginning and the end of the refinement
        23.7846        29.6358
# Chi-squares at the beginning and the end of the refinement
    0.1183    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2   -3   -1    1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    3    1   -2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -2    0    0   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5   -2    0    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    2    0   -2   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7   -3    1    1    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8   -3    1    2    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    1   -1   -2   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2    2    1    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12    0   -2   -2   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13   -1    3    2    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14   -2    4    2    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15   -1   -1   -1   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16    0    2    1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17   -1    3    1    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18   -2    4    1    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19    1    3    1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    0    4    1    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    1    3    0    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    2    2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -3   -1    1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3    1   -2   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2    0    0   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    1    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6    2    0   -2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7   -3    1    1    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8   -3    1    2    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9    1   -1   -2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10   -1    1    1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11   -2    2    1    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12    0   -2   -2   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1    3    2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2    4    2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1   -1   -1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    0    2    1    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17   -1    3    1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18   -2    4    1    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19    1    3    1    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    0    4    1    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1   -1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22    1    3    0    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2    2   -1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.69                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2564    1.7811    1.0922   90.3662  125.0855   90.0358      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2539    1.7902    1.0892   90.0000  125.1145   90.0000      0.4515         1.1512    1.6436    2.7771    3.9649    2.4124
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0147    0.0298    0.0181    0.0000    0.9554    0.0000      0.0293         0.0145    0.0308    0.1832    0.2657    0.1616
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5925   -0.6624    0.3953)
 a2 = (    0.0222   -0.3051   -0.4708)
 a3 = (    0.3335   -0.8941    0.5842)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5933   -0.6641    0.3970) (    0.0086    0.0072    0.0045)
 a2 = (    0.0220   -0.3007   -0.4702) (    0.0027    0.0073    0.0070)
 a3 = (    0.3348   -0.8953    0.5882) (    0.0173    0.0129    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  154.1874   69.2433   57.9485    0.3174    0.4854    0.5786
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0073      0.0021    0.0024    0.0151

# Number of computed bands
             91             87
# Figure of merit at the beginning and the end of the refinement
        11.9806        29.6032
# Chi-squares at the beginning and the end of the refinement
    0.0924    0.0286
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2   -1   -3   -1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    0    2    2   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4   -1   -3    0   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0   -2   -1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6   -1    1    2   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    0   -4   -1    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8    1   -3   -2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9   -2    0    2   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11    1   -3   -1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12   -3   -1    2   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13    3   -1   -2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14    3   -3   -2    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15   -2   -2    1   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16    2    0   -1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17    2   -2   -1    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18    2   -4   -1    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19    3    1   -1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20    3   -1   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22    2    0    0    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23    1    1    1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7307   -0.0566   -0.7310   -0.0567    0.0003    1          0.0662          0.0702
    2   -1   -3   -1   -0.0132   -0.1736   -0.0130   -0.1762    0.0026    1          0.0994          0.0995
    3    0    2    2   -0.0269    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1   -3    0   -0.1968   -0.5861   -0.1957   -0.5833    0.0029    1          0.1028          0.1078
    5    0   -2   -1    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6   -1    1    2   -0.1082    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0   -4   -1    0.1205   -0.5969    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1   -3   -2    0.1440   -0.2198    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    0    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0782          0.0726
   10    1   -1   -1    0.2255   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -3   -1    0.5376   -0.6131    0.5303   -0.6130    0.0073    1          0.1237          0.1248
   12   -3   -1    2   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    3   -1   -2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    3   -3   -2    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -2   -2    1   -0.3358   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16    2    0   -1    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    2   -2   -1    0.7295   -0.0791    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    2   -4   -1    1.0631   -0.5091    1.0696   -0.4972    0.0136    1          0.2516          0.2483
   19    3    1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    3   -1   -1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1   -1    0   -0.0332   -0.0571   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    2    0    0    0.2995    0.3344    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    1    1    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.73                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2687    1.7678    1.0928   91.0820  125.2899   89.8195      0.5055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2539    1.7902    1.0897   90.0000  125.1497   90.0000      0.4515         1.1507    1.6429    2.7770    3.9649    2.4134
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0112    0.0338    0.0216    0.0000    0.7298    0.0000      0.0299         0.0190    0.0298    0.1858    0.2733    0.1670
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9166   -0.2300    0.1991)
 a2 = (   -0.0225    0.3016    0.4782)
 a3 = (    0.3293   -0.8866    0.6025)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9281   -0.2313    0.1913) (    0.0027    0.0088    0.0052)
 a2 = (   -0.0220    0.3007    0.4702) (    0.0028    0.0071    0.0086)
 a3 = (    0.3348   -0.8953    0.5882) (    0.0125    0.0201    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.1127   59.8063  -20.6736    0.3474    0.4356    0.5648
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0073      0.0021    0.0024    0.0151

# Number of computed bands
             75             87
# Figure of merit at the beginning and the end of the refinement
         9.3876        29.6017
# Chi-squares at the beginning and the end of the refinement
    0.2670    0.0286
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7526   -0.0603   -0.7310   -0.0567    0.0219    1    0.0767    0.0702
    2    1    3   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1117    0.0995
    3    0   -2    2   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.1094    0.0967
    4    1    3   -1   -0.1979   -0.5945   -0.1957   -0.5833    0.0114    1    0.1176    0.1078
    5    0    2   -1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0721    0.0654
    6    1   -1    1   -0.1133    0.1267   -0.1085    0.1216    0.0070    1    0.0863    0.0778
    7    0    4   -1    0.1206   -0.6019    0.1201   -0.5973    0.0046    1    0.1501    0.1302
    8   -1    3   -1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1159    0.1017
    9    2    0    0   -0.2043    0.0513   -0.1952    0.0486    0.0095    1    0.0877    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0516    0.0467
   11   -1    3    0    0.5388   -0.6214    0.5303   -0.6130    0.0120    1    0.1419    0.1248
   12    3    1   -1   -0.1891   -0.0393   -0.1829   -0.0381    0.0063    1    0.1125    0.0984
   13   -3    1    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1126    0.0927
   14   -3    3    1    0.5353   -0.1524    0.5293   -0.1451    0.0095    1    0.1689    0.1473
   15    2    2   -1   -0.3440   -0.2429   -0.3362   -0.2357    0.0106    1    0.0992    0.0881
   16   -2    0    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0697    0.0679
   17   -2    2    1    0.7398   -0.0844    0.7293   -0.0807    0.0111    1    0.1314    0.1198
   18   -2    4    1    1.0717   -0.5244    1.0696   -0.4972    0.0274    1    0.2927    0.2483
   19   -3   -1    2    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1087    0.0994
   20   -3    1    2    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1341    0.1178
   21    1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0486    0.0568
   22   -2    0    2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1019    0.0899
   23   -1   -1    2    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0908    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7307   -0.0566   -0.7310   -0.0567    0.0003    1          0.0662          0.0702
    2    1    3   -2   -0.0132   -0.1736   -0.0130   -0.1762    0.0026    1          0.0994          0.0995
    3    0   -2    2   -0.0269    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4    1    3   -1   -0.1968   -0.5861   -0.1957   -0.5833    0.0029    1          0.1028          0.1078
    5    0    2   -1    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6    1   -1    1   -0.1082    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    0    4   -1    0.1205   -0.5969    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8   -1    3   -1    0.1440   -0.2198    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    2    0    0   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0782          0.0726
   10   -1    1    0    0.2255   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    3    0    0.5376   -0.6131    0.5303   -0.6130    0.0073    1          0.1237          0.1248
   12    3    1   -1   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13   -3    1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14   -3    3    1    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15    2    2   -1   -0.3358   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16   -2    0    1    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17   -2    2    1    0.7295   -0.0791    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18   -2    4    1    1.0631   -0.5091    1.0696   -0.4972    0.0136    1          0.2516          0.2483
   19   -3   -1    2    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20   -3    1    2    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21    1    1   -1   -0.0332   -0.0571   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22   -2    0    2    0.2995    0.3344    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -1   -1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.90                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7806    1.2587    1.2594   89.9476  134.8814   90.0586      0.3212
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7791    1.2601    1.2551   90.0000  134.6975   90.0000      0.4493         1.4175    1.0040    3.9600    2.8048    2.7936
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0184    0.0477    0.0176    0.0000    0.5976    0.0000      0.0339         0.0130    0.0403    0.3012    0.2366    0.2141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1895    0.7484    0.1795)
 a2 = (    0.1464   -0.1464    0.7670)
 a3 = (    0.5677    0.9632    0.0752)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1900    0.7469    0.1771) (    0.0071    0.0022    0.0051)
 a2 = (    0.1452   -0.1449    0.7666) (    0.0096    0.0090    0.0279)
 a3 = (    0.5702    0.9622    0.0738) (    0.0130    0.0071    0.0054)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.0522   97.4086  105.9820    0.3878    0.3094    0.5483
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
             93             91
# Figure of merit at the beginning and the end of the refinement
         4.7664        29.5089
# Chi-squares at the beginning and the end of the refinement
    0.3622    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7292   -0.0552   -0.7310   -0.0567    0.0024    1    0.0475    0.0702
    2    2    0    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0713    0.0995
    3   -3    1    0   -0.0262    0.0877   -0.0262    0.0895    0.0017    1    0.0698    0.0967
    4    1    1    1   -0.1967   -0.5868   -0.1957   -0.5833    0.0036    1    0.0741    0.1078
    5    2    0    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0461    0.0654
    6   -3    1    1   -0.1057    0.1177   -0.1085    0.1216    0.0047    1    0.0550    0.0778
    7    3    1    0    0.1202   -0.5978    0.1201   -0.5973    0.0005    1    0.0950    0.1302
    8    4    0   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0741    0.1017
    9   -3    1    2   -0.1926    0.0484   -0.1952    0.0486    0.0026    1    0.0558    0.0726
   10    2    0   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0331    0.0467
   11    3    1   -1    0.5366   -0.6156    0.5303   -0.6130    0.0068    1    0.0895    0.1248
   12   -3    1    3   -0.1801   -0.0371   -0.1829   -0.0381    0.0029    1    0.0716    0.0984
   13    4    0   -3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0721    0.0927
   14    5    1   -3    0.5323   -0.1500    0.5293   -0.1451    0.0057    1    0.1073    0.1473
   15   -1    1    2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0627    0.0881
   16    4    0   -4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0893    0.0679
   17    3    1   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.0830    0.1198
   18    4    2   -2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1825    0.2483
   19    2    0   -3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0694    0.0994
   20    3    1   -3    0.4463    0.1661    0.4423    0.1634    0.0048    1    0.0851    0.1178
   21    0    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0621    0.0568
   22    1    1   -2    0.2985    0.3355    0.3053    0.3413    0.0089    1    0.0645    0.0899
   23   -1    1   -1    0.0339    0.2715    0.0347    0.2716    0.0008    1    0.0576    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2    2    0    1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3   -3    1    0   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    1    1    1   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    2    0    0    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6   -3    1    1   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    3    1    0    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8    4    0   -1    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -3    1    2   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    2    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    3    1   -1    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12   -3    1    3   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    4    0   -3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    5    1   -3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -1    1    2   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    2    0   -2    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    3    1   -2    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    4    2   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    2    0   -3    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    3    1   -3    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    0    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    1    1   -2    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23   -1    1   -1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.91                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7844    1.2563    1.2613   90.1855  134.9785   90.0299      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7791    1.2601    1.2551   90.0000  134.6975   90.0000      0.4493         1.4175    1.0040    3.9599    2.8047    2.7936
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0184    0.0477    0.0176    0.0000    0.5976    0.0000      0.0339         0.0130    0.0403    0.3012    0.2366    0.2141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1882   -0.7491   -0.1765)
 a2 = (    0.1451   -0.1480    0.7686)
 a3 = (   -0.5679   -0.9635   -0.0724)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1900   -0.7469   -0.1771) (    0.0071    0.0022    0.0051)
 a2 = (    0.1452   -0.1449    0.7666) (    0.0096    0.0090    0.0279)
 a3 = (   -0.5702   -0.9622   -0.0738) (    0.0130    0.0071    0.0054)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.0522   82.5914  -74.0180    0.3878    0.3094    0.5483
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            173             91
# Figure of merit at the beginning and the end of the refinement
         3.3422        29.5088
# Chi-squares at the beginning and the end of the refinement
    1.2447    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2   -2   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2   -4    0   -1    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    3    1    0   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4   -2    2   -2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5   -4    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    6    2   -2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7   -3    1    0    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8   -4    0    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    3    1   -2   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10   -4    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -6    2    2    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    3    1   -3   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13   -4    0    3    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -5    1    3    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    2    2   -4   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16   -4    0    4    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17   -6    2    4    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18   -4    2    2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19   -4    0    5    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -3    1    3    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    0    0   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -1    1    2    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    2    2    2    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -2    0   -1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    3    1    0   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -1    1   -1   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    0    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    3    1   -1   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3    1    0    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -4    0    1    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    3    1   -2   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -2    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -3    1    1    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    3    1   -3   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13   -4    0    3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -5    1    3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    1    1   -2   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -2    0    2    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -3    1    2    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -4    2    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -2    0    3    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -3    1    3    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    0    0   -1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -1    1    2    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    1    1    1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.93                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7827    1.2584    1.2606   89.8816  134.9943   90.1218      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7843    1.2601    1.2551   90.0000  134.8672   90.0000      0.4493         1.4217    1.0040    3.9716    2.8047    2.7936
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0162    0.0477    0.0176    0.0000    0.5228    0.0000      0.0339         0.0148    0.0403    0.3015    0.2366    0.2141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1883   -0.7497   -0.1781)
 a2 = (   -0.1470    0.1446   -0.7674)
 a3 = (    0.9450   -0.5350   -0.2809)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1900   -0.7469   -0.1771) (    0.0071    0.0022    0.0051)
 a2 = (   -0.1452    0.1449   -0.7666) (    0.0096    0.0090    0.0279)
 a3 = (    0.9501   -0.5315   -0.2804) (    0.0135    0.0065    0.0081)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.9478   97.4086  105.9820    0.3878    0.3094    0.5483
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            175             91
# Figure of merit at the beginning and the end of the refinement
         3.4923        29.5088
# Chi-squares at the beginning and the end of the refinement
    0.4988    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2   -4    0    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3    3   -1    0   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4   -6   -2    2   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5   -2    0    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6    1   -1    1   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7   -3   -1    0    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8   -2    0   -1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9   -1   -1    2   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1   -1   -1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12   -3   -1    3   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13    2    0   -3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14    1   -1   -3    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15   -3   -1    2   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16    4    0   -4    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17    2   -2   -4    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18    0   -2   -2    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19    6    0   -5    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20    3   -1   -3    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21   -4    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22    3   -1   -2    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23    3   -1   -1    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -4    0    1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    3   -1    0   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -3   -1    1   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    0    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    1   -1    1   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3   -1    0    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -2    0   -1    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -1   -1    2   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    0    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -1   -1    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12   -3   -1    3   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    2    0   -3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    1   -1   -3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -3   -1    2   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    2    0   -2    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    1   -1   -2    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    0   -2   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    4    0   -3    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    3   -1   -3    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21   -2    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    3   -1   -2    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    3   -1   -1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.97                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7975    1.2366    1.2709   89.6312  134.9310   90.5020      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7843    1.2601    1.2646   90.0000  135.3012   90.0000      0.4493         1.4109    0.9964    3.9716    2.8047    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0186    0.0506    0.0177    0.0000    0.5914    0.0000      0.0345         0.0128    0.0378    0.3082    0.2433    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7503   -0.2125    0.0967)
 a2 = (    0.1410   -0.1610    0.7798)
 a3 = (   -0.9363    0.5301    0.2783)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7601   -0.2153    0.1033) (    0.0019    0.0064    0.0044)
 a2 = (    0.1452   -0.1449    0.7666) (    0.0099    0.0094    0.0296)
 a3 = (   -0.9501    0.5315    0.2804) (    0.0077    0.0109    0.0088)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.6411   77.0810 -165.9016    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         6.3733        29.5087
# Chi-squares at the beginning and the end of the refinement
    0.2868    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2   -4    0    3   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    3    1   -3   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -3    1    2   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5   -2    0    2    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    1    1   -2   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7   -3    1    3    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8   -2    0    3    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9   -1    1   -1   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    1    2    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12   -3    1    0   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    2    0    1    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    1    1    2    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15   -3    1    1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    2    0    0    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1    1    1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    0    2    2    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    4    0   -1    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    3    1    0    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21   -2    0    1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    3    1   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    3    1   -2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -4    0    3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    3    1   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -3    1    2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    1    1   -2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3    1    3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -2    0    3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -1    1   -1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    0    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    1    2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12   -3    1    0   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    2    0    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    1    1    2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -3    1    1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    1    1    1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    0    2    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    4    0   -1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    3    1    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21   -2    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    3    1   -1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    3    1   -2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.99                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7848    1.2381    1.2620   89.9942  134.1503   91.2502      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7791    1.2601    1.2646   90.0000  135.1340   90.0000      0.4493         1.4068    0.9964    3.9599    2.8047    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0162    0.0506    0.0177    0.0000    0.5206    0.0000      0.0345         0.0146    0.0378    0.3066    0.2433    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7451   -0.2113    0.1023)
 a2 = (   -0.1722    0.1402   -0.7769)
 a3 = (   -0.5458   -0.9574   -0.0760)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7601   -0.2153    0.1033) (    0.0019    0.0064    0.0044)
 a2 = (   -0.1452    0.1449   -0.7666) (    0.0099    0.0094    0.0296)
 a3 = (   -0.5702   -0.9622   -0.0738) (    0.0078    0.0136    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  172.3589  102.9190   14.0984    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         7.5123        29.5087
# Chi-squares at the beginning and the end of the refinement
    0.1840    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    2    0   -3   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -3   -1    3   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1   -1   -2   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    2    0   -2    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -3   -1    2   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    3   -1   -3    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    4    0   -3    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9   -3   -1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    2    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    3   -1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -3   -1    0   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    4    0   -1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    5   -1   -2    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15   -1   -1   -1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    2    0    0    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    3   -1   -1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    4   -2   -2    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    2    0    1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    3   -1    0    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0    0   -1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    1   -1    1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -1   -1    2    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2    2    0   -3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3   -3   -1    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    1   -1   -2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    2    0   -2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6   -3   -1    2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    3   -1   -3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8    4    0   -3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -3   -1    1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    2    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    3   -1   -2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12   -3   -1    0   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    4    0   -1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    5   -1   -2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -1   -1   -1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    3   -1   -1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    4   -2   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    2    0    1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    3   -1    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    0    0   -1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    1   -1    1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23   -1   -1    2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.111                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2478    1.7910    1.0793   90.5951  123.9244   91.3759      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2563    1.7838    1.0910   90.0000  125.1130   90.0000      0.4497         1.1515    1.6350    2.7934    3.9662    2.4259
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0124    0.0308    0.0198    0.0000    0.8059    0.0000      0.0309         0.0178    0.0367    0.1940    0.2812    0.1725
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7290    0.5215    0.3615)
 a2 = (   -0.1545    0.4530   -0.2883)
 a3 = (   -0.0716    0.6092    0.9336)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7371    0.5173    0.3688) (    0.0062    0.0064    0.0068)
 a2 = (   -0.1668    0.4472   -0.2940) (    0.0050    0.0093    0.0041)
 a3 = (   -0.0445    0.6034    0.9431) (    0.0146    0.0123    0.0145)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  144.1491   40.3218 -116.0888    0.6106    0.5204    0.7493
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0028      0.0024    0.0024    0.0157

# Number of computed bands
            400             95
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.4660
# Chi-squares at the beginning and the end of the refinement
    0.2456    0.0189
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    1    3    1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    0   -4   -1   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    1    1    1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0    2    1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    1   -3   -1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    0    2    2    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8   -1    3    2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    2   -2   -1   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11   -1    1    2    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    3   -1   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -3    1    2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -3    1    3    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    2    0    0   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16   -2    0    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -2    0    2    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -2    0    3    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19   -3   -1    1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -3   -1    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    1    1    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -2   -2    1    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -1   -3    0    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7307   -0.0570   -0.7310   -0.0567    0.0004    1          0.0664          0.0702
    2    1    3    1   -0.0133   -0.1743   -0.0130   -0.1762    0.0019    1          0.0996          0.0995
    3    0   -4   -1   -0.0264    0.0894   -0.0262    0.0895    0.0003    1          0.0975          0.0967
    4    1    1    1   -0.1960   -0.5855   -0.1957   -0.5833    0.0021    1          0.1033          0.1078
    5    0    2    1    0.0566   -0.2238    0.0560   -0.2234    0.0008    1          0.0643          0.0654
    6    1   -3   -1   -0.1072    0.1194   -0.1085    0.1216    0.0026    1          0.0768          0.0778
    7    0    2    2    0.1200   -0.5957    0.1201   -0.5973    0.0016    1          0.1322          0.1302
    8   -1    3    2    0.1438   -0.2202    0.1454   -0.2240    0.0041    1          0.1034          0.1017
    9    2   -2   -1   -0.1946    0.0484   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -1    1    1    0.2254   -0.1270    0.2251   -0.1274    0.0006    1          0.0462          0.0467
   11   -1    1    2    0.5349   -0.6125    0.5303   -0.6130    0.0046    1          0.1242          0.1248
   12    3   -1   -1   -0.1813   -0.0379   -0.1829   -0.0381    0.0016    1          0.1003          0.0984
   13   -3    1    2    0.1974   -0.0085    0.1990   -0.0092    0.0017    1          0.1008          0.0927
   14   -3    1    3    0.5290   -0.1489    0.5293   -0.1451    0.0038    1          0.1493          0.1473
   15    2    0    0   -0.3359   -0.2362   -0.3362   -0.2357    0.0006    1          0.0876          0.0881
   16   -2    0    1    0.1259    0.0353    0.1275    0.0362    0.0018    1          0.0624          0.0679
   17   -2    0    2    0.7283   -0.0806    0.7293   -0.0807    0.0011    1          0.1152          0.1198
   18   -2    0    3    1.0585   -0.5110    1.0696   -0.4972    0.0177    1          0.2527          0.2483
   19   -3   -1    1    0.0437    0.0287    0.0442    0.0295    0.0010    1          0.0973          0.0994
   20   -3   -1    2    0.4438    0.1644    0.4423    0.1634    0.0018    1          0.1187          0.1178
   21    1    1    0   -0.0338   -0.0579   -0.0341   -0.0579    0.0004    1          0.0435          0.0568
   22   -2   -2    1    0.2986    0.3333    0.3053    0.3413    0.0105    1          0.0900          0.0899
   23   -1   -3    0    0.0350    0.2721    0.0347    0.2716    0.0006    1          0.0805          0.0816

###            No.123                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2688    1.7799    1.0863   91.1889  125.3709   89.6276      0.5055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2652    1.7842    1.0876   90.0000  125.4557   90.0000      0.4469         1.1633    1.6405    2.8314    3.9928    2.4340
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0112    0.0407    0.0207    0.0000    0.7119    0.0000      0.0293         0.0176    0.0329    0.1872    0.2770    0.1661
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1178   -0.9224    0.2638)
 a2 = (    0.4470    0.0358    0.3386)
 a3 = (   -0.6098   -0.3549    0.8816)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1197   -0.9274    0.2590) (    0.0093    0.0024    0.0066)
 a2 = (    0.4499    0.0348    0.3324) (    0.0119    0.0044    0.0060)
 a3 = (   -0.6171   -0.3616    0.8732) (    0.0148    0.0101    0.0158)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   24.2313   40.5663 -116.2278    0.6038    0.4594    0.6888
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
             75             93
# Figure of merit at the beginning and the end of the refinement
         9.3876        29.2186
# Chi-squares at the beginning and the end of the refinement
    0.2775    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7526   -0.0603   -0.7310   -0.0567    0.0219    1    0.0767    0.0702
    2   -3    1    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1117    0.0995
    3    3    1   -1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.1094    0.0967
    4   -2    2    1   -0.1979   -0.5945   -0.1957   -0.5833    0.0114    1    0.1176    0.1078
    5   -2    0    1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0721    0.0654
    6    2    2   -1   -0.1133    0.1267   -0.1085    0.1216    0.0070    1    0.0863    0.0778
    7   -3    1    2    0.1206   -0.6019    0.1201   -0.5973    0.0046    1    0.1501    0.1302
    8   -3   -1    2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1159    0.1017
    9    1    3   -1   -0.2043    0.0513   -0.1952    0.0486    0.0095    1    0.0877    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0516    0.0467
   11   -2    0    2    0.5388   -0.6214    0.5303   -0.6130    0.0120    1    0.1419    0.1248
   12    0    4   -1   -0.1891   -0.0393   -0.1829   -0.0381    0.0063    1    0.1125    0.0984
   13   -1   -3    2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1126    0.0927
   14   -2   -2    3    0.5353   -0.1524    0.5293   -0.1451    0.0095    1    0.1689    0.1473
   15   -1    3    0   -0.3440   -0.2429   -0.3362   -0.2357    0.0106    1    0.0992    0.0881
   16    0   -2    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0697    0.0679
   17   -1   -1    2    0.7398   -0.0844    0.7293   -0.0807    0.0111    1    0.1314    0.1198
   18   -2    0    3    1.0717   -0.5244    1.0696   -0.4972    0.0274    1    0.2927    0.2483
   19    1   -3    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1087    0.0994
   20    0   -2    2    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1341    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0486    0.0568
   22    1   -1    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1019    0.0899
   23    2    0    0    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0908    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -3    1    1   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3    3    1   -1   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4   -2    2    1   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5   -2    0    1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    2    2   -1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7   -3    1    2    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -3   -1    2    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    1    3   -1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10   -1   -1    1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0    2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    0    4   -1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13   -1   -3    2    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -2   -2    3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15   -1    3    0   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    0   -2    1    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1   -1    2    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18   -2    0    3    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19    1   -3    1    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0   -2    2    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1190          0.1178
   21   -1    1    0   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22    1   -1    1    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2    0    0    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.124                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2622    1.7939    1.0823   89.8036  125.3039   90.1760      0.5875
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2652    1.7842    1.0876   90.0000  125.4556   90.0000      0.4469         1.1633    1.6405    2.8314    3.9928    2.4340
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0112    0.0407    0.0207    0.0000    0.7119    0.0000      0.0293         0.0176    0.0329    0.1872    0.2770    0.1661
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1218    0.9279   -0.2579)
 a2 = (    0.4457    0.0348    0.3330)
 a3 = (    0.6224    0.3597   -0.8746)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1197    0.9274   -0.2590) (    0.0093    0.0024    0.0066)
 a2 = (    0.4499    0.0348    0.3324) (    0.0119    0.0044    0.0060)
 a3 = (    0.6171    0.3616   -0.8732) (    0.0148    0.0101    0.0158)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -24.2313  139.4337   63.7722    0.6038    0.4594    0.6888
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
             91             93
# Figure of merit at the beginning and the end of the refinement
         4.5071        29.2184
# Chi-squares at the beginning and the end of the refinement
    0.4675    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7426   -0.0580   -0.7310   -0.0567    0.0117    1    0.0875    0.0702
    2    3    1   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3   -3    1    1   -0.0263    0.0894   -0.0262    0.0895    0.0001    1    0.1276    0.0967
    4    2    2   -1   -0.1935   -0.5912   -0.1957   -0.5833    0.0082    1    0.1361    0.1078
    5    2    0   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -2    2    1   -0.1070    0.1201   -0.1085    0.1216    0.0021    1    0.1003    0.0778
    7    3    1   -2    0.1236   -0.5978    0.1201   -0.5973    0.0034    1    0.1745    0.1302
    8    3   -1   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -1    3    1   -0.1956    0.0494   -0.1952    0.0486    0.0008    1    0.1017    0.0726
   10    1   -1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    2    0   -2    0.5384   -0.6110    0.5303   -0.6130    0.0083    1    0.1644    0.1248
   12    0    4    1   -0.1824   -0.0378   -0.1829   -0.0381    0.0006    1    0.1307    0.0984
   13    1   -3   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    2   -2   -3    0.5313   -0.1493    0.5293   -0.1451    0.0047    1    0.1973    0.1473
   15    1    3    0   -0.3385   -0.2395   -0.3362   -0.2357    0.0045    1    0.1146    0.0881
   16    0   -2   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    1   -1   -2    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1524    0.1198
   18    2    0   -3    1.0565   -0.5053    1.0696   -0.4972    0.0154    1    0.3347    0.2483
   19   -1   -3   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    0   -2   -2    0.4461    0.1648    0.4423    0.1634    0.0040    1    0.1565    0.1178
   21    1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1   -1   -1    0.3006    0.3340    0.3053    0.3413    0.0087    1    0.1185    0.0899
   23   -2    0    0    0.0359    0.2732    0.0347    0.2716    0.0019    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    3    1   -1   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3   -3    1    1   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4    2    2   -1   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5    2    0   -1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6   -2    2    1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7    3    1   -2    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    3   -1   -2    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9   -1    3    1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10    1   -1   -1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    2    0   -2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    0    4    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13    1   -3   -2    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    2   -2   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    1    3    0   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    0   -2   -1    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -1   -2    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18    2    0   -3    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19   -1   -3   -1    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0   -2   -2    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1190          0.1178
   21    1    1    0   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22   -1   -1   -1    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -2    0    0    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.127                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2709    1.7797    1.0864   91.4594  125.4920   89.7892      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2652    1.7842    1.0896   90.0000  125.6025   90.0000      0.4468         1.1612    1.6375    2.8315    3.9929    2.4385
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0142    0.0335    0.0180    0.0000    0.8965    0.0000      0.0285         0.0136    0.0375    0.1835    0.2657    0.1608
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4907   -0.5559   -0.6199)
 a2 = (   -0.4457   -0.0258   -0.3416)
 a3 = (    0.6093    0.3735   -0.8765)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4975   -0.5658   -0.6142) (    0.0057    0.0069    0.0048)
 a2 = (   -0.4499   -0.0348   -0.3324) (    0.0104    0.0042    0.0043)
 a3 = (    0.6171    0.3616   -0.8732) (    0.0118    0.0155    0.0086)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -133.1836  119.9368  159.3211    0.4272    0.5192    0.5350
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            400             93
# Figure of merit at the beginning and the end of the refinement
         6.3733        29.2170
# Chi-squares at the beginning and the end of the refinement
    0.4353    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2   -3   -1    2   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    3   -1   -2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -2   -2    1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5   -2    0    1    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    2   -2   -1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7   -3   -1    1    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8   -3    1    1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    1   -3    0   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -2    0    0    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    0   -4    1   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13   -1    3   -1    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14   -2    2   -1    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15   -1   -3    1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0    2   -1    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17   -1    1   -1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18   -2    0   -1    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    1    3   -2    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    0    2   -2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21   -1   -1    1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    1    1   -2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    2    0   -2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -3   -1    2   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3    3   -1   -2   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4   -2   -2    1   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5   -2    0    1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    2   -2   -1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7   -3   -1    1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -3    1    1    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    1   -3    0   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10   -1    1    0    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0    0    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    0   -4    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13   -1    3   -1    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -2    2   -1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15   -1   -3    1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    0    2   -1    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1    1   -1    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18   -2    0   -1    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19    1    3   -2    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0    2   -2    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1    1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22    1    1   -2    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2    0   -2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.148                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2530    1.7880    1.0816   89.8982  124.3804   90.1869      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2637    1.7789    1.0867   90.0000  125.0482   90.0000      0.4512         1.1629    1.6369    2.8010    3.9429    2.4087
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0169    0.0577    0.0321    0.0000    1.0893    0.0000      0.0295         0.0410    0.0285    0.1869    0.2877    0.1728
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4251    0.3218    0.8068)
 a2 = (    0.4712   -0.2668   -0.1401)
 a3 = (    0.5676    0.9629    0.0751)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4255    0.3346    0.8008) (    0.0046    0.0176    0.0087)
 a2 = (    0.4741   -0.2677   -0.1401) (    0.0158    0.0101    0.0029)
 a3 = (    0.5678    0.9673    0.0733) (    0.0212    0.0343    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  106.7380  120.1021  159.1300    0.3877    1.1504    0.4268
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
             77             81
# Figure of merit at the beginning and the end of the refinement
        23.7846        29.1833
# Chi-squares at the beginning and the end of the refinement
    0.0678    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2    0   -2    2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    1    3   -2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    1   -1    1   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5    0   -2    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    1    3   -1   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7    1   -3    1    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8    0   -4    1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    1    3    0   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -3    0    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12    1    3    1   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13    0   -4   -1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    1   -5   -1    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15    1    1    1   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16    0   -2   -1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    1   -3   -1    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18    2   -4   -1    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19    0   -2   -2    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    1   -3   -2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    1   -1   -2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    1    1   -2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    0   -2    2   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3    1    3   -2   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4    1   -1    1   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    0   -2    1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    1    3   -1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    1   -3    1    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    0   -4    1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    1    3    0   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0778          0.0726
   10    0   -2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1   -3    0    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12    1    3    1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    0   -4   -1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    1   -5   -1    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15    1    1    1   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    0   -2   -1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    1   -3   -1    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    2   -4   -1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19    0   -2   -2    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20    1   -3   -2    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    0    0    1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22    1   -1   -2    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23    1    1   -2    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.149                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2669    1.7770    1.0895   89.9371  125.3741   90.1144      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2637    1.7789    1.0958   90.0000  125.7162   90.0000      0.4512         1.1533    1.6234    2.8010    3.9429    2.4287
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0271    0.0458    0.0199    0.0000    1.7094    0.0000      0.0309         0.0303    0.0333    0.2008    0.2881    0.1718
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1406   -0.6257    0.7251)
 a2 = (   -0.4741    0.2684    0.1409)
 a3 = (   -0.5703   -0.9675   -0.0755)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1423   -0.6327    0.7275) (    0.0184    0.0129    0.0145)
 a2 = (   -0.4741    0.2677    0.1401) (    0.0127    0.0081    0.0031)
 a3 = (   -0.5678   -0.9673   -0.0733) (    0.0164    0.0254    0.0069)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   71.5425  128.0968  -41.0839    0.3690    1.4735    0.5854
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
             91             81
# Figure of merit at the beginning and the end of the refinement
        11.9806        29.1832
# Chi-squares at the beginning and the end of the refinement
    0.1036    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2    0    2   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    1   -3    1   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4    1    1   -2   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    0    2   -1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6    1   -3    0   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    1    3   -2    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8    0    4   -1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9    1   -3   -1   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11    1    3   -1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12    1   -3   -2   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13    0    4    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14    1    5    0    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15    1   -1   -2   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16    0    2    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17    1    3    0    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18    2    4   -1    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19    0    2    2    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20    1    3    1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21    0    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22    1    1    1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23    1   -1    1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    0    2   -2   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3    1   -3    1   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4    1    1   -2   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    0    2   -1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    1   -3    0   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    1    3   -2    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    0    4   -1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    1   -3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0778          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12    1   -3   -2   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    0    4    1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    1    5    0    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15    1   -1   -2   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    0    2    1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    1    3    0    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    2    4   -1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19    0    2    2    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20    1    3    1    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    0    0   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22    1    1    1    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23    1   -1    1    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.152                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2366    1.7995    1.0864   90.0725  124.1856   89.9805      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2637    1.7789    1.0867   90.0000  125.0482   90.0000      0.4512         1.1629    1.6369    2.8010    3.9429    2.4087
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0169    0.0577    0.0321    0.0000    1.0893    0.0000      0.0295         0.0410    0.0285    0.1869    0.2877    0.1728
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4232   -0.3166   -0.8223)
 a2 = (    0.4682   -0.2651   -0.1392)
 a3 = (   -0.5643   -0.9552   -0.0850)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4255   -0.3346   -0.8008) (    0.0046    0.0176    0.0087)
 a2 = (    0.4741   -0.2677   -0.1401) (    0.0158    0.0101    0.0029)
 a3 = (   -0.5678   -0.9673   -0.0733) (    0.0212    0.0343    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -106.7380   59.8979  -20.8700    0.3877    1.1504    0.4268
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            400             81
# Figure of merit at the beginning and the end of the refinement
         6.3733        29.1831
# Chi-squares at the beginning and the end of the refinement
    0.1857    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2    0   -2   -2   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3   -1    3    2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1   -1   -1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5    0   -2   -1    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6   -1    3    1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7   -1   -3   -1    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8    0   -4   -1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9   -1    3    0   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1   -3    0    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12   -1    3   -1   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    0   -4    1    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14   -1   -5    1    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15   -1    1   -1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0   -2    1    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17   -1   -3    1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18   -2   -4    1    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    0   -2    2    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20   -1   -3    2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0    0   -1   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22   -1   -1    2    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23   -1    1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    0   -2   -2   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3   -1    3    2   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4   -1   -1   -1   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    0   -2   -1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -1    3    1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7   -1   -3   -1    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    0   -4   -1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9   -1    3    0   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0   -2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1   -3    0    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12   -1    3   -1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    0   -4    1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14   -1   -5    1    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15   -1    1   -1   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    0   -2    1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17   -1   -3    1    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18   -2   -4    1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19    0   -2    2    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20   -1   -3    2    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    0    0   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -1   -1    2    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23   -1    1    2    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.161                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2381    1.7848    1.0860   89.9934  123.5210   91.2502      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2637    1.7789    1.0958   90.0000  125.7162   90.0000      0.4512         1.1533    1.6234    2.8010    3.9429    2.4287
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0271    0.0458    0.0199    0.0000    1.7094    0.0000      0.0309         0.0303    0.0333    0.2008    0.2881    0.1718
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1007    0.6189   -0.7389)
 a2 = (   -0.4722    0.2673    0.1404)
 a3 = (    0.5458    0.9574    0.0760)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1423    0.6327   -0.7275) (    0.0184    0.0129    0.0145)
 a2 = (   -0.4741    0.2677    0.1401) (    0.0127    0.0081    0.0031)
 a3 = (    0.5678    0.9673    0.0733) (    0.0164    0.0254    0.0069)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -71.5425   51.9032  138.9161    0.3690    1.4735    0.5854
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            400             81
# Figure of merit at the beginning and the end of the refinement
         7.5123        29.1830
# Chi-squares at the beginning and the end of the refinement
    0.6931    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0    2    2   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -1   -3   -1   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4   -1    1    2   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    0    2    1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -1   -3    0   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7   -1    3    2    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    0    4    1    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9   -1   -3    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    3    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -1   -3    2   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    0    4   -1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14   -1    5    0    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15   -1   -1    2   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0    2   -1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17   -1    3    0    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18   -2    4    1    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    0    2   -2    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -1    3   -1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0    0    1   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -1    1   -1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -1   -1   -1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    0    2    2   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3   -1   -3   -1   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4   -1    1    2   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    0    2    1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -1   -3    0   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7   -1    3    2    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    0    4    1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9   -1   -3    1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    3    1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12   -1   -3    2   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    0    4   -1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14   -1    5    0    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15   -1   -1    2   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    0    2   -1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17   -1    3    0    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18   -2    4    1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19    0    2   -2    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20   -1    3   -1    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    0    0    1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -1    1   -1    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23   -1   -1   -1    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.176                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2539    1.7889    1.0834   90.1996  124.6078   90.5611      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2541    1.7827    1.0905   90.0000  124.8882   90.0000      0.4511         1.1500    1.6348    2.7804    3.9523    2.4177
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0104    0.0295    0.0180    0.0000    0.6790    0.0000      0.0294         0.0167    0.0323    0.1826    0.2657    0.1625
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7321    0.5184    0.3665)
 a2 = (   -0.1618    0.4491   -0.2909)
 a3 = (   -0.0571    0.6053    0.9425)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7373    0.5162    0.3671) (    0.0058    0.0061    0.0065)
 a2 = (   -0.1669    0.4475   -0.2942) (    0.0045    0.0089    0.0039)
 a3 = (   -0.0467    0.6013    0.9412) (    0.0126    0.0108    0.0139)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  144.2415   40.2616 -116.2114    0.5738    0.4688    0.6934
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0067      0.0023    0.0023    0.0144

# Number of computed bands
             95             95
# Figure of merit at the beginning and the end of the refinement
         4.1659        28.6417
# Chi-squares at the beginning and the end of the refinement
    0.4532    0.0276
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2    1    3    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3    0   -4   -1   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4    2    2    2   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5    0    2    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6    1   -3   -1   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7    0    2    2    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8   -1    3    2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9    2   -2   -1   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10   -1    1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11   -1    1    2    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12    3   -1   -1   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13   -3    1    2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14   -3    1    3    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15    2    0    0   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16   -4    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17   -4    0    4    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18   -2    0    3    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19   -3   -1    1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20   -3   -1    2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21    2    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22   -2   -2    1    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23   -1   -3    0    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7319   -0.0561   -0.7310   -0.0567    0.0010    1          0.0662          0.0702
    2    1    3    1   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0993          0.0995
    3    0   -4   -1   -0.0271    0.0905   -0.0262    0.0895    0.0014    1          0.0974          0.0967
    4    1    1    1   -0.1962   -0.5871   -0.1957   -0.5833    0.0038    1          0.1028          0.1078
    5    0    2    1    0.0568   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6    1   -3   -1   -0.1080    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0    2    2    0.1215   -0.5968    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8   -1    3    2    0.1441   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9    2   -2   -1   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10   -1    1    1    0.2257   -0.1268    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11   -1    1    2    0.5378   -0.6116    0.5303   -0.6130    0.0075    1          0.1238          0.1248
   12    3   -1   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0021    1          0.1003          0.0984
   13   -3    1    2    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1009          0.0927
   14   -3    1    3    0.5297   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    2    0    0   -0.3362   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16   -2    0    1    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17   -2    0    2    0.7287   -0.0796    0.7293   -0.0807    0.0013    1          0.1150          0.1198
   18   -2    0    3    1.0607   -0.5072    1.0696   -0.4972    0.0135    1          0.2515          0.2483
   19   -3   -1    1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20   -3   -1    2    0.4450    0.1646    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    1    1    0   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22   -2   -2    1    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23   -1   -3    0    0.0351    0.2742    0.0347    0.2716    0.0026    1          0.0805          0.0816

###            No.177                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2602    1.7837    1.0901   90.3155  125.2954   89.7928      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2541    1.7827    1.0943   90.0000  125.1729   90.0000      0.4511         1.1460    1.6291    2.7804    3.9523    2.4261
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0124    0.0332    0.0160    0.0000    0.8059    0.0000      0.0291         0.0140    0.0276    0.1815    0.2655    0.1605
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7770    0.0871    0.5779)
 a2 = (    0.1692   -0.4462    0.2943)
 a3 = (   -0.0404    0.6035    0.9473)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7840    0.0851    0.5741) (    0.0046    0.0079    0.0059)
 a2 = (    0.1669   -0.4475    0.2942) (    0.0053    0.0097    0.0039)
 a3 = (   -0.0467    0.6013    0.9412) (    0.0120    0.0114    0.0111)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   48.2974   52.0295  139.1809    0.4841    0.4946    0.5068
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0067      0.0023    0.0023    0.0144

# Number of computed bands
             79             95
# Figure of merit at the beginning and the end of the refinement
         4.7313        28.6409
# Chi-squares at the beginning and the end of the refinement
    0.4803    0.0276
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2   -1   -3    2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    0    4   -1   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4   -1   -1    2   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5    0   -2    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1    3    0   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7    0   -2    2    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8    1   -3    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -2    2    1   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10    1   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1   -1    1    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12   -3    1    2   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13    3   -1   -1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    3   -1    0    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15   -2    0    2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    2    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    2    0    0    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18    2    0    1    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19    3    1   -2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    3    1   -1    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21   -1   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2    2   -1    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23    1    3   -1    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7319   -0.0561   -0.7310   -0.0567    0.0010    1          0.0662          0.0702
    2   -1   -3    2   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0993          0.0995
    3    0    4   -1   -0.0271    0.0905   -0.0262    0.0895    0.0014    1          0.0974          0.0967
    4   -1   -1    2   -0.1962   -0.5871   -0.1957   -0.5833    0.0038    1          0.1028          0.1078
    5    0   -2    1    0.0568   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1    3    0   -0.1080    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0   -2    2    0.1215   -0.5968    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8    1   -3    1    0.1441   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9   -2    2    1   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10    1   -1    0    0.2257   -0.1268    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    1   -1    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1238          0.1248
   12   -3    1    2   -0.1807   -0.0378   -0.1829   -0.0381    0.0021    1          0.1003          0.0984
   13    3   -1   -1    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1009          0.0927
   14    3   -1    0    0.5297   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -2    0    2   -0.3362   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16    2    0   -1    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17    2    0    0    0.7287   -0.0796    0.7293   -0.0807    0.0013    1          0.1150          0.1198
   18    2    0    1    1.0607   -0.5072    1.0696   -0.4972    0.0134    1          0.2515          0.2483
   19    3    1   -2    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    3    1   -1    0.4450    0.1646    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21   -1   -1    1   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    2    2   -1    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23    1    3   -1    0.0351    0.2742    0.0347    0.2716    0.0026    1          0.0805          0.0816

###            No.179                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2683    1.7860    1.0868   91.0375  125.6524   89.8312      0.4569
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2541    1.7827    1.0905   90.0000  124.8885   90.0000      0.4511         1.1500    1.6348    2.7804    3.9523    2.4176
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0104    0.0295    0.0180    0.0000    0.6790    0.0000      0.0294         0.0167    0.0323    0.1826    0.2657    0.1625
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7303   -0.5166   -0.3759)
 a2 = (   -0.1650    0.4424   -0.3011)
 a3 = (    0.0434   -0.6056   -0.9561)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7373   -0.5162   -0.3671) (    0.0058    0.0061    0.0065)
 a2 = (   -0.1669    0.4475   -0.2942) (    0.0045    0.0089    0.0039)
 a3 = (    0.0467   -0.6013   -0.9412) (    0.0126    0.0108    0.0139)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -144.2414  139.7384   63.7886    0.5738    0.4688    0.6934
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0067      0.0023    0.0023    0.0144

# Number of computed bands
             71             95
# Figure of merit at the beginning and the end of the refinement
        16.7330        28.6405
# Chi-squares at the beginning and the end of the refinement
    0.2251    0.0276
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7511   -0.0623   -0.7310   -0.0567    0.0209    1    0.0693    0.0702
    2   -1    3   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    0   -4    1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0988    0.0967
    4   -1    1   -1   -0.1978   -0.5929   -0.1957   -0.5833    0.0098    1    0.1063    0.1078
    5    0    2   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6   -1   -3    1   -0.1134    0.1266   -0.1085    0.1216    0.0071    1    0.0779    0.0778
    7    0    2   -2    0.1195   -0.6012    0.1201   -0.5973    0.0039    1    0.1356    0.1302
    8    1    3   -2    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9   -2   -2    1   -0.2044    0.0509   -0.1952    0.0486    0.0094    1    0.0792    0.0726
   10    1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1   -2    0.5374   -0.6221    0.5303   -0.6130    0.0115    1    0.1281    0.1248
   12   -3   -1    1   -0.1888   -0.0395   -0.1829   -0.0381    0.0062    1    0.1017    0.0984
   13    3    1   -2    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    3    1   -3    0.5354   -0.1528    0.5293   -0.1451    0.0097    1    0.1525    0.1473
   15   -2    0    0   -0.3431   -0.2427   -0.3362   -0.2357    0.0098    1    0.0897    0.0881
   16    2    0   -1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    2    0   -2    0.7400   -0.0851    0.7293   -0.0807    0.0116    1    0.1187    0.1198
   18    2    0   -3    1.0706   -0.5273    1.0696   -0.4972    0.0302    1    0.2642    0.2483
   19    3   -1   -1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    3   -1   -2    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1211    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    2   -2   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0920    0.0899
   23    1   -3    0    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0820    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7319   -0.0561   -0.7310   -0.0567    0.0010    1          0.0662          0.0702
    2   -1    3   -1   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0994          0.0995
    3    0   -4    1   -0.0271    0.0905   -0.0262    0.0895    0.0014    1          0.0974          0.0967
    4   -1    1   -1   -0.1962   -0.5871   -0.1957   -0.5833    0.0038    1          0.1028          0.1078
    5    0    2   -1    0.0568   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1   -3    1   -0.1080    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0    2   -2    0.1215   -0.5968    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8    1    3   -2    0.1441   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9   -2   -2    1   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10    1    1   -1    0.2257   -0.1268    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    1    1   -2    0.5378   -0.6116    0.5303   -0.6130    0.0075    1          0.1238          0.1248
   12   -3   -1    1   -0.1807   -0.0378   -0.1829   -0.0381    0.0021    1          0.1003          0.0984
   13    3    1   -2    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1009          0.0927
   14    3    1   -3    0.5297   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -2    0    0   -0.3362   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16    2    0   -1    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17    2    0   -2    0.7287   -0.0796    0.7293   -0.0807    0.0013    1          0.1150          0.1198
   18    2    0   -3    1.0607   -0.5072    1.0696   -0.4972    0.0134    1          0.2515          0.2483
   19    3   -1   -1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    3   -1   -2    0.4450    0.1646    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21   -1    1    0   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    2   -2   -1    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23    1   -3    0    0.0351    0.2742    0.0347    0.2716    0.0026    1          0.0805          0.0816

###            No.196                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2593    1.7861    1.0892   90.1062  125.2784   89.9166      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2541    1.7828    1.0943   90.0000  125.1734   90.0000      0.4511         1.1460    1.6291    2.7804    3.9524    2.4261
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0124    0.0332    0.0160    0.0000    0.8059    0.0000      0.0291         0.0140    0.0276    0.1816    0.2655    0.1605
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7793   -0.0888   -0.5752)
 a2 = (    0.1660   -0.4464    0.2943)
 a3 = (    0.0439   -0.6083   -0.9449)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7840   -0.0851   -0.5741) (    0.0046    0.0079    0.0059)
 a2 = (    0.1669   -0.4475    0.2942) (    0.0053    0.0097    0.0039)
 a3 = (    0.0467   -0.6013   -0.9412) (    0.0120    0.0114    0.0111)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -48.2974  127.9703  -40.8192    0.4841    0.4946    0.5068
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0067      0.0023    0.0023    0.0144

# Number of computed bands
            195             97
# Figure of merit at the beginning and the end of the refinement
         3.3663        28.4437
# Chi-squares at the beginning and the end of the refinement
    0.4820    0.0276
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2   -2   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    1   -3   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3    0    4    1   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4    2   -2   -4   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    0   -2   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6    1    3    0   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7    0   -2   -2    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8   -1   -3   -1    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9    2    2   -1   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1   -1   -1    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12    3    1   -2   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13   -3   -1    1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14   -3   -1    0    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15    2    0   -2   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16   -4    0    2    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17   -4    0    0    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18   -2    0   -1    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19   -5    1    3    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20   -3    1    1    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    2   -2   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22   -2    2    1    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -1    3    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7319   -0.0561   -0.7310   -0.0567    0.0010    1          0.0662          0.0702
    2    1   -3   -2   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0993          0.0995
    3    0    4    1   -0.0271    0.0905   -0.0262    0.0895    0.0014    1          0.0974          0.0967
    4    1   -1   -2   -0.1962   -0.5871   -0.1957   -0.5833    0.0038    1          0.1028          0.1078
    5    0   -2   -1    0.0568   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6    1    3    0   -0.1080    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0   -2   -2    0.1215   -0.5968    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8   -1   -3   -1    0.1441   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9    2    2   -1   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10   -1   -1    0    0.2257   -0.1268    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11   -1   -1   -1    0.5378   -0.6116    0.5303   -0.6130    0.0075    1          0.1238          0.1248
   12    3    1   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0021    1          0.1003          0.0984
   13   -3   -1    1    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1009          0.0927
   14   -3   -1    0    0.5297   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    2    0   -2   -0.3362   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16   -2    0    1    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17   -2    0    0    0.7287   -0.0796    0.7293   -0.0807    0.0013    1          0.1150          0.1198
   18   -2    0   -1    1.0607   -0.5072    1.0696   -0.4972    0.0135    1          0.2515          0.2483
   19   -3    1    2    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20   -3    1    1    0.4450    0.1646    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    1   -1   -1   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22   -2    2    1    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23   -1    3    1    0.0351    0.2742    0.0347    0.2716    0.0026    1          0.0805          0.0816

###            No.201                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7910    1.2478    1.2480   90.0027  134.1510   91.3759      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7831    1.2538    1.2593   90.0000  134.7356   90.0000      0.4526         1.4160    0.9956    3.9393    2.7700    2.7821
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1091    0.1100    0.1065    0.0000    3.5391    0.0000      0.0310         0.0373    0.0152    0.3620    0.3084    0.3028
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1188    0.1484   -0.7551)
 a2 = (    0.7647    0.2169   -0.1053)
 a3 = (    0.0716   -0.6092   -0.9336)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1441    0.1460   -0.7623) (    0.0056    0.0195    0.0039)
 a2 = (    0.7609    0.2161   -0.1025) (    0.0680    0.0180    0.0046)
 a3 = (    0.0452   -0.6046   -0.9391) (    0.0217    0.0530    0.0072)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.5775  103.0556   14.1307    0.4926    1.3901    0.3803
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0090      0.0024    0.0024    0.0918

# Number of computed bands
            400             92
# Figure of merit at the beginning and the end of the refinement
         5.8773        28.2770
# Chi-squares at the beginning and the end of the refinement
    1.0494    0.0189
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    3    1   -3   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -4    0    3   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    1    1   -2   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    2    0   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -3    1    2   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    2    0   -3    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    3   -1   -3    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9   -2    2    1   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    1   -1   -2    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12   -1    3    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    1   -3   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    1   -3   -2    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    0    2   -1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    0   -2   -1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    0   -2   -2    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19   -1   -3    1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -1   -3    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    1    1   -1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -2   -2    1    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -3   -1    2    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7312   -0.0569   -0.7310   -0.0567    0.0003    1          0.0661          0.0702
    2    3    1   -3   -0.0134   -0.1742   -0.0130   -0.1762    0.0020    1          0.0998          0.0995
    3   -4    0    3   -0.0264    0.0894   -0.0262    0.0895    0.0003    1          0.0977          0.0967
    4    1    1   -2   -0.1958   -0.5855   -0.1957   -0.5833    0.0022    1          0.1030          0.1078
    5    2    0   -2    0.0566   -0.2238    0.0560   -0.2234    0.0008    1          0.0644          0.0654
    6   -3    1    2   -0.1071    0.1193   -0.1085    0.1216    0.0026    1          0.0770          0.0778
    7    2    0   -3    0.1201   -0.5956    0.1201   -0.5973    0.0017    1          0.1318          0.1302
    8    3   -1   -3    0.1438   -0.2203    0.1454   -0.2240    0.0040    1          0.1035          0.1017
    9   -2    2    1   -0.1946    0.0484   -0.1952    0.0486    0.0006    1          0.0782          0.0726
   10    1   -1   -1    0.2255   -0.1271    0.2251   -0.1274    0.0005    1          0.0462          0.0467
   11    1   -1   -2    0.5349   -0.6123    0.5303   -0.6130    0.0047    1          0.1236          0.1248
   12   -1    3    0   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1005          0.0984
   13    1   -3   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1          0.1010          0.0927
   14    1   -3   -2    0.5290   -0.1489    0.5293   -0.1451    0.0038    1          0.1491          0.1473
   15    0    2   -1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0876          0.0881
   16    0   -2    0    0.1260    0.0354    0.1275    0.0362    0.0017    1          0.0625          0.0679
   17    0   -2   -1    0.7281   -0.0805    0.7293   -0.0807    0.0013    1          0.1147          0.1198
   18    0   -2   -2    1.0582   -0.5103    1.0696   -0.4972    0.0174    1          0.2505          0.2483
   19   -1   -3    1    0.0437    0.0287    0.0442    0.0295    0.0009    1          0.0975          0.0994
   20   -1   -3    0    0.4438    0.1644    0.4423    0.1634    0.0017    1          0.1186          0.1178
   21    1    1   -1   -0.0338   -0.0578   -0.0341   -0.0579    0.0004    1          0.0436          0.0568
   22   -2   -2    1    0.2985    0.3332    0.3053    0.3413    0.0106    1          0.0900          0.0899
   23   -3   -1    2    0.0350    0.2720    0.0347    0.2716    0.0005    1          0.0806          0.0816

###            No.202                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7766    1.2600    1.2588   90.0189  134.7885   89.9880      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7993    1.2484    1.2745   90.0000  135.6852   90.0000      0.4498         1.4119    0.9796    4.0002    2.7755    2.8333
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0949    0.0174    0.0920    0.0000    2.9502    0.0000      0.0488         0.0316    0.0712    0.4824    0.3034    0.3691
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1884   -0.7498   -0.1767)
 a2 = (    0.7569    0.2147   -0.1043)
 a3 = (    0.3341   -0.8895    0.5916)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1905   -0.7524   -0.1746) (    0.0047    0.0027    0.0130)
 a2 = (    0.7642    0.2172   -0.1024) (    0.0110    0.0051    0.0059)
 a3 = (    0.3340   -0.9004    0.5825) (    0.0127    0.0126    0.0446)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -120.2258   14.7183   45.2695    1.2099    1.0092    1.2999
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005   -0.0218      0.0023    0.0023    0.0791

# Number of computed bands
            179             83
# Figure of merit at the beginning and the end of the refinement
         3.2809        27.9899
# Chi-squares at the beginning and the end of the refinement
    1.2664    0.0472
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    2   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2   -5    1    0    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    2    0    1   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4   -6    2    2   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5   -4    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2    2    2   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7   -4    0    1    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8   -3   -1    0    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    0    2    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10   -2   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -6   -2    2    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12   -1    3    1   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13   -1   -3    0    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -3   -3    1    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15   -4    4    2   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    0   -4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -4   -4    2    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18   -4   -2    2    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    1   -5    0    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -1   -3    1    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21   -2    2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    0   -2    1    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23    2   -2    2    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7325   -0.0564   -0.7310   -0.0567    0.0015    1          0.0643          0.0702
    2   -3    1    0   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.0980          0.0995
    3    2    0    1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0962          0.0967
    4   -3    1    1   -0.1960   -0.5866   -0.1957   -0.5833    0.0033    1          0.1002          0.1078
    5   -2    0    0    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0632          0.0654
    6    1    1    1   -0.1079    0.1199   -0.1085    0.1216    0.0018    1          0.0757          0.0778
    7   -4    0    1    0.1211   -0.5966    0.1201   -0.5973    0.0012    1          0.1284          0.1302
    8   -3   -1    0    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1015          0.1017
    9    0    2    1   -0.1948    0.0483   -0.1952    0.0486    0.0005    1          0.0769          0.0726
   10   -1   -1    0    0.2258   -0.1270    0.2251   -0.1274    0.0008    1          0.0454          0.0467
   11   -3   -1    1    0.5376   -0.6121    0.5303   -0.6130    0.0074    1          0.1200          0.1248
   12   -1    3    1   -0.1808   -0.0379   -0.1829   -0.0381    0.0021    1          0.0988          0.0984
   13   -1   -3    0    0.1982   -0.0086    0.1990   -0.0092    0.0010    1          0.0994          0.0927
   14   -3   -3    1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1457          0.1473
   15   -2    2    1   -0.3359   -0.2362   -0.3362   -0.2357    0.0006    1          0.0857          0.0881
   16    0   -2    0    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0616          0.0679
   17   -2   -2    1    0.7290   -0.0792    0.7293   -0.0807    0.0016    1          0.1118          0.1198
   18   -4   -2    2    1.0613   -0.5071    1.0696   -0.4972    0.0129    1          0.2419          0.2483
   19    1   -3    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0960          0.0994
   20   -1   -3    1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1163          0.1178
   21   -1    1    0   -0.0332   -0.0569   -0.0341   -0.0579    0.0014    1          0.0428          0.0568
   22    0   -2    1    0.2997    0.3343    0.3053    0.3413    0.0090    1          0.0883          0.0899
   23    1   -1    1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0793          0.0816

###            No.203                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7773    1.2613    1.2563   90.1855  134.7504   89.8708      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7808    1.2484    1.2745   90.0000  135.1009   90.0000      0.4498         1.3973    0.9796    3.9591    2.7755    2.8333
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0415    0.0174    0.0920    0.0000    1.3301    0.0000      0.0488         0.0723    0.0712    0.4391    0.3034    0.3691
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1882    0.7491    0.1765)
 a2 = (   -0.7561   -0.2145    0.1042)
 a3 = (   -0.0430    0.6011    0.9451)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1905    0.7524    0.1746) (    0.0047    0.0027    0.0130)
 a2 = (   -0.7642   -0.2172    0.1024) (    0.0110    0.0051    0.0059)
 a3 = (   -0.0469    0.6044    0.9318) (    0.0149    0.0112    0.0689)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.7742   14.7183   45.2695    1.2099    1.0092    1.2999
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005   -0.0218      0.0023    0.0023    0.0791

# Number of computed bands
            173             83
# Figure of merit at the beginning and the end of the refinement
         3.3422        27.9899
# Chi-squares at the beginning and the end of the refinement
    1.2575    0.0472
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    2   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    5   -1    0    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3   -4    0    1   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2   -2    2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    4    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -6   -2    2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    2    0    1    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    3    1    0    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -2   -2    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    2    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2    2    2    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12   -1   -3    1   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    1    3    0    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1    3    1    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    0   -4    2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    0    4    2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    0    2    2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19   -1    5    0    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -1    3    1    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    2   -2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -2    2    1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23   -6    2    2    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7325   -0.0564   -0.7310   -0.0567    0.0015    1          0.0643          0.0702
    2    3   -1    0   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.0980          0.0995
    3   -4    0    1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0962          0.0967
    4    1   -1    1   -0.1960   -0.5866   -0.1957   -0.5833    0.0033    1          0.1002          0.1078
    5    2    0    0    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0632          0.0654
    6   -3   -1    1   -0.1079    0.1199   -0.1085    0.1216    0.0018    1          0.0757          0.0778
    7    2    0    1    0.1211   -0.5966    0.1201   -0.5973    0.0012    1          0.1284          0.1302
    8    3    1    0    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1015          0.1017
    9   -2   -2    1   -0.1948    0.0483   -0.1952    0.0486    0.0005    1          0.0769          0.0726
   10    1    1    0    0.2258   -0.1270    0.2251   -0.1274    0.0008    1          0.0454          0.0467
   11    1    1    1    0.5376   -0.6121    0.5303   -0.6130    0.0074    1          0.1200          0.1248
   12   -1   -3    1   -0.1808   -0.0379   -0.1829   -0.0381    0.0021    1          0.0988          0.0984
   13    1    3    0    0.1982   -0.0086    0.1990   -0.0092    0.0010    1          0.0994          0.0927
   14    1    3    1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1457          0.1473
   15    0   -2    1   -0.3359   -0.2362   -0.3362   -0.2357    0.0006    1          0.0857          0.0881
   16    0    2    0    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0616          0.0679
   17    0    2    1    0.7290   -0.0792    0.7293   -0.0807    0.0016    1          0.1118          0.1198
   18    0    2    2    1.0613   -0.5071    1.0696   -0.4972    0.0129    1          0.2419          0.2483
   19   -1    3    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0960          0.0994
   20   -1    3    1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1163          0.1178
   21    1   -1    0   -0.0332   -0.0569   -0.0341   -0.0579    0.0014    1          0.0428          0.0568
   22   -2    2    1    0.2997    0.3343    0.3053    0.3413    0.0090    1          0.0883          0.0899
   23   -3    1    1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0793          0.0816

###            No.204                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7678    1.2807    1.2381   88.2634  134.4512   91.8162      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7835    1.2540    1.2659   90.0000  135.0582   90.0000      0.4533         1.4089    0.9906    3.9347    2.7666    2.7927
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0464    0.0184    0.1061    0.0000    1.4877    0.0000      0.0532         0.0856    0.0855    0.4733    0.3274    0.4029
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1993    0.7460    0.1784)
 a2 = (   -0.7451   -0.2113    0.1023)
 a3 = (   -0.0271    0.6058    0.9553)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1892    0.7504    0.1763) (    0.0051    0.0031    0.0152)
 a2 = (   -0.7607   -0.2160    0.1029) (    0.0116    0.0052    0.0067)
 a3 = (   -0.0448    0.6053    0.9393) (    0.0179    0.0121    0.0809)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.8442   14.8848   45.1637    1.2326    1.2023    1.3321
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0104      0.0024    0.0024    0.0906

# Number of computed bands
            400             92
# Figure of merit at the beginning and the end of the refinement
         7.5123        27.4949
# Chi-squares at the beginning and the end of the refinement
    0.2596    0.0242
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    3   -1    0   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -4    0    1   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1   -1    1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    2    0    0    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -3   -1    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    2    0    1    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    3    1    0    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9   -2   -2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -1   -3    1   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    1    3    0    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    1    3    1    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    0   -2    1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0    2    0    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    0    2    1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    0    2    2    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19   -1    3    0    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20   -1    3    1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    1   -1    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22   -2    2    1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -3    1    1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7321   -0.0576   -0.7310   -0.0567    0.0014    1          0.0661          0.0702
    2    3   -1    0   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0997          0.0995
    3   -4    0    1   -0.0267    0.0904   -0.0262    0.0895    0.0011    1          0.0977          0.0967
    4    1   -1    1   -0.1959   -0.5856   -0.1957   -0.5833    0.0023    1          0.1029          0.1078
    5    2    0    0    0.0565   -0.2235    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -3   -1    1   -0.1077    0.1200   -0.1085    0.1216    0.0017    1          0.0769          0.0778
    7    2    0    1    0.1200   -0.5960    0.1201   -0.5973    0.0013    1          0.1318          0.1302
    8    3    1    0    0.1438   -0.2203    0.1454   -0.2240    0.0040    1          0.1034          0.1017
    9   -2   -2    1   -0.1950    0.0485   -0.1952    0.0486    0.0002    1          0.0782          0.0726
   10    1    1    0    0.2258   -0.1272    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11    1    1    1    0.5354   -0.6135    0.5303   -0.6130    0.0051    1          0.1236          0.1248
   12   -1   -3    1   -0.1811   -0.0379   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    1    3    0    0.1982   -0.0085    0.1990   -0.0092    0.0010    1          0.1010          0.0927
   14    1    3    1    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1491          0.1473
   15    0   -2    1   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0875          0.0881
   16    0    2    0    0.1268    0.0356    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17    0    2    1    0.7301   -0.0811    0.7293   -0.0807    0.0008    1          0.1148          0.1198
   18    0    2    2    1.0600   -0.5125    1.0696   -0.4972    0.0181    1          0.2508          0.2483
   19   -1    3    0    0.0445    0.0292    0.0442    0.0295    0.0004    1          0.0975          0.0994
   20   -1    3    1    0.4455    0.1649    0.4423    0.1634    0.0035    1          0.1187          0.1178
   21    1   -1    0   -0.0334   -0.0572   -0.0341   -0.0579    0.0011    1          0.0435          0.0568
   22   -2    2    1    0.3000    0.3347    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23   -3    1    1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0806          0.0816

###            No.205                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7783    1.2593    1.2594   90.0865  134.8397   89.9611      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7997    1.2482    1.2569   90.0000  134.9001   90.0000      0.4500         1.4319    0.9931    3.9992    2.7738    2.7930
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0399    0.0904    0.0900    0.0000    1.2759    0.0000      0.0296         0.0751    0.0138    0.2775    0.2712    0.2715
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1441   -0.1423    0.7667)
 a2 = (   -0.7574   -0.2154    0.1028)
 a3 = (    0.3321   -0.8929    0.5886)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1435   -0.1480    0.7569) (    0.0049    0.0169    0.0035)
 a2 = (   -0.7643   -0.2172    0.1024) (    0.0564    0.0150    0.0043)
 a3 = (    0.3340   -0.9005    0.5823) (    0.0156    0.0699    0.0052)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   82.4512  103.2745   14.1246    0.4068    1.2203    0.3679
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005   -0.0224      0.0023    0.0023    0.0792

# Number of computed bands
            195             87
# Figure of merit at the beginning and the end of the refinement
         3.3663        27.3226
# Chi-squares at the beginning and the end of the refinement
    0.4823    0.0473
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    3   -1   -3   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3   -2    0    3   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4    6   -2   -4   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    2    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6   -1   -1    2   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7    4    0   -3    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8    3    1   -3    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9    0   -2    1   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10    1    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    3    1   -2    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12    1   -3    0   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13    1    3   -1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14    3    3   -2    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15    2   -2   -1   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16    0    4    0    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17    4    4   -2    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18    4    2   -2    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19   -1    5    1    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20    1    3    0    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    2   -2   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22    0    2    1    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -1    1    2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7326   -0.0564   -0.7310   -0.0567    0.0016    1          0.0643          0.0702
    2    3   -1   -3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.0980          0.0995
    3   -2    0    3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0962          0.0967
    4    3   -1   -2   -0.1960   -0.5866   -0.1957   -0.5833    0.0033    1          0.1002          0.1078
    5    2    0   -2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0632          0.0654
    6   -1   -1    2   -0.1079    0.1199   -0.1085    0.1216    0.0018    1          0.0757          0.0778
    7    4    0   -3    0.1211   -0.5966    0.1201   -0.5973    0.0012    1          0.1284          0.1302
    8    3    1   -3    0.1439   -0.2201    0.1454   -0.2240    0.0041    1          0.1015          0.1017
    9    0   -2    1   -0.1948    0.0483   -0.1952    0.0486    0.0005    1          0.0769          0.0726
   10    1    1   -1    0.2258   -0.1270    0.2251   -0.1274    0.0008    1          0.0454          0.0467
   11    3    1   -2    0.5377   -0.6121    0.5303   -0.6130    0.0074    1          0.1200          0.1248
   12    1   -3    0   -0.1808   -0.0379   -0.1829   -0.0381    0.0021    1          0.0988          0.0984
   13    1    3   -1    0.1982   -0.0086    0.1990   -0.0092    0.0009    1          0.0994          0.0927
   14    3    3   -2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1457          0.1473
   15    2   -2   -1   -0.3359   -0.2362   -0.3362   -0.2357    0.0006    1          0.0856          0.0881
   16    0    2    0    0.1269    0.0355    0.1275    0.0362    0.0008    1          0.0616          0.0679
   17    2    2   -1    0.7290   -0.0792    0.7293   -0.0807    0.0016    1          0.1117          0.1198
   18    4    2   -2    1.0613   -0.5070    1.0696   -0.4972    0.0129    1          0.2417          0.2483
   19   -1    3    1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0960          0.0994
   20    1    3    0    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1163          0.1178
   21    1   -1   -1   -0.0332   -0.0569   -0.0341   -0.0579    0.0014    1          0.0428          0.0568
   22    0    2    1    0.2997    0.3343    0.3053    0.3413    0.0090    1          0.0883          0.0899
   23   -1    1    2    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0793          0.0816

###            No.206                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7805    1.2606    1.2584   89.8816  134.9207   90.0890      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7997    1.2482    1.2749   90.0000  135.7046   90.0000      0.4500         1.4117    0.9791    3.9992    2.7738    2.8329
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0950    0.0174    0.0921    0.0000    2.9512    0.0000      0.0489         0.0316    0.0712    0.4827    0.3036    0.3694
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1883    0.7497    0.1781)
 a2 = (    0.7567    0.2146   -0.1028)
 a3 = (   -0.3353    0.8942   -0.5893)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1905    0.7525    0.1746) (    0.0047    0.0027    0.0130)
 a2 = (    0.7643    0.2172   -0.1024) (    0.0110    0.0051    0.0059)
 a3 = (   -0.3340    0.9005   -0.5823) (    0.0127    0.0126    0.0446)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  120.2302  165.2882 -134.7261    1.2098    1.0094    1.2999
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005   -0.0224      0.0023    0.0023    0.0792

# Number of computed bands
            175             89
# Figure of merit at the beginning and the end of the refinement
         3.4923        27.1143
# Chi-squares at the beginning and the end of the refinement
    0.4841    0.0473
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2    3    1    0   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3   -2    0   -1   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4    6    2   -2   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5    2    0    0    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6   -1    1   -1   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7    4    0   -1    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8    3   -1    0    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9    0    2   -1   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11    3   -1   -1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12    1    3   -1   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13    1   -3    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14    3   -3   -1    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15    2    2   -1   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16    0   -4    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17    4   -4   -2    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18    4   -2   -2    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19   -1   -5    0    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20    1   -3   -1    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21    2    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22    0   -2   -1    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23   -1   -1   -1    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7326   -0.0564   -0.7310   -0.0567    0.0016    1          0.0643          0.0702
    2    3    1    0   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.0980          0.0995
    3   -2    0   -1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0962          0.0967
    4    3    1   -1   -0.1960   -0.5866   -0.1957   -0.5833    0.0033    1          0.1002          0.1078
    5    2    0    0    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0632          0.0654
    6   -1    1   -1   -0.1079    0.1199   -0.1085    0.1216    0.0018    1          0.0757          0.0778
    7    4    0   -1    0.1211   -0.5966    0.1201   -0.5973    0.0012    1          0.1284          0.1302
    8    3   -1    0    0.1439   -0.2201    0.1454   -0.2240    0.0041    1          0.1015          0.1017
    9    0    2   -1   -0.1948    0.0483   -0.1952    0.0486    0.0005    1          0.0769          0.0726
   10    1   -1    0    0.2258   -0.1270    0.2251   -0.1274    0.0008    1          0.0454          0.0467
   11    3   -1   -1    0.5377   -0.6121    0.5303   -0.6130    0.0074    1          0.1200          0.1248
   12    1    3   -1   -0.1808   -0.0379   -0.1829   -0.0381    0.0021    1          0.0988          0.0984
   13    1   -3    0    0.1982   -0.0086    0.1990   -0.0092    0.0009    1          0.0994          0.0927
   14    3   -3   -1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1457          0.1473
   15    2    2   -1   -0.3359   -0.2362   -0.3362   -0.2357    0.0006    1          0.0856          0.0881
   16    0   -2    0    0.1269    0.0355    0.1275    0.0362    0.0008    1          0.0616          0.0679
   17    2   -2   -1    0.7290   -0.0792    0.7293   -0.0807    0.0016    1          0.1117          0.1198
   18    4   -2   -2    1.0613   -0.5070    1.0696   -0.4972    0.0129    1          0.2417          0.2483
   19   -1   -3    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0960          0.0994
   20    1   -3   -1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1163          0.1178
   21    1    1    0   -0.0332   -0.0569   -0.0341   -0.0579    0.0014    1          0.0428          0.0568
   22    0   -2   -1    0.2997    0.3343    0.3053    0.3413    0.0090    1          0.0883          0.0899
   23   -1   -1   -1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0793          0.0816

###            No.208                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2381    1.8111    1.0749   89.9981  123.9036   91.2240      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2442    1.7952    1.0964   90.0000  125.2488   90.0000      0.4398         1.1348    1.6373    2.8289    4.0816    2.4929
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0168    0.2256    0.1246    0.0000    1.0951    0.0000      0.0316         0.1341    0.0332    0.2069    0.5909    0.3352
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3000    0.1271    0.9173)
 a2 = (    0.2729    0.4787    0.0380)
 a3 = (   -0.9444    0.5347    0.2807)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3276    0.1208    0.9201) (    0.0342    0.0265    0.0156)
 a2 = (    0.2819    0.4790    0.0375) (    0.0348    0.0609    0.0030)
 a3 = (   -0.9402    0.5311    0.2849) (    0.1189    0.0701    0.0075)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   85.8832  110.3864 -121.9162    0.3871    2.6592    0.3921
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003    0.0186      0.0024    0.0024    0.1402

# Number of computed bands
            400             79
# Figure of merit at the beginning and the end of the refinement
         7.5123        23.9537
# Chi-squares at the beginning and the end of the refinement
    0.6367    0.0253
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    0    4    1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3    1   -3   -2   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    1    3    0   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    0    2    1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6    1   -1   -2   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    1    3    1    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    0    2    2    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9    1    1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    1    3   -2   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    0   -2    2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    1   -1    2    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15    1    3   -1   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    0   -2    1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    1   -1    1    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    2    0    1    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    0   -4    1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    1   -3    1    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0    2    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    1   -3    0    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23    1   -3   -1    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7335   -0.0566   -0.7310   -0.0567    0.0025    1          0.0674          0.0702
    2    0    4    1   -0.0131   -0.1736   -0.0130   -0.1762    0.0026    1          0.0990          0.0995
    3    1   -3   -2   -0.0266    0.0899   -0.0262    0.0895    0.0007    1          0.0969          0.0967
    4    1    3    0   -0.1947   -0.5860   -0.1957   -0.5833    0.0029    1          0.1043          0.1078
    5    0    2    1    0.0565   -0.2232    0.0560   -0.2234    0.0006    1          0.0641          0.0654
    6    1   -1   -2   -0.1072    0.1198   -0.1085    0.1216    0.0022    1          0.0764          0.0778
    7    1    3    1    0.1203   -0.5950    0.1201   -0.5973    0.0024    1          0.1335          0.1302
    8    0    2    2    0.1435   -0.2201    0.1454   -0.2240    0.0043    1          0.1030          0.1017
    9    1    1   -2   -0.1949    0.0489   -0.1952    0.0486    0.0005    1          0.0775          0.0726
   10    0    0    1    0.2256   -0.1276    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11    1    1    1    0.5343   -0.6129    0.5303   -0.6130    0.0040    1          0.1266          0.1248
   12    1    3   -2   -0.1814   -0.0378   -0.1829   -0.0381    0.0015    1          0.0994          0.0984
   13    0   -2    2    0.1985   -0.0087    0.1990   -0.0092    0.0006    1          0.1001          0.0927
   14    1   -1    2    0.5303   -0.1501    0.5293   -0.1451    0.0051    1          0.1505          0.1473
   15    1    3   -1   -0.3362   -0.2371   -0.3362   -0.2357    0.0014    1          0.0876          0.0881
   16    0   -2    1    0.1269    0.0357    0.1275    0.0362    0.0007    1          0.0618          0.0679
   17    1   -1    1    0.7304   -0.0817    0.7293   -0.0807    0.0015    1          0.1171          0.1198
   18    2    0    1    1.0590   -0.5131    1.0696   -0.4972    0.0191    1          0.2609          0.2483
   19    0   -4    1    0.0444    0.0294    0.0442    0.0295    0.0003    1          0.0963          0.0994
   20    1   -3    1    0.4460    0.1653    0.4423    0.1634    0.0041    1          0.1192          0.1178
   21    0    2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0431          0.0568
   22    1   -3    0    0.2993    0.3353    0.3053    0.3413    0.0085    1          0.0904          0.0899
   23    1   -3   -1    0.0347    0.2731    0.0347    0.2716    0.0015    1          0.0803          0.0816

###            No.209                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7546    1.2752    1.2515   91.2081  134.3971   89.8254      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7803    1.2484    1.2564   90.0000  134.2542   90.0000      0.4583         1.4170    0.9937    3.8846    2.7241    2.7414
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0922    0.0917    0.0906    0.0000    3.0449    0.0000      0.0307         0.0331    0.0144    0.3287    0.2706    0.2697
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1625   -0.1567    0.7651)
 a2 = (    0.7445    0.2270   -0.0982)
 a3 = (   -0.0268    0.5989    0.9445)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1433   -0.1489    0.7565) (    0.0051    0.0170    0.0036)
 a2 = (    0.7642    0.2172   -0.1020) (    0.0572    0.0151    0.0044)
 a3 = (   -0.0472    0.6038    0.9317) (    0.0182    0.0461    0.0068)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.5223   76.6616 -165.8767    0.4120    1.2306    0.3748
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006   -0.0205      0.0023    0.0023    0.0802

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         8.6014        23.1807
# Chi-squares at the beginning and the end of the refinement
    0.4797    0.0224
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -3    1    3   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    4    0   -3   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -1    1    2   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -2    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    3    1   -2   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -2    0    3    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -3   -1    3    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    2    2   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11   -1   -1    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    1    3    0   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13   -1   -3    1    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14   -1   -3    2    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    0    2    1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0   -2    0    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    0   -2    1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    0   -2    2    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    1   -3   -1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    1   -3    0    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1    1    1   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    2   -2   -1    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    3   -1   -2    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7317   -0.0557   -0.7310   -0.0567    0.0012    1          0.0656          0.0702
    2   -3    1    3   -0.0134   -0.1741   -0.0130   -0.1762    0.0021    1          0.1001          0.0995
    3    4    0   -3   -0.0266    0.0894   -0.0262    0.0895    0.0004    1          0.0982          0.0967
    4   -1    1    2   -0.1959   -0.5866   -0.1957   -0.5833    0.0033    1          0.1023          0.1078
    5   -2    0    2    0.0566   -0.2238    0.0560   -0.2234    0.0008    1          0.0645          0.0654
    6    3    1   -2   -0.1072    0.1191   -0.1085    0.1216    0.0027    1          0.0773          0.0778
    7   -2    0    3    0.1211   -0.5963    0.1201   -0.5973    0.0014    1          0.1311          0.1302
    8   -3   -1    3    0.1439   -0.2202    0.1454   -0.2240    0.0040    1          0.1037          0.1017
    9    2    2   -1   -0.1944    0.0482   -0.1952    0.0486    0.0009    1          0.0784          0.0726
   10   -1   -1    1    0.2255   -0.1270    0.2251   -0.1274    0.0006    1          0.0463          0.0467
   11   -1   -1    2    0.5371   -0.6111    0.5303   -0.6130    0.0070    1          0.1225          0.1248
   12    1    3    0   -0.1809   -0.0379   -0.1829   -0.0381    0.0020    1          0.1008          0.0984
   13   -1   -3    1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1          0.1014          0.0927
   14   -1   -3    2    0.5289   -0.1479    0.5293   -0.1451    0.0028    1          0.1487          0.1473
   15    0    2    1   -0.3360   -0.2362   -0.3362   -0.2357    0.0005    1          0.0874          0.0881
   16    0   -2    0    0.1262    0.0353    0.1275    0.0362    0.0016    1          0.0628          0.0679
   17    0   -2    1    0.7273   -0.0787    0.7293   -0.0807    0.0029    1          0.1139          0.1198
   18    0   -2    2    1.0597   -0.5054    1.0696   -0.4972    0.0128    1          0.2466          0.2483
   19    1   -3   -1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0980          0.0994
   20    1   -3    0    0.4432    0.1645    0.4423    0.1634    0.0014    1          0.1186          0.1178
   21   -1    1    1   -0.0336   -0.0576   -0.0341   -0.0579    0.0006    1          0.0437          0.0568
   22    2   -2   -1    0.2982    0.3328    0.3053    0.3413    0.0111    1          0.0900          0.0899
   23    3   -1   -2    0.0350    0.2721    0.0347    0.2716    0.0006    1          0.0809          0.0816

###            No.211                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7676    1.2726    1.2366   89.6593  134.0272   90.2841      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7806    1.2471    1.2772   90.0000  135.1534   90.0000      0.4607         1.3942    0.9765    3.8651    2.7071    2.7723
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0418    0.0174    0.0926    0.0000    1.3394    0.0000      0.0503         0.0723    0.0713    0.4321    0.2982    0.3636
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1860   -0.7426   -0.1817)
 a2 = (   -0.7503   -0.2125    0.0967)
 a3 = (    0.0450   -0.5817   -0.9615)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1907   -0.7533   -0.1743) (    0.0047    0.0027    0.0130)
 a2 = (   -0.7650   -0.2174    0.1023) (    0.0110    0.0051    0.0059)
 a3 = (    0.0476   -0.6051   -0.9297) (    0.0149    0.0112    0.0690)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -59.7466  165.3246 -134.7034    1.2095    1.0107    1.2996
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0253      0.0023    0.0023    0.0797

# Number of computed bands
            400             87
# Figure of merit at the beginning and the end of the refinement
         6.3733        21.4380
# Chi-squares at the beginning and the end of the refinement
    0.1830    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2   -3   -1    0   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    4    0   -1   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1   -1   -1   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5   -2    0    0    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    3   -1   -1   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7   -2    0   -1    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8   -3    1    0    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    2   -2   -1   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    1   -1    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    1   -3   -1   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13   -1    3    0    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14   -1    3   -1    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15    0   -2   -1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0    2    0    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    0    2   -1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    0    2   -2    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    1    3    0    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    1    3   -1    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21   -1   -1    0   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    2    2   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    3    1   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2   -3   -1    0   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3    4    0   -1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4   -1   -1   -1   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5   -2    0    0    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6    3   -1   -1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7   -2    0   -1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8   -3    1    0    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9    2   -2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10   -1    1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -1    1   -1    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12    1   -3   -1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13   -1    3    0    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14   -1    3   -1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15    0   -2   -1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0    2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17    0    2   -1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18    0    2   -2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19    1    3    0    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20    1    3   -1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21   -1   -1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22    2    2   -1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    3    1   -1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.216                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7811    1.2564    1.2565   89.9926  134.6603   90.0358      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.8016    1.2471    1.2558   90.0000  134.8575   90.0000      0.4607         1.4347    0.9931    3.9107    2.7070    2.7258
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0399    0.0906    0.0901    0.0000    1.2760    0.0000      0.0303         0.0756    0.0138    0.2715    0.2653    0.2654
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1445    0.1419   -0.7629)
 a2 = (   -0.7593   -0.2154    0.1032)
 a3 = (   -0.3335    0.8941   -0.5842)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1432    0.1482   -0.7554) (    0.0049    0.0169    0.0035)
 a2 = (   -0.7650   -0.2174    0.1023) (    0.0566    0.0150    0.0043)
 a3 = (   -0.3339    0.9016   -0.5811) (    0.0156    0.0701    0.0052)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.4634   76.6915 -165.8811    0.4081    1.2254    0.3678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0254      0.0023    0.0023    0.0797

# Number of computed bands
             91             87
# Figure of merit at the beginning and the end of the refinement
        11.9806        21.4237
# Chi-squares at the beginning and the end of the refinement
    0.0987    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2   -3   -1    3   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3    2    0   -3   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4   -3   -1    2   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5   -2    0    2    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6    1   -1   -2   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7   -4    0    3    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8   -3    1    3    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9    0   -2   -1   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11   -3    1    2    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12   -1   -3    0   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13   -1    3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14   -3    3    2    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15   -2   -2    1   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16    0    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17   -2    2    1    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18   -4    2    2    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19    1    3   -1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20   -1    3    0    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21   -1   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22    0    2   -1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23    1    1   -2    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2   -3   -1    3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3    2    0   -3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4   -3   -1    2   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5   -2    0    2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6    1   -1   -2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7   -4    0    3    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8   -3    1    3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9    0   -2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10   -1    1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -3    1    2    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12   -1   -3    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13   -1    3    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14   -3    3    2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15   -2   -2    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0    2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17   -2    2    1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18   -4    2    2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19    1    3   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -1    3    0    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21   -1   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22    0    2   -1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    1    1   -2    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.218                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.7807    1.2610    1.2569   89.9937  134.8759   90.0058      0.3033
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.7806    1.2471    1.2772   90.0000  135.1540   90.0000      0.4607         1.3941    0.9764    3.8649    2.7069    2.7723
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0419    0.0174    0.0926    0.0000    1.3395    0.0000      0.0504         0.0723    0.0713    0.4321    0.2982    0.3636
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1882    0.7493    0.1766)
 a2 = (   -0.7563   -0.2145    0.1042)
 a3 = (   -0.0413    0.6048    0.9450)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1908    0.7533    0.1743) (    0.0047    0.0027    0.0130)
 a2 = (   -0.7650   -0.2174    0.1023) (    0.0110    0.0051    0.0059)
 a3 = (   -0.0476    0.6051    0.9297) (    0.0149    0.0112    0.0690)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.7462   14.6749   45.2969    1.2095    1.0107    1.2996
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0254      0.0023    0.0023    0.0797

# Number of computed bands
            151             87
# Figure of merit at the beginning and the end of the refinement
         3.5634        21.4228
# Chi-squares at the beginning and the end of the refinement
    1.1843    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0901    0.0702
    2    5   -1    0    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1095    0.0995
    3   -4    0    1   -0.0273    0.0917   -0.0262    0.0895    0.0025    1    0.0659    0.0967
    4    2   -2    2   -0.1958   -0.5829   -0.1957   -0.5833    0.0004    1    0.1398    0.1078
    5    4    0    0    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0870    0.0654
    6   -3   -1    1   -0.1082    0.1208   -0.1085    0.1216    0.0008    1    0.0520    0.0778
    7    2    0    1    0.1179   -0.5938    0.1201   -0.5973    0.0042    1    0.0893    0.1302
    8    3    1    0    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0698    0.1017
    9   -2   -2    1   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0527    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0312    0.0467
   11    1    1    1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0841    0.1248
   12   -1   -3    1   -0.1810   -0.0374   -0.1829   -0.0381    0.0020    1    0.0676    0.0984
   13    1    3    0    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0679    0.0927
   14    1    3    1    0.5311   -0.1510    0.5293   -0.1451    0.0061    1    0.1010    0.1473
   15    0   -2    1   -0.3352   -0.2355   -0.3362   -0.2357    0.0011    1    0.0591    0.0881
   16    0    4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0842    0.0679
   17    0    4    2    0.7329   -0.0829    0.7293   -0.0807    0.0041    1    0.1567    0.1198
   18    0    2    2    1.0614   -0.5193    1.0696   -0.4972    0.0236    1    0.1720    0.2483
   19   -2    6    0    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1313    0.0994
   20   -1    3    1    0.4477    0.1663    0.4423    0.1634    0.0060    1    0.0803    0.1178
   21    2   -2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0587    0.0568
   22   -2    2    1    0.3004    0.3375    0.3053    0.3413    0.0062    1    0.0610    0.0899
   23   -3    1    1    0.0345    0.2753    0.0347    0.2716    0.0037    1    0.0545    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2    3   -1    0   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3   -4    0    1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4    1   -1    1   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5    2    0    0    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6   -3   -1    1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7    2    0    1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8    3    1    0    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9   -2   -2    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10    1    1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11    1    1    1    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12   -1   -3    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13    1    3    0    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14    1    3    1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15    0   -2    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0    2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17    0    2    1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18    0    2    2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19   -1    3    0    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -1    3    1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21    1   -1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22   -2    2    1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -3    1    1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.232                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2850    1.7648    1.0793   89.1759  125.1812   91.3732      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2388    1.7975    1.0829   90.0000  123.9610   90.0000      0.4355         1.1439    1.6599    2.8446    4.1276    2.4867
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0910    0.1044    0.0355    0.0000    6.2470    0.0000      0.0506         0.0587    0.1349    0.3908    0.5359    0.3001
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5963   -0.4188    0.6131)
 a2 = (   -0.2872   -0.4873   -0.0366)
 a3 = (    0.9551   -0.5407   -0.2839)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6097   -0.4101    0.6382) (    0.0450    0.0168    0.0532)
 a2 = (   -0.2817   -0.4782   -0.0382) (    0.0160    0.0284    0.0030)
 a3 = (    0.9369   -0.5289   -0.2864) (    0.0553    0.0344    0.0262)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   95.9731  138.7501   64.0016    0.4121    4.1909    0.5857
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0004    0.0285      0.0024    0.0024    0.1376

# Number of computed bands
            400             79
# Figure of merit at the beginning and the end of the refinement
         5.8773        20.5388
# Chi-squares at the beginning and the end of the refinement
    0.3132    0.0196
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    0   -4   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3    1    3    1   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    1   -3   -1   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    0   -2   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6    1    1    1   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    1   -3   -2    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    0   -2   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    1   -1    1   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    1   -1   -2    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    1   -3    1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    0    2   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14    1    1   -3    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    1   -3    0   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16    0    2   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    1   -2    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18    2    0   -3    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19    0    4   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20    1    3   -2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    0   -2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22    1    3   -1    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23    1    3    0    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7327   -0.0564   -0.7310   -0.0567    0.0017    1          0.0678          0.0702
    2    0   -4   -1   -0.0133   -0.1740   -0.0130   -0.1762    0.0022    1          0.0989          0.0995
    3    1    3    1   -0.0262    0.0890   -0.0262    0.0895    0.0005    1          0.0966          0.0967
    4    1   -3   -1   -0.1948   -0.5853   -0.1957   -0.5833    0.0022    1          0.1048          0.1078
    5    0   -2   -1    0.0563   -0.2235    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6    1    1    1   -0.1066    0.1193   -0.1085    0.1216    0.0029    1          0.0761          0.0778
    7    1   -3   -2    0.1198   -0.5947    0.1201   -0.5973    0.0026    1          0.1341          0.1302
    8    0   -2   -2    0.1433   -0.2204    0.1454   -0.2240    0.0042    1          0.1029          0.1017
    9    1   -1    1   -0.1947    0.0487   -0.1952    0.0486    0.0006    1          0.0773          0.0726
   10    0    0   -1    0.2254   -0.1275    0.2251   -0.1274    0.0003    1          0.0459          0.0467
   11    1   -1   -2    0.5342   -0.6124    0.5303   -0.6130    0.0039    1          0.1275          0.1248
   12    1   -3    1   -0.1814   -0.0380   -0.1829   -0.0381    0.0014    1          0.0992          0.0984
   13    0    2   -2    0.1978   -0.0086    0.1990   -0.0092    0.0013    1          0.0998          0.0927
   14    1    1   -3    0.5294   -0.1493    0.5293   -0.1451    0.0041    1          0.1509          0.1473
   15    1   -3    0   -0.3358   -0.2371   -0.3362   -0.2357    0.0014    1          0.0877          0.0881
   16    0    2   -1    0.1260    0.0355    0.1275    0.0362    0.0016    1          0.0617          0.0679
   17    1    1   -2    0.7287   -0.0803    0.7293   -0.0807    0.0008    1          0.1177          0.1198
   18    2    0   -3    1.0586   -0.5103    1.0696   -0.4972    0.0172    1          0.2639          0.2483
   19    0    4   -1    0.0436    0.0288    0.0442    0.0295    0.0010    1          0.0961          0.0994
   20    1    3   -2    0.4436    0.1651    0.4423    0.1634    0.0021    1          0.1194          0.1178
   21    0   -2    0   -0.0337   -0.0579   -0.0341   -0.0579    0.0004    1          0.0430          0.0568
   22    1    3   -1    0.2973    0.3332    0.3053    0.3413    0.0114    1          0.0905          0.0899
   23    1    3    0    0.0348    0.2710    0.0347    0.2716    0.0006    1          0.0803          0.0816

###            No.233                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2578    1.7855    1.0873   90.3153  125.0049   89.5949      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2341    1.8034    1.0806   90.0000  123.7333   90.0000      0.4315         1.1420    1.6689    2.8601    4.1796    2.5044
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0721    0.0878    0.0280    0.0000    5.0129    0.0000      0.0434         0.0494    0.1075    0.3326    0.4669    0.2601
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6138    0.4161   -0.6263)
 a2 = (   -0.2838   -0.4814   -0.0376)
 a3 = (   -0.9464    0.5334    0.2837)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6092    0.4091   -0.6410) (    0.0362    0.0139    0.0427)
 a2 = (   -0.2804   -0.4769   -0.0379) (    0.0133    0.0238    0.0026)
 a3 = (   -0.9365    0.5278    0.2876) (    0.0466    0.0283    0.0211)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -95.9302   41.4035 -115.9999    0.3821    3.3576    0.5502
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0003    0.0324      0.0023    0.0023    0.1097

# Number of computed bands
             91             77
# Figure of merit at the beginning and the end of the refinement
         7.8810        18.6464
# Chi-squares at the beginning and the end of the refinement
    0.1932    0.0315
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2    0   -4    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3   -1    3   -1   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4   -1   -3    1   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5    0   -2    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6   -1    1   -1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7   -1   -3    2    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8    0   -2    2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9   -1   -1   -1   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10    0    0    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11   -1   -1    2    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12   -1   -3   -1   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13    0    2    2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14   -1    1    3    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15   -1   -3    0   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16    0    2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17   -1    1    2    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18   -2    0    3    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19    0    4    1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20   -1    3    2    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22   -1    3    1    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23   -1    3    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7340   -0.0562   -0.7310   -0.0567    0.0030    1          0.0678          0.0702
    2    0   -4    1   -0.0131   -0.1738   -0.0130   -0.1762    0.0024    1          0.0981          0.0995
    3   -1    3   -1   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0959          0.0967
    4   -1   -3    1   -0.1944   -0.5867   -0.1957   -0.5833    0.0036    1          0.1044          0.1078
    5    0   -2    1    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0635          0.0654
    6   -1    1   -1   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0757          0.0778
    7   -1   -3    2    0.1212   -0.5952    0.1201   -0.5973    0.0023    1          0.1337          0.1302
    8    0   -2    2    0.1437   -0.2201    0.1454   -0.2240    0.0043    1          0.1023          0.1017
    9   -1   -1   -1   -0.1948    0.0488   -0.1952    0.0486    0.0005    1          0.0768          0.0726
   10    0    0    1    0.2257   -0.1274    0.2251   -0.1274    0.0006    1          0.0456          0.0467
   11   -1   -1    2    0.5355   -0.6119    0.5303   -0.6130    0.0053    1          0.1274          0.1248
   12   -1   -3   -1   -0.1814   -0.0378   -0.1829   -0.0381    0.0015    1          0.0985          0.0984
   13    0    2    2    0.1984   -0.0086    0.1990   -0.0092    0.0008    1          0.0992          0.0927
   14   -1    1    3    0.5301   -0.1493    0.5293   -0.1451    0.0042    1          0.1505          0.1473
   15   -1   -3    0   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0872          0.0881
   16    0    2    1    0.1268    0.0357    0.1275    0.0362    0.0008    1          0.0612          0.0679
   17   -1    1    2    0.7297   -0.0804    0.7293   -0.0807    0.0005    1          0.1177          0.1198
   18   -2    0    3    1.0596   -0.5098    1.0696   -0.4972    0.0161    1          0.2645          0.2483
   19    0    4    1    0.0443    0.0293    0.0442    0.0295    0.0003    1          0.0953          0.0994
   20   -1    3    2    0.4452    0.1655    0.4423    0.1634    0.0036    1          0.1190          0.1178
   21    0   -2    0   -0.0335   -0.0574   -0.0341   -0.0579    0.0009    1          0.0426          0.0568
   22   -1    3    1    0.2986    0.3349    0.3053    0.3413    0.0093    1          0.0901          0.0899
   23   -1    3    0    0.0345    0.2727    0.0347    0.2716    0.0011    1          0.0798          0.0816

###            No.236                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2572    1.7859    1.0901   90.2017  125.1970   89.7936      0.5876
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2316    1.8054    1.1008   90.0000  125.2014   90.0000      0.4298         1.1188    1.6400    2.8652    4.2003    2.5611
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0147    0.1795    0.0995    0.0000    0.9686    0.0000      0.0291         0.1052    0.0301    0.1968    0.5051    0.2891
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3241   -0.1222   -0.9097)
 a2 = (    0.2837    0.4813    0.0376)
 a3 = (    0.9462   -0.5333   -0.2836)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3272   -0.1183   -0.9308) (    0.0286    0.0214    0.0127)
 a2 = (    0.2801    0.4763    0.0379) (    0.0272    0.0481    0.0029)
 a3 = (    0.9354   -0.5271   -0.2883) (    0.0947    0.0550    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -85.8202   69.9160   58.1029    0.3239    2.1694    0.3877
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0003    0.0357      0.0023    0.0023    0.1089

# Number of computed bands
             79             77
# Figure of merit at the beginning and the end of the refinement
         4.7313        17.5584
# Chi-squares at the beginning and the end of the refinement
    0.4822    0.0315
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2    0    4   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3   -1   -3    2   -0.0265    0.0882   -0.0262    0.0895    0.0013    1    0.1277    0.0967
    4   -1    3    0   -0.1973   -0.5864   -0.1957   -0.5833    0.0035    1    0.1359    0.1078
    5    0    2   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1   -1    2   -0.1064    0.1180   -0.1085    0.1216    0.0041    1    0.1007    0.0778
    7   -1    3   -1    0.1195   -0.5983    0.1201   -0.5973    0.0012    1    0.1743    0.1302
    8    0    2   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -1    1    2   -0.1931    0.0483   -0.1952    0.0486    0.0021    1    0.1023    0.0726
   10    0    0   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -1    1   -1    0.5360   -0.6176    0.5303   -0.6130    0.0073    1    0.1642    0.1248
   12   -1    3    2   -0.1804   -0.0373   -0.1829   -0.0381    0.0026    1    0.1313    0.0984
   13    0   -2   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -1   -1   -2    0.5330   -0.1508    0.5293   -0.1451    0.0068    1    0.1968    0.1473
   15   -1    3    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    0   -2   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1   -1   -1    0.7345   -0.0823    0.7293   -0.0807    0.0054    1    0.1521    0.1198
   18   -2    0   -1    1.0656   -0.5197    1.0696   -0.4972    0.0229    1    0.3371    0.2483
   19    0   -4   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -1   -3   -1    0.4476    0.1663    0.4423    0.1634    0.0060    1    0.1559    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1   -3    0    0.2994    0.3368    0.3053    0.3413    0.0074    1    0.1180    0.0899
   23   -1   -3    1    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7342   -0.0561   -0.7310   -0.0567    0.0032    1          0.0679          0.0702
    2    0    4   -1   -0.0131   -0.1737   -0.0130   -0.1762    0.0025    1          0.0980          0.0995
    3   -1   -3    2   -0.0267    0.0897   -0.0262    0.0895    0.0006    1          0.0958          0.0967
    4   -1    3    0   -0.1944   -0.5868   -0.1957   -0.5833    0.0037    1          0.1045          0.1078
    5    0    2   -1    0.0566   -0.2233    0.0560   -0.2234    0.0007    1          0.0635          0.0654
    6   -1   -1    2   -0.1072    0.1196   -0.1085    0.1216    0.0023    1          0.0755          0.0778
    7   -1    3   -1    0.1212   -0.5952    0.1201   -0.5973    0.0023    1          0.1338          0.1302
    8    0    2   -2    0.1436   -0.2201    0.1454   -0.2240    0.0043    1          0.1021          0.1017
    9   -1    1    2   -0.1948    0.0488   -0.1952    0.0486    0.0005    1          0.0767          0.0726
   10    0    0   -1    0.2257   -0.1274    0.2251   -0.1274    0.0006    1          0.0456          0.0467
   11   -1    1   -1    0.5357   -0.6118    0.5303   -0.6130    0.0055    1          0.1278          0.1248
   12   -1    3    2   -0.1814   -0.0378   -0.1829   -0.0381    0.0015    1          0.0984          0.0984
   13    0   -2   -2    0.1984   -0.0086    0.1990   -0.0092    0.0008    1          0.0991          0.0927
   14   -1   -1   -2    0.5301   -0.1492    0.5293   -0.1451    0.0042    1          0.1506          0.1473
   15   -1    3    1   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0871          0.0881
   16    0   -2   -1    0.1269    0.0358    0.1275    0.0362    0.0008    1          0.0612          0.0679
   17   -1   -1   -1    0.7297   -0.0803    0.7293   -0.0807    0.0005    1          0.1179          0.1198
   18   -2    0   -1    1.0596   -0.5093    1.0696   -0.4972    0.0157    1          0.2657          0.2483
   19    0   -4   -1    0.0443    0.0293    0.0442    0.0295    0.0003    1          0.0952          0.0994
   20   -1   -3   -1    0.4452    0.1655    0.4423    0.1634    0.0035    1          0.1190          0.1178
   21    0    2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0009    1          0.0426          0.0568
   22   -1   -3    0    0.2987    0.3348    0.3053    0.3413    0.0093    1          0.0901          0.0899
   23   -1   -3    1    0.0346    0.2727    0.0347    0.2716    0.0011    1          0.0797          0.0816

###            No.238                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9864    1.4251    1.4228   90.1311   90.4132   90.3880      0.3538
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0027    1.4120    1.4127   90.0000   89.5066   90.0000      0.3554         0.7098    0.9995    2.8214    3.9729    3.9749
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.0581    0.0624    0.0000    1.1928    0.0000      0.0226         0.0314    0.0141    0.1791    0.3005    0.3074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1789    0.1845   -0.9807)
 a2 = (    0.5912   -0.3347   -0.1757)
 a3 = (   -0.3559   -0.6037   -0.0539)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1786    0.1878   -0.9631) (    0.0124    0.0137    0.0019)
 a2 = (    0.5973   -0.3372   -0.1765) (    0.0252    0.0156    0.0043)
 a3 = (   -0.3576   -0.6092   -0.0462) (    0.0165    0.0270    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -104.4713   94.2166  -30.5330    0.4349    0.9239    0.4406
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0063      0.0023    0.0024    0.0430

# Number of computed bands
            141            155
# Figure of merit at the beginning and the end of the refinement
         7.8086        12.6245
# Chi-squares at the beginning and the end of the refinement
    0.2249    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0681    0.0702
    2    0   -2   -4   -0.0143   -0.1827   -0.0130   -0.1762    0.0066    1    0.0989    0.0995
    3   -1    3    3   -0.0264    0.0895   -0.0262    0.0895    0.0002    1    0.0964    0.0967
    4   -1   -1   -3   -0.2020   -0.6045   -0.1957   -0.5833    0.0221    1    0.1049    0.1078
    5    0   -2   -2    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0639    0.0654
    6   -1    3    1   -0.1108    0.1243   -0.1085    0.1216    0.0036    1    0.0760    0.0778
    7   -1   -3   -3    0.1222   -0.6101    0.1201   -0.5973    0.0130    1    0.1335    0.1302
    8    0   -4   -2    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1024    0.1017
    9   -1    3   -1   -0.2066    0.0523   -0.1952    0.0486    0.0120    1    0.0774    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0455    0.0467
   11   -1   -3   -1    0.5434   -0.6243    0.5303   -0.6130    0.0173    1    0.1256    0.1248
   12   -1    3   -3   -0.1954   -0.0403   -0.1829   -0.0381    0.0127    1    0.0995    0.0984
   13    0   -4    2    0.1931   -0.0082    0.1990   -0.0092    0.0059    1    0.0990    0.0927
   14   -1   -5    1    0.5337   -0.1508    0.5293   -0.1451    0.0072    1    0.1483    0.1473
   15   -1    1   -3   -0.3520   -0.2475   -0.3362   -0.2357    0.0197    1    0.0881    0.0881
   16    0   -2    2    0.1190    0.0338    0.1275    0.0362    0.0088    1    0.0612    0.0679
   17   -1   -3    1    0.7364   -0.0815    0.7293   -0.0807    0.0071    1    0.1151    0.1198
   18   -2   -4    0    1.0763   -0.5201    1.0696   -0.4972    0.0239    1    0.2577    0.2483
   19    0   -2    4    0.0360    0.0241    0.0442    0.0295    0.0098    1    0.0957    0.0994
   20   -1   -3    3    0.4441    0.1654    0.4423    0.1634    0.0027    1    0.1172    0.1178
   21    0    0   -3   -0.0390   -0.0662   -0.0341   -0.0579    0.0096    1    0.0645    0.0568
   22   -1   -1    3    0.2975    0.3339    0.3053    0.3413    0.0108    1    0.0889    0.0899
   23   -1    1    3    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0796    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7352   -0.0551   -0.7310   -0.0567    0.0045    1          0.0657          0.0702
    2    0   -2   -4   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0990          0.0995
    3   -1    3    3   -0.0267    0.0897   -0.0262    0.0895    0.0006    1          0.0971          0.0967
    4   -1   -1   -3   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1021          0.1078
    5    0   -2   -2    0.0564   -0.2229    0.0560   -0.2234    0.0007    1          0.0639          0.0654
    6   -1    3    1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0764          0.0778
    7   -1   -3   -3    0.1213   -0.5948    0.1201   -0.5973    0.0027    1          0.1309          0.1302
    8    0   -4   -2    0.1433   -0.2200    0.1454   -0.2240    0.0045    1          0.1027          0.1017
    9   -1    3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0006    1          0.0773          0.0726
   10    0   -2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0458          0.0467
   11   -1   -3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1229          0.1248
   12   -1    3   -3   -0.1814   -0.0379   -0.1829   -0.0381    0.0015    1          0.0992          0.0984
   13    0   -4    2    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.0999          0.0927
   14   -1   -5    1    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1481          0.1473
   15   -1    1   -3   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0866          0.0881
   16    0   -2    2    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0618          0.0679
   17   -1   -3    1    0.7300   -0.0799    0.7293   -0.0807    0.0010    1          0.1142          0.1198
   18   -2   -4    0    1.0605   -0.5083    1.0696   -0.4972    0.0144    1          0.2498          0.2483
   19    0   -2    4    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0964          0.0994
   20   -1   -3    3    0.4452    0.1659    0.4423    0.1634    0.0038    1          0.1178          0.1178
   21    0    0   -3   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0647          0.0568
   22   -1   -1    3    0.2981    0.3350    0.3053    0.3413    0.0096    1          0.0895          0.0899
   23   -1    1    3    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0802          0.0816

###            No.239                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0006    1.4191    1.4089   90.3744   91.2008   89.9536      0.3469
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0027    1.4120    1.4127   90.0000   90.4935   90.0000      0.3554         0.7098    0.9995    2.8214    3.9729    3.9749
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.0581    0.0624    0.0000    1.1928    0.0000      0.0226         0.0314    0.0141    0.1791    0.3005    0.3074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1729    0.1981   -0.9644)
 a2 = (   -0.5911    0.3406    0.1765)
 a3 = (    0.3598    0.6103    0.0455)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1786    0.1878   -0.9631) (    0.0124    0.0137    0.0019)
 a2 = (   -0.5973    0.3372    0.1765) (    0.0252    0.0156    0.0043)
 a3 = (    0.3576    0.6092    0.0462) (    0.0165    0.0270    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -75.5286   85.7833  149.4670    0.4349    0.9239    0.4406
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0063      0.0023    0.0024    0.0430

# Number of computed bands
            149            156
# Figure of merit at the beginning and the end of the refinement
        10.6636        12.5974
# Chi-squares at the beginning and the end of the refinement
    0.0874    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7386   -0.0470   -0.7310   -0.0567    0.0123    1    0.0646    0.0702
    2    0    2    4   -0.0140   -0.1701   -0.0130   -0.1762    0.0062    1    0.0976    0.0995
    3   -1   -3   -3   -0.0257    0.0906   -0.0262    0.0895    0.0012    1    0.0959    0.0967
    4   -1    1    3   -0.1949   -0.5819   -0.1957   -0.5833    0.0016    1    0.1003    0.1078
    5    0    2    2    0.0536   -0.2203    0.0560   -0.2234    0.0039    1    0.0629    0.0654
    6   -1   -3   -1   -0.1053    0.1215   -0.1085    0.1216    0.0031    1    0.0750    0.0778
    7   -1    3    3    0.1161   -0.5913    0.1201   -0.5973    0.0073    1    0.1285    0.1302
    8    0    4    2    0.1397   -0.2194    0.1454   -0.2240    0.0073    1    0.1008    0.1017
    9   -1   -3    1   -0.1948    0.0515   -0.1952    0.0486    0.0029    1    0.0755    0.0726
   10    0    2    0    0.2241   -0.1291    0.2251   -0.1274    0.0020    1    0.0448    0.0467
   11   -1    3    1    0.5311   -0.6139    0.5303   -0.6130    0.0011    1    0.1209    0.1248
   12   -1   -3    3   -0.1815   -0.0366   -0.1829   -0.0381    0.0020    1    0.0968    0.0984
   13    0    4   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.0976    0.0927
   14   -1    5   -1    0.5302   -0.1510    0.5293   -0.1451    0.0059    1    0.1453    0.1473
   15   -1   -1    3   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0848    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0605    0.0679
   17   -1    3   -1    0.7302   -0.0795    0.7293   -0.0807    0.0015    1    0.1124    0.1198
   18   -2    4    0    1.0618   -0.5083    1.0696   -0.4972    0.0135    1    0.2469    0.2483
   19    0    2   -4    0.0450    0.0302    0.0442    0.0295    0.0010    1    0.0946    0.0994
   20   -1    3   -3    0.4438    0.1668    0.4423    0.1634    0.0037    1    0.1158    0.1178
   21    0    0    3   -0.0326   -0.0553   -0.0341   -0.0579    0.0031    1    0.0637    0.0568
   22   -1    1   -3    0.2953    0.3330    0.3053    0.3413    0.0130    1    0.0883    0.0899
   23   -1   -1   -3    0.0359    0.2702    0.0347    0.2716    0.0019    1    0.0794    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7352   -0.0551   -0.7310   -0.0567    0.0045    1          0.0657          0.0702
    2    0    2    4   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0990          0.0995
    3   -1   -3   -3   -0.0267    0.0897   -0.0262    0.0895    0.0006    1          0.0971          0.0967
    4   -1    1    3   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1021          0.1078
    5    0    2    2    0.0564   -0.2229    0.0560   -0.2234    0.0007    1          0.0639          0.0654
    6   -1   -3   -1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0764          0.0778
    7   -1    3    3    0.1213   -0.5948    0.1201   -0.5973    0.0027    1          0.1309          0.1302
    8    0    4    2    0.1433   -0.2200    0.1454   -0.2240    0.0045    1          0.1027          0.1017
    9   -1   -3    1   -0.1948    0.0489   -0.1952    0.0486    0.0006    1          0.0773          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0458          0.0467
   11   -1    3    1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1229          0.1248
   12   -1   -3    3   -0.1814   -0.0379   -0.1829   -0.0381    0.0015    1          0.0992          0.0984
   13    0    4   -2    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.0999          0.0927
   14   -1    5   -1    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1481          0.1473
   15   -1   -1    3   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0866          0.0881
   16    0    2   -2    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0618          0.0679
   17   -1    3   -1    0.7300   -0.0799    0.7293   -0.0807    0.0010    1          0.1142          0.1198
   18   -2    4    0    1.0605   -0.5083    1.0696   -0.4972    0.0144    1          0.2498          0.2483
   19    0    2   -4    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0964          0.0994
   20   -1    3   -3    0.4452    0.1659    0.4423    0.1634    0.0038    1          0.1178          0.1178
   21    0    0    3   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0647          0.0568
   22   -1    1   -3    0.2981    0.3350    0.3053    0.3413    0.0096    1          0.0895          0.0899
   23   -1   -1   -3    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0802          0.0816

###            No.241                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9946    1.4128    1.4233   90.0305   90.4979   90.2400      0.4015
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0027    1.4120    1.4127   90.0000   90.4934   90.0000      0.3554         0.7098    0.9995    2.8214    3.9729    3.9749
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.0581    0.0624    0.0000    1.1928    0.0000      0.0226         0.0314    0.0141    0.1791    0.3005    0.3074
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1772   -0.1882    0.9716)
 a2 = (   -0.5963    0.3376    0.1773)
 a3 = (   -0.3560   -0.6040   -0.0457)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1786   -0.1878    0.9631) (    0.0124    0.0137    0.0019)
 a2 = (   -0.5973    0.3372    0.1765) (    0.0252    0.0156    0.0043)
 a3 = (   -0.3576   -0.6092   -0.0462) (    0.0165    0.0270    0.0040)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   75.5287   94.2166  -30.5330    0.4349    0.9239    0.4406
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0063      0.0023    0.0024    0.0430

# Number of computed bands
            157            157
# Figure of merit at the beginning and the end of the refinement
         6.8940        12.5706
# Chi-squares at the beginning and the end of the refinement
    0.1316    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7402   -0.0512   -0.7310   -0.0567    0.0107    1    0.0754    0.0702
    2    0    2   -4   -0.0129   -0.1729   -0.0130   -0.1762    0.0033    1    0.1119    0.0995
    3    1   -3    3   -0.0275    0.0922   -0.0262    0.0895    0.0031    1    0.1101    0.0967
    4    1    1   -3   -0.1955   -0.5910   -0.1957   -0.5833    0.0077    1    0.1166    0.1078
    5    0    2   -2    0.0568   -0.2224    0.0560   -0.2234    0.0013    1    0.0724    0.0654
    6    1   -3    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0868    0.0778
    7    1    3   -3    0.1231   -0.5969    0.1201   -0.5973    0.0030    1    0.1495    0.1302
    8    0    4   -2    0.1433   -0.2192    0.1454   -0.2240    0.0053    1    0.1166    0.1017
    9    1   -3   -1   -0.1961    0.0504   -0.1952    0.0486    0.0020    1    0.0879    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0521    0.0467
   11    1    3   -1    0.5377   -0.6117    0.5303   -0.6130    0.0075    1    0.1410    0.1248
   12    1   -3   -3   -0.1828   -0.0368   -0.1829   -0.0381    0.0013    1    0.1125    0.0984
   13    0    4    2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1135    0.0927
   14    1    5    1    0.5307   -0.1504    0.5293   -0.1451    0.0055    1    0.1693    0.1473
   15    1   -1   -3   -0.3400   -0.2375   -0.3362   -0.2357    0.0042    1    0.0984    0.0881
   16    0    2    2    0.1281    0.0358    0.1275    0.0362    0.0007    1    0.0701    0.0679
   17    1    3    1    0.7316   -0.0820    0.7293   -0.0807    0.0026    1    0.1310    0.1198
   18    2    4    0    1.0618   -0.5092    1.0696   -0.4972    0.0144    1    0.2883    0.2483
   19    0    2    4    0.0454    0.0302    0.0442    0.0295    0.0014    1    0.1090    0.0994
   20    1    3    3    0.4489    0.1654    0.4423    0.1634    0.0068    1    0.1344    0.1178
   21    0    0   -2   -0.0331   -0.0562   -0.0341   -0.0579    0.0020    1    0.0487    0.0568
   22    1    1    3    0.3023    0.3380    0.3053    0.3413    0.0044    1    0.1020    0.0899
   23    1   -1    3    0.0349    0.2767    0.0347    0.2716    0.0050    1    0.0910    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7352   -0.0551   -0.7310   -0.0567    0.0045    1          0.0657          0.0702
    2    0    2   -4   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0990          0.0995
    3    1   -3    3   -0.0267    0.0897   -0.0262    0.0895    0.0006    1          0.0971          0.0967
    4    1    1   -3   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1021          0.1078
    5    0    2   -2    0.0564   -0.2229    0.0560   -0.2234    0.0007    1          0.0639          0.0654
    6    1   -3    1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0764          0.0778
    7    1    3   -3    0.1213   -0.5948    0.1201   -0.5973    0.0027    1          0.1309          0.1302
    8    0    4   -2    0.1433   -0.2200    0.1454   -0.2240    0.0045    1          0.1027          0.1017
    9    1   -3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0006    1          0.0773          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0458          0.0467
   11    1    3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1229          0.1248
   12    1   -3   -3   -0.1814   -0.0379   -0.1829   -0.0381    0.0015    1          0.0992          0.0984
   13    0    4    2    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.0999          0.0927
   14    1    5    1    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1481          0.1473
   15    1   -1   -3   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0866          0.0881
   16    0    2    2    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0618          0.0679
   17    1    3    1    0.7300   -0.0799    0.7293   -0.0807    0.0010    1          0.1142          0.1198
   18    2    4    0    1.0605   -0.5083    1.0696   -0.4972    0.0144    1          0.2498          0.2483
   19    0    2    4    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0964          0.0994
   20    1    3    3    0.4452    0.1659    0.4423    0.1634    0.0038    1          0.1178          0.1178
   21    0    0   -3   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0647          0.0568
   22    1    1    3    0.2981    0.3350    0.3053    0.3413    0.0096    1          0.0895          0.0899
   23    1   -1    3    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0802          0.0816

###            No.242                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0075    1.3998    1.4185   90.2507   90.6108   88.9195      0.3559
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9957    1.4143    1.4202   90.0000   89.8953   90.0000      0.3572         0.7011    0.9958    2.7875    3.9591    3.9757
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0254    0.0242    0.0000    0.9076    0.0000      0.0239         0.0119    0.0196    0.1866    0.2744    0.2746
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9428   -0.2866    0.1203)
 a2 = (   -0.2077    0.5733   -0.3724)
 a3 = (    0.0295   -0.3736   -0.5972)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9580   -0.2721    0.1295) (    0.0021    0.0076    0.0056)
 a2 = (   -0.2104    0.5645   -0.3702) (    0.0067    0.0118    0.0052)
 a3 = (    0.0286   -0.3783   -0.5931) (    0.0079    0.0082    0.0100)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  166.1609  147.3688    4.1380    0.5828    0.4387    0.7166
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005   -0.0044      0.0023    0.0023    0.0151

# Number of computed bands
            400            158
# Figure of merit at the beginning and the end of the refinement
         5.9925        12.4090
# Chi-squares at the beginning and the end of the refinement
    0.2132    0.0227
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0677    0.0702
    2   -1    3   -3   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1005    0.0995
    3    0   -4    2   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0982    0.0967
    4   -1    1   -3   -0.1935   -0.5926   -0.1957   -0.5833    0.0095    1    0.1044    0.1078
    5    0    2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0645    0.0654
    6   -1   -3    1   -0.1098    0.1243   -0.1085    0.1216    0.0030    1    0.0768    0.0778
    7    0    2   -4    0.1208   -0.5981    0.1201   -0.5973    0.0010    1    0.1327    0.1302
    8    1    3   -3    0.1420   -0.2192    0.1454   -0.2240    0.0059    1    0.1028    0.1017
    9   -2   -2    0   -0.2063    0.0514   -0.1952    0.0486    0.0114    1    0.0775    0.0726
   10    1    1   -1    0.2227   -0.1246    0.2251   -0.1274    0.0037    1    0.0455    0.0467
   11    1    1   -3    0.5425   -0.6163    0.5303   -0.6130    0.0126    1    0.1244    0.1248
   12   -3   -1   -1   -0.1931   -0.0424   -0.1829   -0.0381    0.0111    1    0.0998    0.0984
   13    3    1   -1    0.1909   -0.0054    0.1990   -0.0092    0.0088    1    0.0991    0.0927
   14    3    1   -3    0.5318   -0.1420    0.5293   -0.1451    0.0040    1    0.1474    0.1473
   15   -2    0   -2   -0.3429   -0.2479   -0.3362   -0.2357    0.0139    1    0.0883    0.0881
   16    2    0    0    0.1168    0.0355    0.1275    0.0362    0.0107    1    0.0616    0.0679
   17    2    0   -2    0.7321   -0.0655    0.7293   -0.0807    0.0155    1    0.1143    0.1198
   18    2    0   -4    1.0834   -0.4980    1.0696   -0.4972    0.0139    1    0.2554    0.2483
   19    3   -1    1    0.0354    0.0247    0.0442    0.0295    0.0101    1    0.0970    0.0994
   20    3   -1   -1    0.4329    0.1731    0.4423    0.1634    0.0135    1    0.1174    0.1178
   21   -1    1   -1   -0.0365   -0.0638   -0.0341   -0.0579    0.0063    1    0.0438    0.0568
   22    2   -2    0    0.2830    0.3311    0.3053    0.3413    0.0245    0    0.0898    0.0899
   23    1   -3    1    0.0323    0.2651    0.0347    0.2716    0.0069    1    0.0813    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7304   -0.0557   -0.7310   -0.0567    0.0012    1          0.0662          0.0702
    2   -1    3   -3   -0.0133   -0.1742   -0.0130   -0.1762    0.0020    1          0.0994          0.0995
    3    0   -4    2   -0.0267    0.0896   -0.0262    0.0895    0.0005    1          0.0975          0.0967
    4   -1    1   -3   -0.1964   -0.5865   -0.1957   -0.5833    0.0032    1          0.1030          0.1078
    5    0    2   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1   -3    1   -0.1074    0.1192   -0.1085    0.1216    0.0026    1          0.0768          0.0778
    7    0    2   -4    0.1209   -0.5965    0.1201   -0.5973    0.0011    1          0.1318          0.1302
    8    1    3   -3    0.1440   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9   -2   -2    0   -0.1945    0.0482   -0.1952    0.0486    0.0008    1          0.0781          0.0726
   10    1    1   -1    0.2253   -0.1267    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    1    1   -3    0.5371   -0.6115    0.5303   -0.6130    0.0069    1          0.1239          0.1248
   12   -3   -1   -1   -0.1810   -0.0379   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    3    1   -1    0.1972   -0.0085    0.1990   -0.0092    0.0019    1          0.1008          0.0927
   14    3    1   -3    0.5288   -0.1478    0.5293   -0.1451    0.0027    1          0.1491          0.1473
   15   -2    0   -2   -0.3361   -0.2359   -0.3362   -0.2357    0.0003    1          0.0875          0.0881
   16    2    0    0    0.1259    0.0352    0.1275    0.0362    0.0019    1          0.0624          0.0679
   17    2    0   -2    0.7275   -0.0788    0.7293   -0.0807    0.0026    1          0.1149          0.1198
   18    2    0   -4    1.0605   -0.5066    1.0696   -0.4972    0.0131    1          0.2518          0.2483
   19    3   -1    1    0.0439    0.0286    0.0442    0.0295    0.0010    1          0.0973          0.0994
   20    3   -1   -1    0.4432    0.1644    0.4423    0.1634    0.0013    1          0.1187          0.1178
   21   -1    1   -1   -0.0336   -0.0577   -0.0341   -0.0579    0.0005    1          0.0434          0.0568
   22    2   -2    0    0.2983    0.3331    0.3053    0.3413    0.0108    1          0.0900          0.0899
   23    1   -3    1    0.0349    0.2723    0.0347    0.2716    0.0007    1          0.0805          0.0816

###            No.243                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0068    1.4249    1.3941   90.3476   90.2992   89.8811      0.5595
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9954    1.4150    1.4200   90.0000   89.7878   90.0000      0.3580         0.7010    0.9965    2.7804    3.9522    3.9662
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0242    0.0239    0.0000    0.8829    0.0000      0.0235         0.0118    0.0193    0.1824    0.2679    0.2686
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9469   -0.2686    0.1336)
 a2 = (   -0.2090    0.5564   -0.3732)
 a3 = (    0.0218   -0.3900   -0.6017)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9584   -0.2716    0.1304) (    0.0020    0.0073    0.0054)
 a2 = (   -0.2102    0.5638   -0.3706) (    0.0062    0.0112    0.0051)
 a3 = (    0.0294   -0.3788   -0.5929) (    0.0078    0.0082    0.0098)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  166.0976  147.2978    4.0574    0.5687    0.4119    0.6984
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0067      0.0023    0.0023    0.0144

# Number of computed bands
            400            165
# Figure of merit at the beginning and the end of the refinement
         1.5938        12.0245
# Chi-squares at the beginning and the end of the refinement
    2.1640    0.0276
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7359   -0.0663   -0.7310   -0.0567    0.0108    1    0.1053    0.0702
    2   -1    3   -3   -0.0144   -0.1764   -0.0130   -0.1762    0.0014    1    0.1574    0.0995
    3    0   -2    1   -0.0260    0.0888   -0.0262    0.0895    0.0007    1    0.0763    0.0967
    4   -1    1   -3   -0.1970   -0.5843   -0.1957   -0.5833    0.0016    1    0.1646    0.1078
    5    0    2   -2    0.0556   -0.2278    0.0560   -0.2234    0.0045    1    0.1016    0.0654
    6   -1   -3    1   -0.1066    0.1197   -0.1085    0.1216    0.0026    1    0.1199    0.0778
    7    0    2   -4    0.1134   -0.5998    0.1201   -0.5973    0.0072    1    0.2113    0.1302
    8    1    3   -3    0.1444   -0.2265    0.1454   -0.2240    0.0027    1    0.1632    0.1017
    9   -1   -1    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0608    0.0726
   10    1    1   -1    0.2309   -0.1329    0.2251   -0.1274    0.0080    1    0.0724    0.0467
   11    1    1   -3    0.5286   -0.6310    0.5303   -0.6130    0.0181    1    0.1994    0.1248
   12   -2    0   -1   -0.1435   -0.0711   -0.1829   -0.0381    0.0514    1    0.1044    0.0984
   13    3    1   -1    0.2045   -0.0094    0.1990   -0.0092    0.0055    1    0.1576    0.0927
   14    3    1   -3    0.5411   -0.1599    0.5293   -0.1451    0.0189    1    0.2378    0.1473
   15   -2    0   -2   -0.3358   -0.2390   -0.3362   -0.2357    0.0034    1    0.1384    0.0881
   16    2    0    0    0.1306    0.0370    0.1275    0.0362    0.0032    1    0.0973    0.0679
   17    2    0   -2    0.7473   -0.0937    0.7293   -0.0807    0.0222    1    0.1848    0.1198
   18    2    0   -4    1.0658   -0.5502    1.0696   -0.4972    0.0532    0    0.4136    0.2483
   19    3   -1    1    0.0455    0.0306    0.0442    0.0295    0.0017    1    0.1522    0.0994
   20    3   -1   -1    0.4571    0.1675    0.4423    0.1634    0.0153    1    0.1876    0.1178
   21   -1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0683    0.0568
   22    1   -1    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0708    0.0899
   23    1   -3    1    0.0353    0.2754    0.0347    0.2716    0.0038    1    0.1263    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7319   -0.0561   -0.7310   -0.0567    0.0010    1          0.0662          0.0702
    2   -1    3   -3   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0994          0.0995
    3    0   -4    2   -0.0271    0.0905   -0.0262    0.0895    0.0014    1          0.0974          0.0967
    4   -1    1   -3   -0.1962   -0.5871   -0.1957   -0.5833    0.0038    1          0.1028          0.1078
    5    0    2   -2    0.0568   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1   -3    1   -0.1080    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0    2   -4    0.1215   -0.5968    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8    1    3   -3    0.1441   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9   -2   -2    0   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10    1    1   -1    0.2257   -0.1268    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    1    1   -3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1238          0.1248
   12   -3   -1   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0021    1          0.1003          0.0984
   13    3    1   -1    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1009          0.0927
   14    3    1   -3    0.5297   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -2    0   -2   -0.3362   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16    2    0    0    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17    2    0   -2    0.7287   -0.0796    0.7293   -0.0807    0.0013    1          0.1150          0.1198
   18    2    0   -4    1.0607   -0.5072    1.0696   -0.4972    0.0134    1          0.2515          0.2483
   19    3   -1    1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    3   -1   -1    0.4450    0.1646    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21   -1    1   -1   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    2   -2    0    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23    1   -3    1    0.0351    0.2742    0.0347    0.2716    0.0026    1          0.0805          0.0816

###            No.245                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9909    1.4124    1.4305   90.5697   91.8342   91.7738      0.4522
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9865    1.4256    1.4222   90.0000   90.7902   90.0000      0.3484         0.6937    1.0024    2.8320    4.0924    4.0826
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0011    0.2163    0.2025    0.0000    4.7101    0.0000      0.0245         0.0980    0.0174    0.1990    0.6842    0.6481
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1733   -0.1426    0.9849)
 a2 = (    0.3523    0.6126    0.0495)
 a3 = (   -0.5893    0.3336    0.1752)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1785   -0.1820    0.9812) (    0.0416    0.0170    0.0105)
 a2 = (    0.3550    0.6031    0.0473) (    0.0523    0.0929    0.0040)
 a3 = (   -0.5919    0.3344    0.1797) (    0.0893    0.0518    0.0053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   86.0147   75.9814 -119.5167    0.4619    2.5448    0.4339
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0002    0.0201      0.0024    0.0024    0.1579

# Number of computed bands
            400            150
# Figure of merit at the beginning and the end of the refinement
         2.6895        10.9189
# Chi-squares at the beginning and the end of the refinement
    1.2888    0.0264
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7593   -0.0929   -0.7310   -0.0567    0.0460    0    0.0871    0.0702
    2    0    4    2   -0.0129   -0.1749   -0.0130   -0.1762    0.0013    1    0.1273    0.0995
    3    1   -3   -3   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.1228    0.0967
    4    1    3    1   -0.1853   -0.5864   -0.1957   -0.5833    0.0109    1    0.1340    0.1078
    5    0    2    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0819    0.0654
    6    1   -1   -3   -0.1162    0.1284   -0.1085    0.1216    0.0103    1    0.0962    0.0778
    7    1    3    3    0.1180   -0.5917    0.1201   -0.5973    0.0060    1    0.1707    0.1302
    8    0    2    4    0.1423   -0.2205    0.1454   -0.2240    0.0047    1    0.1310    0.1017
    9    1    1   -3   -0.2106    0.0488   -0.1952    0.0486    0.0154    1    0.0980    0.0726
   10    0    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0580    0.0467
   11    1    1    3    0.5228   -0.6190    0.5303   -0.6130    0.0096    1    0.1598    0.1248
   12    1    3   -3   -0.1924   -0.0446   -0.1829   -0.0381    0.0116    1    0.1268    0.0984
   13    0   -2    4    0.1963   -0.0070    0.1990   -0.0092    0.0034    1    0.1262    0.0927
   14    1   -1    5    0.5340   -0.1560    0.5293   -0.1451    0.0118    1    0.1903    0.1473
   15    1    3   -1   -0.3376   -0.2526   -0.3362   -0.2357    0.0169    1    0.1130    0.0881
   16    0   -2    2    0.1227    0.0364    0.1275    0.0362    0.0048    1    0.0782    0.0679
   17    1   -1    3    0.7386   -0.0932    0.7293   -0.0807    0.0156    1    0.1480    0.1198
   18    2    0    4    1.0439   -0.5448    1.0696   -0.4972    0.0541    0    0.3276    0.2483
   19    0   -4    2    0.0400    0.0275    0.0442    0.0295    0.0047    1    0.1227    0.0994
   20    1   -3    3    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1506    0.1178
   21    0    2    0   -0.0349   -0.0607   -0.0341   -0.0579    0.0028    1    0.0553    0.0568
   22    1   -3    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1143    0.0899
   23    1   -3   -1    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.1019    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7345   -0.0569   -0.7310   -0.0567    0.0035    1          0.0675          0.0702
    2    0    4    3    0.0217   -0.2070   -0.0130   -0.1762    0.0464    1          0.1121          0.0995
    3    1   -3   -3   -0.0267    0.0900   -0.0262    0.0895    0.0007    1          0.0968          0.0967
    4    1    3    1   -0.1945   -0.5863   -0.1957   -0.5833    0.0032    1          0.1043          0.1078
    5    0    2    2    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6    1   -1   -3   -0.1073    0.1199   -0.1085    0.1216    0.0020    1          0.0763          0.0778
    7    1    3    3    0.1205   -0.5951    0.1201   -0.5973    0.0022    1          0.1336          0.1302
    8    0    2    4    0.1435   -0.2202    0.1454   -0.2240    0.0043    1          0.1029          0.1017
    9    1    1   -3   -0.1951    0.0490   -0.1952    0.0486    0.0004    1          0.0774          0.0726
   10    0    0    2    0.2257   -0.1276    0.2251   -0.1274    0.0006    1          0.0459          0.0467
   11    1    1    3    0.5344   -0.6128    0.5303   -0.6130    0.0041    1          0.1267          0.1248
   12    1    3   -3   -0.1816   -0.0378   -0.1829   -0.0381    0.0013    1          0.0993          0.0984
   13    0   -2    4    0.1985   -0.0087    0.1990   -0.0092    0.0006    1          0.1000          0.0927
   14    1   -1    5    0.5303   -0.1501    0.5293   -0.1451    0.0051    1          0.1506          0.1473
   15    1    3   -1   -0.3365   -0.2373   -0.3362   -0.2357    0.0017    1          0.0875          0.0881
   16    0   -2    2    0.1269    0.0358    0.1275    0.0362    0.0007    1          0.0618          0.0679
   17    1   -1    3    0.7303   -0.0818    0.7293   -0.0807    0.0014    1          0.1172          0.1198
   18    2    0    4    1.0587   -0.5127    1.0696   -0.4972    0.0190    1          0.2613          0.2483
   19    0   -4    3    0.0900    0.0394    0.0442    0.0295    0.0468    1          0.1084          0.0994
   20    1   -3    3    0.4460    0.1653    0.4423    0.1634    0.0041    1          0.1192          0.1178
   21    0    2    0   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0430          0.0568
   22    1   -3    1    0.2995    0.3352    0.3053    0.3413    0.0084    1          0.0904          0.0899
   23    1   -3   -1    0.0348    0.2733    0.0347    0.2716    0.0016    1          0.0803          0.0816

###            No.246                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4139    1.0087    1.4029   90.4264   91.4180   90.6033      0.3553
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4132    0.9898    1.4299   90.0000   89.0306   90.0000      0.3657         0.9883    0.6922    3.8650    2.7070    3.9107
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0017    0.0256    0.0531    0.0000    4.1337    0.0000      0.0346         0.0357    0.0373    0.3653    0.2653    0.3971
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2034    0.5601   -0.3815)
 a2 = (    0.9455    0.2695   -0.1282)
 a3 = (    0.0314   -0.3776   -0.6041)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2104    0.5679   -0.3661) (    0.0046    0.0144    0.0210)
 a2 = (    0.9639    0.2739   -0.1290) (    0.0262    0.0076    0.0057)
 a3 = (    0.0300   -0.3812   -0.5857) (    0.0100    0.0132    0.0328)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.8602  147.8039    4.0696    0.4961    2.0443    0.6678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0253      0.0023    0.0023    0.0797

# Number of computed bands
            400            157
# Figure of merit at the beginning and the end of the refinement
         5.7529        10.8995
# Chi-squares at the beginning and the end of the refinement
    0.2166    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7625   -0.0593   -0.7310   -0.0567    0.0316    0    0.0683    0.0702
    2    3    1   -3   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.0988    0.0995
    3   -4    0    2   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0968    0.0967
    4    1    1   -3   -0.1976   -0.5985   -0.1957   -0.5833    0.0153    1    0.1043    0.1078
    5    2    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0638    0.0654
    6   -3    1    1   -0.1144    0.1289   -0.1085    0.1216    0.0094    1    0.0763    0.0778
    7    2    0   -4    0.1222   -0.6037    0.1201   -0.5973    0.0068    1    0.1330    0.1302
    8    3   -1   -3    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1024    0.1017
    9   -2    2    0   -0.2071    0.0524   -0.1952    0.0486    0.0125    1    0.0774    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0456    0.0467
   11    1   -1   -3    0.5426   -0.6213    0.5303   -0.6130    0.0148    1    0.1258    0.1248
   12   -1    3   -1   -0.1914   -0.0398   -0.1829   -0.0381    0.0087    1    0.0993    0.0984
   13    1   -3   -1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1    0.0995    0.0927
   14    1   -3   -3    0.5365   -0.1514    0.5293   -0.1451    0.0096    1    0.1495    0.1473
   15    0    2   -2   -0.3468   -0.2455   -0.3362   -0.2357    0.0144    1    0.0878    0.0881
   16    0   -2    0    0.1255    0.0358    0.1275    0.0362    0.0021    1    0.0616    0.0679
   17    0   -2   -2    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1165    0.1198
   18    0   -2   -4    1.0757   -0.5181    1.0696   -0.4972    0.0219    1    0.2595    0.2483
   19   -1   -3    1    0.0430    0.0288    0.0442    0.0295    0.0014    1    0.0961    0.0994
   20   -1   -3   -1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1189    0.1178
   21    1    1   -1   -0.0342   -0.0580   -0.0341   -0.0579    0.0001    1    0.0430    0.0568
   22   -2   -2    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0905    0.0899
   23   -3   -1    1    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.0806    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2    3    1   -3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3   -4    0    2   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4    1    1   -3   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5    2    0   -2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6   -3    1    1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7    2    0   -4    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8    3   -1   -3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9   -2    2    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10    1   -1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11    1   -1   -3    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12   -1    3   -1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13    1   -3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14    1   -3   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15    0    2   -2   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17    0   -2   -2    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18    0   -2   -4    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19   -1   -3    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -1   -3   -1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21    1    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22   -2   -2    0    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -3   -1    1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.247                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4140    0.9990    1.4161   90.5323   90.7905   90.2989      0.3616
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4132    0.9898    1.4300   90.0000   89.0299   90.0000      0.3657         0.9883    0.6922    3.8650    2.7070    3.9107
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0017    0.0256    0.0531    0.0000    4.1338    0.0000      0.0346         0.0357    0.0373    0.3653    0.2653    0.3972
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2139   -0.5598    0.3757)
 a2 = (    0.9550    0.2687   -0.1334)
 a3 = (   -0.0170    0.3804    0.5949)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2104   -0.5679    0.3661) (    0.0046    0.0144    0.0210)
 a2 = (    0.9639    0.2739   -0.1290) (    0.0262    0.0076    0.0057)
 a3 = (   -0.0300    0.3812    0.5857) (    0.0100    0.0132    0.0328)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.8603   32.1958 -175.9305    0.4961    2.0443    0.6678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0254      0.0023    0.0023    0.0797

# Number of computed bands
            135            157
# Figure of merit at the beginning and the end of the refinement
         9.0473        10.8987
# Chi-squares at the beginning and the end of the refinement
    0.0930    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0676    0.0702
    2   -3    1    3   -0.0143   -0.1685   -0.0130   -0.1762    0.0078    1    0.1006    0.0995
    3    4    0   -2   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.0988    0.0967
    4   -1    1    3   -0.2021   -0.5768   -0.1957   -0.5833    0.0091    1    0.1045    0.1078
    5   -2    0    2    0.0540   -0.2199    0.0560   -0.2234    0.0040    1    0.0649    0.0654
    6    3    1   -1   -0.1107    0.1229   -0.1085    0.1216    0.0026    1    0.0780    0.0778
    7   -2    0    4    0.1118   -0.5955    0.1201   -0.5973    0.0085    1    0.1337    0.1302
    8   -3   -1    3    0.1412   -0.2187    0.1454   -0.2240    0.0067    1    0.1042    0.1017
    9    2    2    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0795    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1   -1    3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1265    0.1248
   12    1    3    1   -0.1788   -0.0366   -0.1829   -0.0381    0.0043    1    0.1021    0.0984
   13   -1   -3    1    0.1996   -0.0086    0.1990   -0.0092    0.0009    1    0.1022    0.0927
   14   -1   -3    3    0.5343   -0.1527    0.5293   -0.1451    0.0091    1    0.1518    0.1473
   15    0    2    2   -0.3327   -0.2302   -0.3362   -0.2357    0.0065    1    0.0890    0.0881
   16    0   -2    0    0.1294    0.0364    0.1275    0.0362    0.0019    1    0.0633    0.0679
   17    0   -2    2    0.7394   -0.0849    0.7293   -0.0807    0.0109    1    0.1179    0.1198
   18    0   -2    4    1.0723   -0.5334    1.0696   -0.4972    0.0364    1    0.2621    0.2483
   19    1   -3   -1    0.0477    0.0316    0.0442    0.0295    0.0041    1    0.0988    0.0994
   20    1   -3    1    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1210    0.1178
   21   -1    1    1   -0.0313   -0.0522   -0.0341   -0.0579    0.0064    1    0.0440    0.0568
   22    2   -2    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0920    0.0899
   23    3   -1   -1    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.0819    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2   -3    1    3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3    4    0   -2   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4   -1    1    3   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5   -2    0    2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6    3    1   -1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7   -2    0    4    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8   -3   -1    3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9    2    2    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10   -1   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -1   -1    3    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12    1    3    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13   -1   -3    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14   -1   -3    3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15    0    2    2   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17    0   -2    2    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18    0   -2    4    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19    1   -3   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20    1   -3    1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21   -1    1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22    2   -2    0    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    3   -1   -1    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.250                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0024    1.4226    1.4026   90.2032   90.4586   90.2714      0.4665
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0044    1.4164    1.4059   90.0000   90.1575   90.0000      0.3628         0.7144    1.0075    2.7686    3.9044    3.8752
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0281    0.0223    0.0000    1.0358    0.0000      0.0237         0.0113    0.0219    0.1811    0.2668    0.2608
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2386   -0.9420   -0.2259)
 a2 = (   -0.5617   -0.0450   -0.4203)
 a3 = (    0.3915    0.2254   -0.5516)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2382   -0.9404   -0.2239) (    0.0080    0.0028    0.0056)
 a2 = (   -0.5667   -0.0438   -0.4188) (    0.0133    0.0054    0.0065)
 a3 = (    0.3891    0.2275   -0.5503) (    0.0095    0.0081    0.0090)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -159.2350  140.6253  120.5487    0.5295    0.4388    0.7927
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0000    0.0004    0.0018      0.0024    0.0023    0.0122

# Number of computed bands
            115            115
# Figure of merit at the beginning and the end of the refinement
         4.0517         9.5054
# Chi-squares at the beginning and the end of the refinement
    0.4682    0.1107
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7435   -0.0595   -0.7310   -0.0567    0.0128    1    0.0877    0.0702
    2   -3   -1    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    3   -1   -1   -0.0265    0.0900   -0.0262    0.0895    0.0007    1    0.1275    0.0967
    4   -2   -2    0   -0.1936   -0.5914   -0.1957   -0.5833    0.0083    1    0.1363    0.1078
    5   -2    0    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    2   -2    0   -0.1076    0.1207   -0.1085    0.1216    0.0012    1    0.1003    0.0778
    7   -3   -1   -1    0.1233   -0.5981    0.1201   -0.5973    0.0033    1    0.1747    0.1302
    8   -3    1   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1   -3    1   -0.1964    0.0493   -0.1952    0.0486    0.0014    1    0.1017    0.0726
   10   -1    1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -2    0   -2    0.5380   -0.6119    0.5303   -0.6130    0.0077    1    0.1646    0.1248
   12    0   -4    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1308    0.0984
   13   -1    3   -3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -1    1   -2    0.5318   -0.1499    0.5293   -0.1451    0.0054    1    0.0984    0.1473
   15   -1   -3    1   -0.3388   -0.2400   -0.3362   -0.2357    0.0050    1    0.1148    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1    1   -3    0.7304   -0.0817    0.7293   -0.0807    0.0014    1    0.1526    0.1198
   18   -2    0   -4    1.0567   -0.5082    1.0696   -0.4972    0.0169    1    0.3355    0.2483
   19    1    3   -3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    0    2   -4    0.4471    0.1648    0.4423    0.1634    0.0049    1    0.1566    0.1178
   21   -1   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1    1   -3    0.3016    0.3349    0.3053    0.3413    0.0075    1    0.1185    0.0899
   23    2    0   -2    0.0359    0.2743    0.0347    0.2716    0.0029    1    0.1055    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7333   -0.0571   -0.7310   -0.0567    0.0023    1          0.0680          0.0702
    2   -3   -1    1   -0.0135   -0.1738   -0.0130   -0.1762    0.0025    1          0.1014          0.0995
    3    3   -1   -1   -0.0269    0.0903   -0.0262    0.0895    0.0011    1          0.0993          0.0967
    4   -2   -2    0   -0.1957   -0.5869   -0.1957   -0.5833    0.0036    1          0.1056          0.1078
    5   -2    0    0    0.0566   -0.2238    0.0560   -0.2234    0.0008    1          0.0655          0.0654
    6    2   -2    0   -0.1078    0.1197   -0.1085    0.1216    0.0020    1          0.0782          0.0778
    7   -3   -1   -1    0.1214   -0.5967    0.1201   -0.5973    0.0014    1          0.1352          0.1302
    8   -3    1   -1    0.1442   -0.2205    0.1454   -0.2240    0.0037    1          0.1054          0.1017
    9    1   -3    1   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0795          0.0726
   10   -1    1   -1    0.2262   -0.1272    0.2251   -0.1274    0.0011    1          0.0471          0.0467
   11   -2    0   -2    0.5377   -0.6114    0.5303   -0.6130    0.0075    1          0.1275          0.1248
   12    0   -4    2   -0.1806   -0.0378   -0.1829   -0.0381    0.0023    1          0.1022          0.0984
   13   -1    3   -3    0.1985   -0.0085    0.1990   -0.0092    0.0008    1          0.1030          0.0927
   14   -2    2   -4    0.5299   -0.1482    0.5293   -0.1451    0.0032    1          0.1531          0.1473
   15   -1   -3    1   -0.3359   -0.2363   -0.3362   -0.2357    0.0006    1          0.0893          0.0881
   16    0    2   -2    0.1271    0.0357    0.1275    0.0362    0.0006    1          0.0637          0.0679
   17   -1    1   -3    0.7284   -0.0795    0.7293   -0.0807    0.0015    1          0.1184          0.1198
   18   -2    0   -4    1.0593   -0.5063    1.0696   -0.4972    0.0138    1          0.2601          0.2483
   19    1    3   -3    0.0449    0.0295    0.0442    0.0295    0.0007    1          0.0992          0.0994
   20    0    2   -4    0.4449    0.1646    0.4423    0.1634    0.0028    1          0.1218          0.1178
   21   -1   -1    1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0443          0.0568
   22    1    1   -3    0.3002    0.3340    0.3053    0.3413    0.0089    1          0.0923          0.0899
   23    2    0   -2    0.0355    0.2739    0.0347    0.2716    0.0024    1          0.0822          0.0816

###            No.251                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0048    1.4366    1.3857   90.1832   90.7603   90.0151      0.3911
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0042    1.4161    1.4064   90.0000   90.1111   90.0000      0.3547         0.7141    1.0069    2.8314    3.9928    3.9653
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0281    0.0223    0.0000    1.0356    0.0000      0.0230         0.0113    0.0219    0.1838    0.2710    0.2650
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2450    0.9377    0.2263)
 a2 = (   -0.5533   -0.0429   -0.4202)
 a3 = (   -0.4046   -0.2288    0.5522)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2380    0.9407    0.2238) (    0.0080    0.0028    0.0056)
 a2 = (   -0.5669   -0.0438   -0.4188) (    0.0133    0.0054    0.0065)
 a3 = (   -0.3888   -0.2278    0.5501) (    0.0095    0.0081    0.0090)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  159.2451   39.3597  -59.4710    0.5295    0.4387    0.7927
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            123            115
# Figure of merit at the beginning and the end of the refinement
         6.2262         9.4885
# Chi-squares at the beginning and the end of the refinement
    0.1652    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0736    0.0702
    2    3   -1   -1   -0.0127   -0.1764   -0.0130   -0.1762    0.0004    1    0.1090    0.0995
    3   -3   -1    1   -0.0265    0.0900   -0.0262    0.0895    0.0007    1    0.1066    0.0967
    4    2   -2    0   -0.1887   -0.6000   -0.1957   -0.5833    0.0181    1    0.1140    0.1078
    5    2    0    0    0.0590   -0.2259    0.0560   -0.2234    0.0040    1    0.0706    0.0654
    6   -2   -2    0   -0.1076    0.1207   -0.1085    0.1216    0.0012    1    0.0838    0.0778
    7    3   -1    1    0.1336   -0.5988    0.1201   -0.5973    0.0135    1    0.1464    0.1302
    8    3    1    1    0.1472   -0.2210    0.1454   -0.2240    0.0035    1    0.1138    0.1017
    9   -1   -3   -1   -0.1964    0.0493   -0.1952    0.0486    0.0014    1    0.0850    0.0726
   10    1    1    1    0.2280   -0.1262    0.2251   -0.1274    0.0031    1    0.0510    0.0467
   11    2    0    2    0.5470   -0.5970    0.5303   -0.6130    0.0231    1    0.1379    0.1248
   12    0   -4   -2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1093    0.0984
   13    1    3    3    0.1992   -0.0078    0.1990   -0.0092    0.0013    1    0.1113    0.0927
   14    2    2    4    0.5274   -0.1435    0.5293   -0.1451    0.0025    1    0.1662    0.1473
   15    1   -3   -1   -0.3410   -0.2427   -0.3362   -0.2357    0.0085    1    0.0957    0.0881
   16    0    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0687    0.0679
   17    1    1    3    0.7193   -0.0745    0.7293   -0.0807    0.0118    1    0.1279    0.1198
   18    2    0    4    1.0455   -0.4762    1.0696   -0.4972    0.0319    1    0.2767    0.2483
   19   -1    3    3    0.0446    0.0298    0.0442    0.0295    0.0005    1    0.1067    0.0994
   20    0    2    4    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1320    0.1178
   21    1   -1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0475    0.0568
   22   -1    1    3    0.3017    0.3304    0.3053    0.3413    0.0115    1    0.0998    0.0899
   23   -2    0    2    0.0375    0.2742    0.0347    0.2716    0.0038    1    0.0884    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    3   -1   -1   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3   -3   -1    1   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4    2   -2    0   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5    2    0    0    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6   -2   -2    0   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7    3   -1    1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    3    1    1    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9   -1   -3   -1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10    1    1    1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    2    0    2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    0   -4   -2   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13    1    3    3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    2    2    4    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    1   -3   -1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    0    2    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1    1    3    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18    2    0    4    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19   -1    3    3    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0    2    4    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1190          0.1178
   21    1   -1   -1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22   -1    1    3    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -2    0    2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.253                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3964    1.4477    0.9894   90.3545   90.8274   90.1783      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4110    1.4129    1.0032   90.0000   90.1971   90.0000      0.3559         1.4065    1.4084    3.9649    3.9702    2.8190
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0367    0.0187    0.0000    1.0932    0.0000      0.0235         0.0262    0.0287    0.2623    0.2821    0.1937
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4014    0.2270   -0.5479)
 a2 = (    0.5490    0.0426    0.4170)
 a3 = (    0.2542   -0.9516   -0.2272)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3867    0.2259   -0.5493) (    0.0060    0.0088    0.0046)
 a2 = (    0.5689    0.0445    0.4187) (    0.0180    0.0058    0.0068)
 a3 = (    0.2384   -0.9416   -0.2238) (    0.0090    0.0183    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -52.6440  102.8174   14.0872    0.5503    0.7081    0.4447
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002    0.0000      0.0024    0.0023    0.0135

# Number of computed bands
            400            169
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.4106
# Chi-squares at the beginning and the end of the refinement
    0.2222    0.0237
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    1    1   -3   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -1    1    3   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    0    2   -2   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    0    0   -2    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6    0    2    2   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7   -1    1   -3    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8   -1   -1   -3    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    1    3    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10   -1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11   -2    0   -2    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    2    4    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13   -3   -3   -1    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14   -4   -2   -2    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1    3   -1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16   -2   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -3   -1   -1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18   -4    0   -2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -3   -3    1    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20   -4   -2    0    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1    1   -1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -3   -1    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    0    2    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7314   -0.0575   -0.7310   -0.0567    0.0009    1          0.0666          0.0702
    2    1    1   -3   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0994          0.0995
    3   -1    1    3   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0973          0.0967
    4    0    2   -2   -0.1960   -0.5860   -0.1957   -0.5833    0.0027    1          0.1034          0.1078
    5    0    0   -2    0.0568   -0.2236    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6    0    2    2   -0.1078    0.1198   -0.1085    0.1216    0.0018    1          0.0767          0.0778
    7   -1    1   -3    0.1204   -0.5961    0.1201   -0.5973    0.0012    1          0.1324          0.1302
    8   -1   -1   -3    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1033          0.1017
    9    1    3    1   -0.1948    0.0485   -0.1952    0.0486    0.0004    1          0.0780          0.0726
   10   -1   -1   -1    0.2257   -0.1270    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11   -2    0   -2    0.5354   -0.6130    0.5303   -0.6130    0.0050    1          0.1247          0.1248
   12    2    4    0   -0.1811   -0.0377   -0.1829   -0.0381    0.0018    1          0.1002          0.0984
   13   -3   -3   -1    0.1981   -0.0085    0.1990   -0.0092    0.0011    1          0.1008          0.0927
   14   -4   -2   -2    0.5299   -0.1495    0.5293   -0.1451    0.0044    1          0.1497          0.1473
   15    1    3   -1   -0.3361   -0.2361   -0.3362   -0.2357    0.0005    1          0.0876          0.0881
   16   -2   -2    0    0.1267    0.0356    0.1275    0.0362    0.0010    1          0.0623          0.0679
   17   -3   -1   -1    0.7297   -0.0816    0.7293   -0.0807    0.0009    1          0.1157          0.1198
   18   -4    0   -2    1.0590   -0.5129    1.0696   -0.4972    0.0189    1          0.2543          0.2483
   19   -3   -3    1    0.0444    0.0292    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20   -4   -2    0    0.4458    0.1645    0.4423    0.1634    0.0036    1          0.1189          0.1178
   21    1    1   -1   -0.0335   -0.0572   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -3   -1    1    0.3005    0.3350    0.3053    0.3413    0.0079    1          0.0901          0.0899
   23   -2    0    2    0.0351    0.2741    0.0347    0.2716    0.0025    1          0.0804          0.0816

###            No.254                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4120    1.4046    1.0088   90.4844   90.5549   91.4221      0.3878
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4142    1.4211    0.9952   90.0000   89.9679   90.0000      0.3581         1.4210    1.4279    3.9490    3.9682    2.7790
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0369    0.0212    0.0000    1.1138    0.0000      0.0238         0.0303    0.0263    0.2626    0.2832    0.1940
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2037   -0.5613    0.3812)
 a2 = (   -0.0312    0.3764    0.6038)
 a3 = (   -0.9457   -0.2682    0.1285)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2110   -0.5641    0.3705) (    0.0099    0.0049    0.0060)
 a2 = (   -0.0276    0.3788    0.5924) (    0.0048    0.0148    0.0124)
 a3 = (   -0.9584   -0.2726    0.1296) (    0.0207    0.0105    0.0052)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   31.9010   82.5726  -74.0958    0.5695    0.5910    0.6744
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0073      0.0021    0.0024    0.0152

# Number of computed bands
            400            163
# Figure of merit at the beginning and the end of the refinement
         4.3518         9.3980
# Chi-squares at the beginning and the end of the refinement
    0.3435    0.0299
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7618   -0.0567   -0.7310   -0.0567    0.0308    0    0.0745    0.0702
    2   -3    3   -1   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1078    0.0995
    3    4   -2    0   -0.0285    0.0975   -0.0262    0.0895    0.0084    1    0.1058    0.0967
    4   -1    3   -1   -0.1983   -0.5990   -0.1957   -0.5833    0.0159    1    0.1138    0.1078
    5   -2    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0696    0.0654
    6    3   -1   -1   -0.1139    0.1286   -0.1085    0.1216    0.0089    1    0.0834    0.0778
    7   -2    4    0    0.1223   -0.6041    0.1201   -0.5973    0.0072    1    0.1451    0.1302
    8   -3    3    1    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1118    0.1017
    9    2    0   -2   -0.2065    0.0527   -0.1952    0.0486    0.0120    1    0.0845    0.0726
   10   -1    1    1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0498    0.0467
   11   -1    3    1    0.5431   -0.6214    0.5303   -0.6130    0.0152    1    0.1374    0.1248
   12    1    1   -3   -0.1911   -0.0394   -0.1829   -0.0381    0.0084    1    0.1084    0.0984
   13   -1    1    3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1086    0.0927
   14   -1    3    3    0.5364   -0.1516    0.5293   -0.1451    0.0096    1    0.1633    0.1473
   15    0    2   -2   -0.3473   -0.2448   -0.3362   -0.2357    0.0143    1    0.0957    0.0881
   16    0    0    2    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0672    0.0679
   17    0    2    2    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1272    0.1198
   18    0    4    2    1.0767   -0.5174    1.0696   -0.4972    0.0215    1    0.2835    0.2483
   19    1   -1    3    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1049    0.0994
   20    1    1    3    0.4520    0.1679    0.4423    0.1634    0.0106    1    0.1298    0.1178
   21   -1    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0469    0.0568
   22    2    0    2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0988    0.0899
   23    3   -1    1    0.0368    0.2822    0.0347    0.2716    0.0108    1    0.0880    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7306   -0.0564   -0.7310   -0.0567    0.0005    1          0.0662          0.0702
    2   -3    3   -1   -0.0132   -0.1735   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    4   -2    0   -0.0269    0.0907   -0.0262    0.0895    0.0015    1          0.0974          0.0967
    4   -1    3   -1   -0.1968   -0.5860   -0.1957   -0.5833    0.0029    1          0.1028          0.1078
    5   -2    2    0    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0641          0.0654
    6    3   -1   -1   -0.1081    0.1200   -0.1085    0.1216    0.0016    1          0.0768          0.0778
    7   -2    4    0    0.1205   -0.5969    0.1201   -0.5973    0.0006    1          0.1315          0.1302
    8   -3    3    1    0.1440   -0.2198    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    2    0   -2   -0.1950    0.0482   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10   -1    1    1    0.2255   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    3    1    0.5376   -0.6131    0.5303   -0.6130    0.0073    1          0.1236          0.1248
   12    1    1   -3   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13   -1    1    3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -1    3    3    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1489          0.1473
   15    0    2   -2   -0.3358   -0.2358   -0.3362   -0.2357    0.0004    1          0.0874          0.0881
   16    0    0    2    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0624          0.0679
   17    0    2    2    0.7295   -0.0790    0.7293   -0.0807    0.0017    1          0.1148          0.1198
   18    0    4    2    1.0632   -0.5090    1.0696   -0.4972    0.0135    1          0.2514          0.2483
   19    1   -1    3    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    1    1    3    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1186          0.1178
   21   -1    1   -1   -0.0332   -0.0571   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    2    0    2    0.2995    0.3344    0.3053    0.3413    0.0090    1          0.0900          0.0899
   23    3   -1    1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0805          0.0816

###            No.257                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4159    1.4168    0.9971   90.1126   90.2351   90.0790      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4123    1.4119    1.0030   90.0000   90.5025   90.0000      0.3581         1.4080    1.4076    3.9440    3.9429    2.8010
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0003    0.0199    0.0445    0.0000    1.1933    0.0000      0.0286         0.0623    0.0581    0.3148    0.3196    0.2558
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3583    0.6070    0.0455)
 a2 = (    0.5947   -0.3367   -0.1768)
 a3 = (   -0.1813    0.1844   -0.9691)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3577    0.6094    0.0461) (    0.0035    0.0021    0.0045)
 a2 = (    0.5973   -0.3372   -0.1765) (    0.0089    0.0054    0.0062)
 a3 = (   -0.1784    0.1878   -0.9628) (    0.0189    0.0144    0.0416)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  165.3421  165.0760 -134.5939    1.2635    0.4714    1.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            155            157
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.3751
# Chi-squares at the beginning and the end of the refinement
    1.8913    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    4   -2    0   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3   -3    3   -1   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    3   -1   -1   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    2   -2    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6   -1    3   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    3   -3   -1    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8    2   -4    0    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    1    3   -1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    1   -3   -1    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    3    3   -1   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13   -1   -3    0    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14   -1   -5   -1    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    3    1   -1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16   -2   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -1   -3   -1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18    0   -2   -1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19   -4   -2    0    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20   -3   -3   -1    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    2    0    0   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22   -3   -1   -1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23   -3    1   -1    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    4   -2    0   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3   -3    3   -1   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4    3   -1   -1   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    2   -2    0    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -1    3   -1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    3   -3   -1    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    2   -4    0    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    1    3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0   -2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1   -3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12    3    3   -1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13   -2   -4    0    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14   -1   -5   -1    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15    3    1   -1   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16   -2   -2    0    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17   -1   -3   -1    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    0   -4   -2    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19   -4   -2    0    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20   -3   -3   -1    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    2    0    0   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -3   -1   -1    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23   -3    1   -1    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.258                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4154    1.4165    0.9976   90.3140   90.5272   90.0408      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4123    1.4119    1.0030   90.0000   89.4975   90.0000      0.3581         1.4080    1.4076    3.9440    3.9429    2.8010
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0003    0.0199    0.0445    0.0000    1.1933    0.0000      0.0286         0.0623    0.0581    0.3148    0.3196    0.2558
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3584   -0.6071   -0.0473)
 a2 = (   -0.5948    0.3367    0.1768)
 a3 = (   -0.1930    0.1785   -0.9674)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3577   -0.6094   -0.0461) (    0.0035    0.0021    0.0045)
 a2 = (   -0.5973    0.3372    0.1765) (    0.0089    0.0054    0.0062)
 a3 = (   -0.1784    0.1878   -0.9628) (    0.0189    0.0144    0.0416)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -14.6579  165.0760 -134.5939    1.2635    0.4714    1.3305
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            139            157
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.3751
# Chi-squares at the beginning and the end of the refinement
    0.3229    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2   -4    2    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    3   -3   -1   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4   -3    1   -1   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5   -2    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1   -3   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7   -3    3   -1    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8   -2    4    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -1   -3   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    3   -1    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12   -3   -3   -1   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    2    4    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1    5   -1    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15   -3   -1   -1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    2    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1    3   -1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    0    4   -2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    4    2    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    3    3   -1    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21   -2    0    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    3    1   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    3   -1   -1    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2   -4    2    0   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3    3   -3   -1   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4   -3    1   -1   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5   -2    2    0    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    1   -3   -1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7   -3    3   -1    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8   -2    4    0    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9   -1   -3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12   -3   -3   -1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    2    4    0    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    1    5   -1    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15   -3   -1   -1   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    2    2    0    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    1    3   -1    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    0    4   -2    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19    4    2    0    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20    3    3   -1    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21   -2    0    0   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22    3    1   -1    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23    3   -1   -1    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.261                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4080    1.4159    1.0042   89.1108   92.0623   91.0272      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4164    1.4164    0.9969   90.0000   90.1321   90.0000      0.3577         1.4208    1.4208    3.9597    3.9598    2.7870
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0298    0.0183    0.0000    0.9829    0.0000      0.0235         0.0261    0.0251    0.2606    0.2736    0.1904
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0533    0.3836    0.5960)
 a2 = (   -0.2009    0.5680   -0.3689)
 a3 = (   -0.9505   -0.2696    0.1309)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0287    0.3807    0.5939) (    0.0088    0.0044    0.0028)
 a2 = (   -0.2099    0.5629   -0.3709) (    0.0069    0.0140    0.0051)
 a3 = (   -0.9570   -0.2711    0.1303) (    0.0178    0.0093    0.0056)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  121.9837   82.6481  -74.1132    0.4278    0.6911    0.4087
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0049      0.0024    0.0024    0.0152

# Number of computed bands
            400            171
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.3353
# Chi-squares at the beginning and the end of the refinement
    0.4342    0.0239
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3    3   -1   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -2   -4    0   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    3    1   -1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    2    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -1   -3   -1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    4    2    0    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    3    1    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    0   -2   -2   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    3    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    1   -1   -3   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    1    3    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    3    1    3    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    2    0   -2   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    2    0    2    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    4    0    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1   -1    3    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    1   -1    3    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1    1   -1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    0   -2    2    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -1   -3    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7321   -0.0575   -0.7310   -0.0567    0.0013    1          0.0664          0.0702
    2    3    3   -1   -0.0133   -0.1738   -0.0130   -0.1762    0.0024    1          0.0995          0.0995
    3   -2   -4    0   -0.0268    0.0903   -0.0262    0.0895    0.0011    1          0.0975          0.0967
    4    3    1   -1   -0.1958   -0.5860   -0.1957   -0.5833    0.0027    1          0.1031          0.1078
    5    2    2    0    0.0567   -0.2235    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6   -1   -3   -1   -0.1077    0.1199   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    4    2    0    0.1204   -0.5960    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    3    3    1    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1034          0.1017
    9    0   -2   -2   -0.1948    0.0485   -0.1952    0.0486    0.0004    1          0.0781          0.0726
   10    1    1    1    0.2258   -0.1272    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11    3    1    1    0.5354   -0.6128    0.5303   -0.6130    0.0051    1          0.1241          0.1248
   12    1   -1   -3   -0.1810   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    1    1    3    0.1983   -0.0086    0.1990   -0.0092    0.0009    1          0.1009          0.0927
   14    3    1    3    0.5300   -0.1494    0.5293   -0.1451    0.0044    1          0.1495          0.1473
   15    2    0   -2   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0875          0.0881
   16    0    0    2    0.1269    0.0356    0.1275    0.0362    0.0008    1          0.0624          0.0679
   17    2    0    2    0.7296   -0.0814    0.7293   -0.0807    0.0007    1          0.1153          0.1198
   18    4    0    2    1.0589   -0.5120    1.0696   -0.4972    0.0183    1          0.2525          0.2483
   19   -1   -1    3    0.0445    0.0293    0.0442    0.0295    0.0004    1          0.0973          0.0994
   20    1   -1    3    0.4457    0.1646    0.4423    0.1634    0.0036    1          0.1188          0.1178
   21    1    1   -1   -0.0334   -0.0571   -0.0341   -0.0579    0.0011    1          0.0434          0.0568
   22    0   -2    2    0.3003    0.3348    0.3053    0.3413    0.0082    1          0.0901          0.0899
   23   -1   -3    1    0.0352    0.2740    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.262                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4142    1.4138    1.0003   89.9956   90.0704   90.0317      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4160    1.4070    1.0039   90.0000   89.8772   90.0000      0.3551         1.4106    1.4016    3.9878    3.9623    2.8270
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0313    0.0190    0.0000    0.8440    0.0000      0.0232         0.0267    0.0218    0.2600    0.2730    0.1920
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5686    0.0441    0.4181)
 a2 = (    0.3858    0.2266   -0.5478)
 a3 = (   -0.2367    0.9450    0.2243)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5672    0.0428    0.4185) (    0.0037    0.0069    0.0049)
 a2 = (    0.3882    0.2287   -0.5497) (    0.0131    0.0058    0.0096)
 a3 = (   -0.2384    0.9411    0.2232) (    0.0091    0.0181    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  142.5396   76.9772 -165.8862    0.4849    0.4726    0.4494
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
            151            167
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.3162
# Chi-squares at the beginning and the end of the refinement
    0.3004    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    1    1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    1   -1   -3   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    2    0    2   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    2    0   -2   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    1   -1    3    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8   -1   -1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    3    1   -1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10   -1   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    0   -2    2    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    4    2    0   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13   -3   -3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -2   -4    2    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    3    1    1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16   -2   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -1   -3    1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18    0   -4    2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19   -3   -3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -2   -4    0    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    1    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1   -3   -1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23    0   -2   -2    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0    0   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    1    1    3   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -1   -3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    2    0    2   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    0    0    2    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6    2    0   -2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7    1   -1    3    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8   -1   -1    3    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9    3    1   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10   -1   -1    1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    0   -2    2    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12    4    2    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3   -3    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2   -4    2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    3    1    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16   -2   -2    0    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17   -1   -3    1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18    0   -4    2    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19   -3   -3   -1    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20   -2   -4    0    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22   -1   -3   -1    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    0   -2   -2    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.263                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4058    1.4205    1.0016   90.0739   90.1389   90.1856      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4160    1.4070    1.0039   90.0000   89.8772   90.0000      0.3551         1.4106    1.4016    3.9878    3.9623    2.8270
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0313    0.0190    0.0000    0.8440    0.0000      0.0232         0.0267    0.0218    0.2600    0.2730    0.1920
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5731   -0.0459   -0.4189)
 a2 = (    0.3801    0.2244   -0.5484)
 a3 = (    0.2364   -0.9438   -0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5672   -0.0428   -0.4185) (    0.0037    0.0069    0.0049)
 a2 = (    0.3882    0.2287   -0.5497) (    0.0131    0.0058    0.0096)
 a3 = (    0.2384   -0.9411   -0.2232) (    0.0091    0.0181    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -142.5396  103.0228   14.1138    0.4849    0.4726    0.4494
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
            139            167
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.3161
# Chi-squares at the beginning and the end of the refinement
    0.3181    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2   -1    1   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1   -1    3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4   -2    0   -2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -2    0    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7   -1   -1   -3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    1   -1   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -3    1    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    0   -2   -2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12   -4    2    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    3   -3   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    2   -4   -2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15   -3    1   -1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    2   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -3   -1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    0   -4   -2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    3   -3    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    2   -4    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21   -1    1   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -3    1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    0   -2    2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    0   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -1    1   -3   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1   -1    3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2    0   -2   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    0    0   -2    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6   -2    0    2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7   -1   -1   -3    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8    1   -1   -3    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9   -3    1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10    1   -1   -1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    0   -2   -2    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12   -4    2    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3   -3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2   -4   -2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -3    1   -1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    2   -2    0    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    1   -3   -1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18    0   -4   -2    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19    3   -3    1    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    2   -4    0    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22    1   -3    1    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    0   -2    2    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.266                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4199    1.3990    1.0070   89.9885   90.0420   91.0446      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4064    1.4161    1.0042   90.0000   89.8891   90.0000      0.3547         1.4004    1.4102    3.9654    3.9929    2.8315
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0308    0.0160    0.0000    1.0356    0.0000      0.0226         0.0222    0.0280    0.2532    0.2693    0.1863
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3736    0.2245   -0.5534)
 a2 = (   -0.5748   -0.0446   -0.4227)
 a3 = (   -0.2352    0.9391    0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3888    0.2278   -0.5501) (    0.0051    0.0082    0.0041)
 a2 = (   -0.5669   -0.0438   -0.4188) (    0.0149    0.0055    0.0061)
 a3 = (   -0.2380    0.9407    0.2238) (    0.0087    0.0156    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -127.4728   77.1006 -165.8712    0.4683    0.6641    0.4294
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            133            169
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.2879
# Chi-squares at the beginning and the end of the refinement
    3.2098    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    1   -1    2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -1   -1   -3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    0   -2    2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0    1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6    0   -2   -2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7   -1   -1    3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8   -1    1    2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9    1   -3   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10   -1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -2    0    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    2   -4    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13   -2    2    1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -4    2    2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    1   -3    1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16   -1    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -3    1    1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18   -2    0    1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19   -2    2   -1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -4    2    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    1   -1    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -3    1   -1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -2    0   -2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    1   -1    3   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3   -1   -1   -3   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4    0   -2    2   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5    0    0    2    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    0   -2   -2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7   -1   -1    3    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -1    1    3    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    1   -3   -1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10   -1    1    1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0    2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    2   -4    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13   -3    3    1    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -4    2    2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    1   -3    1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16   -2    2    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -3    1    1    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18   -4    0    2    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19   -3    3   -1    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20   -4    2    0    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1    1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22   -3    1   -1    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -2    0   -2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.269                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4107    1.4101    1.0057   90.5681   90.6216   91.1176      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4206    1.4140    0.9957   90.0000   89.8037   90.0000      0.3584         1.4267    1.4201    3.9641    3.9458    2.7785
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0281    0.0168    0.0000    0.8863    0.0000      0.0234         0.0240    0.0249    0.2592    0.2697    0.1876
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0170    0.3796    0.5986)
 a2 = (    0.2182   -0.5595    0.3775)
 a3 = (    0.9484    0.2690   -0.1306)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0293    0.3787    0.5927) (    0.0077    0.0041    0.0026)
 a2 = (    0.2104   -0.5642    0.3709) (    0.0065    0.0132    0.0051)
 a3 = (    0.9581    0.2716   -0.1303) (    0.0164    0.0087    0.0055)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   58.0814   97.2852  105.9324    0.4002    0.6081    0.3908
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0064      0.0023    0.0023    0.0145

# Number of computed bands
            133            169
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.2381
# Chi-squares at the beginning and the end of the refinement
    3.4536    0.0274
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    2   -2    1   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -2    4    0   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    3   -1    1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    1   -1    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -1    3    1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    4   -2    0    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    2   -2   -1    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9    0    2    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    3   -1   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    1    1    3   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    1   -1   -2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    3   -1   -3    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    2    0    2   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    2    0   -2    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    2    0   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19   -1    1   -2    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20    1    1   -3    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    1   -1    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22    0    2   -2    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -1    3   -1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7319   -0.0558   -0.7310   -0.0567    0.0012    1          0.0663          0.0702
    2    3   -3    1   -0.0132   -0.1732   -0.0130   -0.1762    0.0030    1          0.0995          0.0995
    3   -2    4    0   -0.0272    0.0909   -0.0262    0.0895    0.0018    1          0.0976          0.0967
    4    3   -1    1   -0.1960   -0.5866   -0.1957   -0.5833    0.0033    1          0.1029          0.1078
    5    2   -2    0    0.0567   -0.2229    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1    3    1   -0.1082    0.1200   -0.1085    0.1216    0.0016    1          0.0770          0.0778
    7    4   -2    0    0.1214   -0.5961    0.1201   -0.5973    0.0017    1          0.1318          0.1302
    8    3   -3   -1    0.1437   -0.2195    0.1454   -0.2240    0.0048    1          0.1033          0.1017
    9    0    2    2   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0782          0.0726
   10    1   -1   -1    0.2252   -0.1267    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11    3   -1   -1    0.5372   -0.6112    0.5303   -0.6130    0.0071    1          0.1238          0.1248
   12    1    1    3   -0.1809   -0.0378   -0.1829   -0.0381    0.0020    1          0.1004          0.0984
   13    1   -1   -3    0.1978   -0.0086    0.1990   -0.0092    0.0013    1          0.1010          0.0927
   14    3   -1   -3    0.5293   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    2    0    2   -0.3361   -0.2359   -0.3362   -0.2357    0.0002    1          0.0874          0.0881
   16    0    0   -2    0.1268    0.0354    0.1275    0.0362    0.0010    1          0.0625          0.0679
   17    2    0   -2    0.7285   -0.0795    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    4    0   -2    1.0604   -0.5071    1.0696   -0.4972    0.0135    1          0.2517          0.2483
   19   -1    1   -3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    1    1   -3    0.4449    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1    1   -0.0331   -0.0567   -0.0341   -0.0579    0.0016    1          0.0434          0.0568
   22    0    2   -2    0.3000    0.3347    0.3053    0.3413    0.0085    1          0.0902          0.0899
   23   -1    3   -1    0.0351    0.2744    0.0347    0.2716    0.0028    1          0.0807          0.0816

###            No.270                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4067    0.9935    1.4313   90.2549   90.6743   90.1572      0.4899
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4062    1.0041    1.4165   90.0000   89.9484   90.0000      0.3545         0.9927    0.7088    3.9664    2.8322    3.9957
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0253    0.0333    0.0000    2.4844    0.0000      0.0239         0.0233    0.0153    0.2674    0.2038    0.2853
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3943   -0.2277    0.5460)
 a2 = (   -0.2439    0.9506    0.2238)
 a3 = (   -0.5618   -0.0435   -0.4132)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3884   -0.2287    0.5501) (    0.0143    0.0035    0.0094)
 a2 = (   -0.2374    0.9410    0.2236) (    0.0088    0.0245    0.0053)
 a3 = (   -0.5666   -0.0434   -0.4189) (    0.0196    0.0090    0.0093)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   73.8184  126.3470  -85.6005    0.3457    1.3556    0.4973
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
            159            153
# Figure of merit at the beginning and the end of the refinement
         3.1381         9.2377
# Chi-squares at the beginning and the end of the refinement
    0.6850    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0905    0.0702
    2   -1    3   -1   -0.0123   -0.1716   -0.0130   -0.1762    0.0046    1    0.1379    0.0995
    3    1   -3   -1   -0.0258    0.0871   -0.0262    0.0895    0.0024    1    0.1352    0.0967
    4    0    2   -2   -0.1859   -0.5813   -0.1957   -0.5833    0.0100    1    0.1415    0.1078
    5    0    2    0    0.0567   -0.2209    0.0560   -0.2234    0.0026    1    0.0892    0.0654
    6    0   -2   -2   -0.1036    0.1167   -0.1085    0.1216    0.0069    1    0.1060    0.0778
    7    1    3   -1    0.1238   -0.5851    0.1201   -0.5973    0.0127    1    0.1822    0.1302
    8    1    3    1    0.1428   -0.2183    0.1454   -0.2240    0.0062    1    0.1436    0.1017
    9   -1   -1   -3   -0.1898    0.0484   -0.1952    0.0486    0.0054    1    0.1069    0.0726
   10    1    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0640    0.0467
   11    1    1    0    0.5283   -0.5985    0.5303   -0.6130    0.0147    1    0.0851    0.1248
   12   -2    0   -4   -0.1770   -0.0367   -0.1829   -0.0381    0.0060    1    0.1372    0.0984
   13    3    1    3    0.1996   -0.0088    0.1990   -0.0092    0.0007    1    0.1393    0.0927
   14    4    2    2    0.5241   -0.1485    0.5293   -0.1451    0.0062    1    0.2069    0.1473
   15   -1    1   -3   -0.3313   -0.2362   -0.3362   -0.2357    0.0050    1    0.1196    0.0881
   16    2    0    2    0.1286    0.0365    0.1275    0.0362    0.0012    1    0.0860    0.0679
   17    3    1    1    0.7194   -0.0811    0.7293   -0.0807    0.0100    1    0.1589    0.1198
   18    4    2    0    1.0360   -0.4969    1.0696   -0.4972    0.0335    1    0.3440    0.2483
   19    3   -1    3    0.0459    0.0308    0.0442    0.0295    0.0021    1    0.1340    0.0994
   20    2    0    1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0819    0.1178
   21   -1    1   -1   -0.0324   -0.0556   -0.0341   -0.0579    0.0029    1    0.0599    0.0568
   22    3   -1    1    0.2966    0.3315    0.3053    0.3413    0.0131    1    0.1244    0.0899
   23    1   -1    0    0.0343    0.2691    0.0347    0.2716    0.0026    1    0.0556    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1    3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -3   -1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    0    2   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6    0   -2   -2   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    1    3   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1    3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9   -1   -1   -3   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    1    1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    2    2    0    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -2    0   -4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3    1    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14    4    2    2    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15   -1    1   -3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2    0    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    3    1    1    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    4    2    0    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19    3   -1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    4    0    2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    3   -1    1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23    2   -2    0    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.271                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4172    1.0008    1.4101   89.9388   90.1140   90.1151      0.5606
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4062    1.0041    1.4165   90.0000   90.0516   90.0000      0.3545         0.9927    0.7088    3.9664    2.8322    3.9957
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0253    0.0333    0.0000    2.4844    0.0000      0.0239         0.0233    0.0153    0.2674    0.2038    0.2853
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3837    0.2249   -0.5478)
 a2 = (    0.2386   -0.9443   -0.2232)
 a3 = (   -0.5702   -0.0442   -0.4193)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3884    0.2287   -0.5501) (    0.0143    0.0035    0.0094)
 a2 = (    0.2374   -0.9410   -0.2236) (    0.0088    0.0245    0.0053)
 a3 = (   -0.5666   -0.0434   -0.4189) (    0.0196    0.0090    0.0093)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -106.1816  126.3470  -85.6005    0.3457    1.3556    0.4973
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
            141            153
# Figure of merit at the beginning and the end of the refinement
         2.3593         9.2377
# Chi-squares at the beginning and the end of the refinement
    1.3287    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0525    0.0702
    2    1   -3   -1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1    0.1571    0.0995
    3   -1    3   -1   -0.0271    0.0906   -0.0262    0.0895    0.0015    1    0.1540    0.0967
    4    0   -2   -2   -0.1960   -0.5843   -0.1957   -0.5833    0.0010    1    0.1632    0.1078
    5    0   -2    0    0.0561   -0.2222    0.0560   -0.2234    0.0012    1    0.1014    0.0654
    6    0    2   -2   -0.1083    0.1206   -0.1085    0.1216    0.0010    1    0.1214    0.0778
    7   -1   -3   -1    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.2090    0.1302
    8   -1   -3    1    0.1424   -0.2186    0.1454   -0.2240    0.0062    1    0.1631    0.1017
    9    1    1   -3   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1232    0.0726
   10   -1   -1    1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0726    0.0467
   11   -1   -1    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.0978    0.1248
   12    2    0   -4   -0.1831   -0.0376   -0.1829   -0.0381    0.0005    1    0.1582    0.0984
   13   -3   -1    3    0.1959   -0.0086    0.1990   -0.0092    0.0031    1    0.1586    0.0927
   14   -4   -2    2    0.5276   -0.1507    0.5293   -0.1451    0.0058    1    0.2358    0.1473
   15    1   -1   -3   -0.3371   -0.2365   -0.3362   -0.2357    0.0012    1    0.1384    0.0881
   16   -2    0    2    0.1248    0.0352    0.1275    0.0362    0.0029    1    0.0980    0.0679
   17   -3   -1    1    0.7288   -0.0838    0.7293   -0.0807    0.0031    1    0.1819    0.1198
   18   -4   -2    0    1.0559   -0.5189    1.0696   -0.4972    0.0257    1    0.4026    0.2483
   19   -3    1    3    0.0428    0.0286    0.0442    0.0295    0.0017    1    0.1529    0.0994
   20   -2    0    1    0.4449    0.1643    0.4423    0.1634    0.0027    1    0.0932    0.1178
   21    1   -1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0683    0.0568
   22   -3    1    1    0.2989    0.3353    0.3053    0.3413    0.0088    1    0.1417    0.0899
   23   -1    1    0    0.0339    0.2734    0.0347    0.2716    0.0019    1    0.0633    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    1   -3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1    3   -1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    0   -2   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0   -2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6    0    2   -2   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7   -1   -3   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8   -1   -3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9    1    1   -3   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10   -1   -1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11   -2   -2    0    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    2    0   -4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -3   -1    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14   -4   -2    2    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15    1   -1   -3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16   -2    0    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -3   -1    1    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -4   -2    0    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19   -3    1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20   -4    0    2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -3    1    1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23   -2    2    0    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.276                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0061    1.4030    1.4170   90.1649   90.1371   90.4597      0.7261
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0039    1.4070    1.4160   90.0000   89.8772   90.0000      0.3551         0.7089    0.9936    2.8270    3.9623    3.9878
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0219    0.0268    0.0000    0.8440    0.0000      0.0229         0.0134    0.0221    0.1825    0.2631    0.2683
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2289   -0.9429   -0.2159)
 a2 = (   -0.3905   -0.2270    0.5514)
 a3 = (   -0.5674   -0.0440   -0.4173)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2384   -0.9411   -0.2232) (    0.0084    0.0020    0.0048)
 a2 = (   -0.3882   -0.2287    0.5497) (    0.0094    0.0046    0.0079)
 a3 = (   -0.5672   -0.0428   -0.4185) (    0.0133    0.0070    0.0062)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -16.1581  126.3739  -85.5359    0.3597    0.4365    0.6522
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
            149            155
# Figure of merit at the beginning and the end of the refinement
         1.4517         9.2236
# Chi-squares at the beginning and the end of the refinement
   14.3426    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0677    0.0702
    2   -2    0    0    0.0525   -0.2162   -0.0130   -0.1762    0.0768    1    0.1304    0.0995
    3    1   -1   -2   -0.0340    0.0122   -0.0262    0.0895    0.0777    1    0.1166    0.0967
    4   -2    0   -2   -0.1969   -0.5740   -0.1957   -0.5833    0.0094    1    0.2093    0.1078
    5   -2    0    0    0.0525   -0.2162    0.0560   -0.2234    0.0080    1    0.1304    0.0654
    6    2    0   -2   -0.1112    0.1256   -0.1085    0.1216    0.0048    1    0.1566    0.0778
    7   -3    1   -1    0.1135   -0.5891    0.1201   -0.5973    0.0106    1    0.2687    0.1302
    8   -2    0    0    0.0525   -0.2162    0.1454   -0.2240    0.0933    1    0.1304    0.1017
    9    1   -1   -3   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1591    0.0726
   10   -1    1    1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0937    0.0467
   11   -1    1    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1261    0.1248
   12    0   -2   -4   -0.1781   -0.0368   -0.1829   -0.0381    0.0049    1    0.2050    0.0984
   13    0    2    2    0.1296    0.0367    0.1990   -0.0092    0.0831    1    0.1278    0.0927
   14   -2    4    2    0.5294   -0.1493    0.5293   -0.1451    0.0042    1    0.3072    0.1473
   15   -1   -1   -3   -0.3304   -0.2308   -0.3362   -0.2357    0.0076    1    0.1784    0.0881
   16    0    2    2    0.1296    0.0367    0.1275    0.0362    0.0022    1    0.1278    0.0679
   17   -1    3    1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.2370    0.1198
   18   -2    4    0    1.0580   -0.5121    1.0696   -0.4972    0.0189    1    0.5258    0.2483
   19   -2    0    1    0.0033   -0.0060    0.0442    0.0295    0.0541    1    0.1317    0.0994
   20    0    2    1    0.4473    0.1652    0.4423    0.1634    0.0053    1    0.1221    0.1178
   21   -1   -1   -1   -0.0297   -0.0495   -0.0341   -0.0579    0.0095    1    0.0888    0.0568
   22    1    3    1    0.3045    0.3364    0.3053    0.3413    0.0050    1    0.1866    0.0899
   23    1    1    0    0.0389    0.2814    0.0347    0.2716    0.0106    1    0.0828    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -3   -1   -1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    3    1   -1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2    0   -2   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    0    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6    2    0   -2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7   -3    1   -1    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8   -3    1    1    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9    1   -1   -3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10   -1    1    1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11   -2    2    0    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12    0   -2   -4   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13   -1    3    3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14   -2    4    2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1   -1   -3   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    0    2    2    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17   -1    3    1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18   -2    4    0    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19    1    3    3    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    0    4    2    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22    1    3    1    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2    2    0    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.282                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4158    0.9969    1.4171   90.1198   90.4010   90.0980      0.5416
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4293    0.9902    1.4133   90.0000   90.9009   90.0000      0.3651         1.0113    0.7006    3.9150    2.7123    3.8712
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0016    0.0522    0.0496    0.0000    4.1273    0.0000      0.0270         0.0365    0.0187    0.2893    0.2462    0.3166
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0272   -0.3803   -0.5946)
 a2 = (    0.9567    0.2714   -0.1318)
 a3 = (    0.2122   -0.5653    0.3653)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0298   -0.3810   -0.5862) (    0.0108    0.0202    0.0136)
 a2 = (    0.9635    0.2738   -0.1290) (    0.0521    0.0138    0.0046)
 a3 = (    0.2104   -0.5677    0.3664) (    0.0073    0.0340    0.0105)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -98.6702   57.9258   20.4946    0.3462    2.1716    0.4074
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0240      0.0023    0.0023    0.0795

# Number of computed bands
            161            157
# Figure of merit at the beginning and the end of the refinement
         2.3953         8.9191
# Chi-squares at the beginning and the end of the refinement
    1.1551    0.0278
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7213   -0.0546   -0.7310   -0.0567    0.0100    1    0.1002    0.0702
    2   -3    1   -3   -0.0136   -0.1779   -0.0130   -0.1762    0.0018    1    0.1524    0.0995
    3    2    0    4   -0.0247    0.0826   -0.0262    0.0895    0.0070    1    0.1488    0.0967
    4   -3    1   -1   -0.1961   -0.5850   -0.1957   -0.5833    0.0017    1    0.1578    0.1078
    5   -2    0   -2    0.0577   -0.2279    0.0560   -0.2234    0.0049    1    0.0985    0.0654
    6    1    1    3   -0.1018    0.1134   -0.1085    0.1216    0.0106    1    0.1170    0.0778
    7   -2    0   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1011    0.1302
    8   -3   -1   -3    0.1463   -0.2240    0.1454   -0.2240    0.0009    1    0.1586    0.1017
    9    0    2    2   -0.1879    0.0472   -0.1952    0.0486    0.0074    1    0.1187    0.0726
   10   -1   -1   -1    0.2291   -0.1291    0.2251   -0.1274    0.0044    1    0.0707    0.0467
   11   -3   -1   -1    0.5353   -0.6141    0.5303   -0.6130    0.0050    1    0.1907    0.1248
   12   -1    3    1   -0.1773   -0.0365   -0.1829   -0.0381    0.0058    1    0.1527    0.0984
   13   -1   -3   -1    0.2005   -0.0085    0.1990   -0.0092    0.0017    1    0.1541    0.0927
   14   -3   -3   -1    0.5311   -0.1497    0.5293   -0.1451    0.0049    1    0.2292    0.1473
   15   -1    1    0   -0.3339   -0.2341   -0.3362   -0.2357    0.0029    1    0.0665    0.0881
   16    0   -2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0951    0.0679
   17   -1   -1    0    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.0879    0.1198
   18   -4   -2    0    1.0587   -0.5122    1.0696   -0.4972    0.0185    1    0.3893    0.2483
   19    1   -3    1    0.0436    0.0292    0.0442    0.0295    0.0007    1    0.1482    0.0994
   20   -1   -3    1    0.4434    0.1650    0.4423    0.1634    0.0019    1    0.1811    0.1178
   21   -1    1   -1   -0.0351   -0.0595   -0.0341   -0.0579    0.0018    1    0.0662    0.0568
   22    0   -2    2    0.2951    0.3316    0.3053    0.3413    0.0141    1    0.1368    0.0899
   23    1   -1    3    0.0331    0.2656    0.0347    0.2716    0.0063    1    0.1223    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7328   -0.0564   -0.7310   -0.0567    0.0018    1          0.0655          0.0702
    2   -3    1   -3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1000          0.0995
    3    2    0    4   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0982          0.0967
    4   -3    1   -1   -0.1959   -0.5867   -0.1957   -0.5833    0.0034    1          0.1022          0.1078
    5   -2    0   -2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6    1    1    3   -0.1079    0.1198   -0.1085    0.1216    0.0018    1          0.0773          0.0778
    7   -4    0   -2    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8   -3   -1   -3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9    0    2    2   -0.1948    0.0483   -0.1952    0.0486    0.0006    1          0.0784          0.0726
   10   -1   -1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -3   -1   -1    0.5377   -0.6120    0.5303   -0.6130    0.0074    1          0.1223          0.1248
   12   -1    3    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.1008          0.0984
   13   -1   -3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0009    1          0.1015          0.0927
   14   -3   -3   -1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15   -2    2    0   -0.3359   -0.2362   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17   -2   -2    0    0.7290   -0.0792    0.7293   -0.0807    0.0016    1          0.1139          0.1198
   18   -4   -2    0    1.0611   -0.5068    1.0696   -0.4972    0.0128    1          0.2461          0.2483
   19    1   -3    1    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -1   -3    1    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21   -1    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0437          0.0568
   22    0   -2    2    0.2997    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    1   -1    3    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0809          0.0816

###            No.283                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3994    1.4199    1.0073   91.2391   91.7080   89.1509      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4214    1.4248    0.9876   90.0000   90.6807   90.0000      0.3491         1.4393    1.4427    4.0717    4.0813    2.8289
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0013    0.0222    0.1225    0.0000    4.3938    0.0000      0.0562         0.1798    0.1892    0.6560    0.6606    0.5752
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6023    0.3410    0.1790)
 a2 = (   -0.3481   -0.6106   -0.0481)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5923    0.3346    0.1795) (    0.0053    0.0057    0.0247)
 a2 = (   -0.3552   -0.6035   -0.0472) (    0.0067    0.0098    0.0048)
 a3 = (    0.1796   -0.1824    0.9798) (    0.0215    0.0139    0.1312)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  104.7775   15.2967   45.2444    1.2132    2.0978    1.2918
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003    0.0185      0.0024    0.0024    0.1402

# Number of computed bands
            400            152
# Figure of merit at the beginning and the end of the refinement
         4.1190         8.8164
# Chi-squares at the beginning and the end of the refinement
    0.1460    0.0253
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    2   -4    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    3    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    1   -3    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2   -2    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -3    1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3   -3    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    4   -2    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -3   -1    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    2    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    3   -1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12   -3   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    4    2    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    5    1    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15   -1   -3    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    2    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    3    1    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    4    0    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19    2    4    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    3    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    0   -2    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    1    3    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -1    3    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7335   -0.0566   -0.7310   -0.0567    0.0025    1          0.0674          0.0702
    2    2   -4    0   -0.0131   -0.1736   -0.0130   -0.1762    0.0026    1          0.0990          0.0995
    3   -3    3    1   -0.0266    0.0899   -0.0262    0.0895    0.0007    1          0.0969          0.0967
    4    1   -3    1   -0.1947   -0.5860   -0.1957   -0.5833    0.0029    1          0.1043          0.1078
    5    2   -2    0    0.0565   -0.2232    0.0560   -0.2234    0.0006    1          0.0641          0.0654
    6   -3    1    1   -0.1072    0.1198   -0.1085    0.1216    0.0022    1          0.0764          0.0778
    7    3   -3    1    0.1203   -0.5950    0.1201   -0.5973    0.0024    1          0.1335          0.1302
    8    4   -2    0    0.1435   -0.2201    0.1454   -0.2240    0.0043    1          0.1030          0.1017
    9   -3   -1    1   -0.1949    0.0489   -0.1952    0.0486    0.0005    1          0.0775          0.0726
   10    2    0    0    0.2256   -0.1276    0.2251   -0.1274    0.0006    1          0.0460          0.0467
   11    3   -1    1    0.5343   -0.6129    0.5303   -0.6130    0.0039    1          0.1266          0.1248
   12   -3   -3    1   -0.1814   -0.0378   -0.1829   -0.0381    0.0015    1          0.0995          0.0984
   13    4    2    0    0.1985   -0.0087    0.1990   -0.0092    0.0006    1          0.1001          0.0927
   14    5    1    1    0.5303   -0.1501    0.5293   -0.1451    0.0051    1          0.1505          0.1473
   15   -1   -3    1   -0.3362   -0.2371   -0.3362   -0.2357    0.0014    1          0.0876          0.0881
   16    2    2    0    0.1269    0.0357    0.1275    0.0362    0.0007    1          0.0618          0.0679
   17    3    1    1    0.7304   -0.0817    0.7293   -0.0807    0.0015    1          0.1171          0.1198
   18    4    0    2    1.0590   -0.5131    1.0696   -0.4972    0.0191    1          0.2609          0.2483
   19    2    4    0    0.0444    0.0294    0.0442    0.0295    0.0003    1          0.0963          0.0994
   20    3    3    1    0.4460    0.1653    0.4423    0.1634    0.0041    1          0.1192          0.1178
   21    0   -2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0431          0.0568
   22    1    3    1    0.2993    0.3353    0.3053    0.3413    0.0085    1          0.0904          0.0899
   23   -1    3    1    0.0347    0.2731    0.0347    0.2716    0.0015    1          0.0803          0.0816

###            No.284                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9945    1.4188    1.4177   89.9933   90.8185   90.7528      0.3957
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9810    1.4301    1.4257   90.0000   89.0155   90.0000      0.3435         0.6881    1.0031    2.8562    4.1636    4.1509
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0010    0.1514    0.1451    0.0000    3.4764    0.0000      0.0227         0.0694    0.0141    0.1889    0.5196    0.5038
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2031    0.1799   -0.9685)
 a2 = (   -0.3571   -0.6059   -0.0473)
 a3 = (   -0.5943    0.3365    0.1767)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1782    0.1831   -0.9870) (    0.0307    0.0133    0.0079)
 a2 = (   -0.3536   -0.6014   -0.0477) (    0.0366    0.0645    0.0039)
 a3 = (   -0.5905    0.3328    0.1808) (    0.0636    0.0369    0.0049)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -94.0315   76.0454 -119.4777    0.3277    1.8840    0.3888
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003    0.0297      0.0023    0.0023    0.1103

# Number of computed bands
            137            229
# Figure of merit at the beginning and the end of the refinement
         7.0851         8.7037
# Chi-squares at the beginning and the end of the refinement
    0.2831    0.0315
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0742    0.0702
    2    0   -4    2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1106    0.0995
    3   -1    3   -3   -0.0275    0.0903   -0.0262    0.0895    0.0015    1    0.1084    0.0967
    4   -1   -3    1   -0.2008   -0.5827   -0.1957   -0.5833    0.0051    1    0.1152    0.1078
    5    0   -2    2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0714    0.0654
    6   -1    1   -3   -0.1084    0.1195   -0.1085    0.1216    0.0021    1    0.0857    0.0778
    7   -1   -3    3    0.1148   -0.5976    0.1201   -0.5973    0.0053    1    0.1473    0.1302
    8    0   -2    4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1148    0.1017
    9   -1   -1   -3   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0872    0.0726
   10    0    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0512    0.0467
   11   -1   -1    3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1388    0.1248
   12   -1   -3   -3   -0.1821   -0.0374   -0.1829   -0.0381    0.0010    1    0.1118    0.0984
   13    0    2    4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1116    0.0927
   14   -1    1    5    0.5334   -0.1530    0.5293   -0.1451    0.0089    1    0.1658    0.1473
   15   -1   -3   -1   -0.3365   -0.2343   -0.3362   -0.2357    0.0014    1    0.0978    0.0881
   16    0    2    2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0690    0.0679
   17   -1    1    3    0.7393   -0.0854    0.7293   -0.0807    0.0110    1    0.1286    0.1198
   18   -2    0    4    1.0727   -0.5366    1.0696   -0.4972    0.0396    1    0.2872    0.2483
   19    0    4    2    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1076    0.0994
   20   -1    3    3    0.4493    0.1674    0.4423    0.1634    0.0080    1    0.1314    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0481    0.0568
   22   -1    3    1    0.2996    0.3402    0.3053    0.3413    0.0058    1    0.0997    0.0899
   23   -1    3   -1    0.0322    0.2747    0.0347    0.2716    0.0039    1    0.0893    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7338   -0.0562   -0.7310   -0.0567    0.0028    1          0.0676          0.0702
    2    0   -4    3    0.0218   -0.2070   -0.0130   -0.1762    0.0465    1          0.1114          0.0995
    3   -1    3   -3   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0961          0.0967
    4   -1   -3    1   -0.1944   -0.5867   -0.1957   -0.5833    0.0036    1          0.1043          0.1078
    5    0   -2    2    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0636          0.0654
    6   -1    1   -3   -0.1072    0.1196   -0.1085    0.1216    0.0024    1          0.0758          0.0778
    7   -1   -3    3    0.1211   -0.5952    0.1201   -0.5973    0.0023    1          0.1335          0.1302
    8    0   -2    4    0.1437   -0.2200    0.1454   -0.2240    0.0043    1          0.1023          0.1017
    9   -1   -1   -3   -0.1948    0.0488   -0.1952    0.0486    0.0004    1          0.0769          0.0726
   10    0    0    2    0.2256   -0.1274    0.2251   -0.1274    0.0005    1          0.0457          0.0467
   11   -1   -1    3    0.5354   -0.6120    0.5303   -0.6130    0.0052    1          0.1272          0.1248
   12   -1   -3   -3   -0.1815   -0.0378   -0.1829   -0.0381    0.0014    1          0.0987          0.0984
   13    0    2    4    0.1983   -0.0086    0.1990   -0.0092    0.0009    1          0.0993          0.0927
   14   -1    1    5    0.5301   -0.1493    0.5293   -0.1451    0.0042    1          0.1504          0.1473
   15   -1   -3   -1   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0872          0.0881
   16    0    2    2    0.1267    0.0357    0.1275    0.0362    0.0009    1          0.0613          0.0679
   17   -1    1    3    0.7298   -0.0805    0.7293   -0.0807    0.0005    1          0.1175          0.1198
   18   -2    0    4    1.0597   -0.5102    1.0696   -0.4972    0.0163    1          0.2636          0.2483
   19    0    6    2    0.0125    0.0107    0.0442    0.0295    0.0368    1          0.1347          0.0994
   20   -1    3    3    0.4452    0.1656    0.4423    0.1634    0.0036    1          0.1189          0.1178
   21    0   -2    0   -0.0335   -0.0575   -0.0341   -0.0579    0.0008    1          0.0427          0.0568
   22   -1    3    1    0.2986    0.3349    0.3053    0.3413    0.0093    1          0.0901          0.0899
   23   -1    3   -1    0.0345    0.2727    0.0347    0.2716    0.0011    1          0.0798          0.0816

###            No.285                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9928    1.4266    1.4121   90.0051   90.1847   90.5268      0.3821
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9769    1.4334    1.4286   90.0000   91.2016   90.0000      0.3408         0.6838    1.0033    2.8661    4.2053    4.1915
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0012    0.1507    0.1446    0.0000    3.4508    0.0000      0.0224         0.0684    0.0140    0.1884    0.5214    0.5059
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1888   -0.1765    0.9735)
 a2 = (    0.3552    0.6025    0.0470)
 a3 = (   -0.5962    0.3375    0.1792)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1772   -0.1832    0.9917) (    0.0304    0.0133    0.0077)
 a2 = (    0.3528    0.6000    0.0478) (    0.0363    0.0639    0.0039)
 a3 = (   -0.5890    0.3319    0.1817) (    0.0631    0.0366    0.0049)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   85.9556   76.1567 -119.4900    0.3260    1.8607    0.3886
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0003    0.0366      0.0023    0.0023    0.1087

# Number of computed bands
            155            229
# Figure of merit at the beginning and the end of the refinement
         7.9512         8.1811
# Chi-squares at the beginning and the end of the refinement
    0.1685    0.0316
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0718    0.0702
    2    0    4    2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1065    0.0995
    3    1   -3   -3   -0.0274    0.0900   -0.0262    0.0895    0.0014    1    0.1043    0.0967
    4    1    3    1   -0.1976   -0.5912   -0.1957   -0.5833    0.0081    1    0.1116    0.1078
    5    0    2    2    0.0579   -0.2258    0.0560   -0.2234    0.0031    1    0.0690    0.0654
    6    1   -1   -3   -0.1080    0.1193   -0.1085    0.1216    0.0024    1    0.0825    0.0778
    7    1    3    3    0.1214   -0.6005    0.1201   -0.5973    0.0034    1    0.1431    0.1302
    8    0    2    4    0.1455   -0.2220    0.1454   -0.2240    0.0020    1    0.1112    0.1017
    9    1    1   -3   -0.1947    0.0490   -0.1952    0.0486    0.0006    1    0.0838    0.0726
   10    0    0    2    0.2276   -0.1289    0.2251   -0.1274    0.0029    1    0.0497    0.0467
   11    1    1    3    0.5359   -0.6195    0.5303   -0.6130    0.0086    1    0.1351    0.1248
   12    1    3   -3   -0.1821   -0.0370   -0.1829   -0.0381    0.0013    1    0.1074    0.0984
   13    0   -2    4    0.2008   -0.0094    0.1990   -0.0092    0.0018    1    0.1081    0.0927
   14    1   -1    5    0.5345   -0.1543    0.5293   -0.1451    0.0106    1    0.1616    0.1473
   15    1    3   -1   -0.3396   -0.2374   -0.3362   -0.2357    0.0037    1    0.0941    0.0881
   16    0   -2    2    0.1289    0.0359    0.1275    0.0362    0.0015    1    0.0666    0.0679
   17    1   -1    3    0.7384   -0.0882    0.7293   -0.0807    0.0118    1    0.1253    0.1198
   18    2    0    4    1.0645   -0.5288    1.0696   -0.4972    0.0321    1    0.2774    0.2483
   19    0   -4    2    0.0452    0.0300    0.0442    0.0295    0.0012    1    0.1035    0.0994
   20    1   -3    3    0.4538    0.1654    0.4423    0.1634    0.0116    1    0.1277    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0462    0.0568
   22    1   -3    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0966    0.0899
   23    1   -3   -1    0.0335    0.2773    0.0347    0.2716    0.0058    1    0.0860    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7341   -0.0560   -0.7310   -0.0567    0.0031    1          0.0679          0.0702
    2    0    4    3    0.0218   -0.2069   -0.0130   -0.1762    0.0464    1          0.1111          0.0995
    3    1   -3   -3   -0.0267    0.0898   -0.0262    0.0895    0.0006    1          0.0958          0.0967
    4    1    3    1   -0.1944   -0.5867   -0.1957   -0.5833    0.0036    1          0.1046          0.1078
    5    0    2    2    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0634          0.0654
    6    1   -1   -3   -0.1072    0.1196   -0.1085    0.1216    0.0023    1          0.0755          0.0778
    7    1    3    3    0.1212   -0.5953    0.1201   -0.5973    0.0023    1          0.1339          0.1302
    8    0    2    4    0.1436   -0.2201    0.1454   -0.2240    0.0043    1          0.1021          0.1017
    9    1    1   -3   -0.1948    0.0488   -0.1952    0.0486    0.0004    1          0.0767          0.0726
   10    0    0    2    0.2257   -0.1274    0.2251   -0.1274    0.0006    1          0.0456          0.0467
   11    1    1    3    0.5357   -0.6119    0.5303   -0.6130    0.0055    1          0.1278          0.1248
   12    1    3   -3   -0.1814   -0.0379   -0.1829   -0.0381    0.0015    1          0.0984          0.0984
   13    0   -2    4    0.1984   -0.0086    0.1990   -0.0092    0.0008    1          0.0991          0.0927
   14    1   -1    5    0.5301   -0.1492    0.5293   -0.1451    0.0042    1          0.1507          0.1473
   15    1    3   -1   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0872          0.0881
   16    0   -2    2    0.1269    0.0357    0.1275    0.0362    0.0008    1          0.0611          0.0679
   17    1   -1    3    0.7297   -0.0802    0.7293   -0.0807    0.0006    1          0.1180          0.1198
   18    2    0    4    1.0599   -0.5093    1.0696   -0.4972    0.0155    1          0.2661          0.2483
   19    0   -6    2    0.0126    0.0108    0.0442    0.0295    0.0367    1          0.1343          0.0994
   20    1   -3    3    0.4452    0.1656    0.4423    0.1634    0.0035    1          0.1191          0.1178
   21    0    2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0425          0.0568
   22    1   -3    1    0.2986    0.3349    0.3053    0.3413    0.0093    1          0.0902          0.0899
   23    1   -3   -1    0.0346    0.2727    0.0347    0.2716    0.0011    1          0.0797          0.0816

###            No.286                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4082    0.9950    1.4275   90.0147   90.6568   90.4801      0.5002
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4534    0.9729    1.4146   90.0000   89.2505   90.0000      0.3612         1.0274    0.6877    4.0242    2.6937    3.9169
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0003    0.0372    0.0193    0.0000    0.8039    0.0000      0.0273         0.0140    0.0255    0.3046    0.2284    0.3012
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3531    0.6140    0.0516)
 a2 = (   -0.1763    0.1928   -0.9705)
 a3 = (   -0.5907    0.3344    0.1735)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3537    0.5886    0.0443) (    0.0056    0.0033    0.0035)
 a2 = (   -0.1916    0.1898   -0.9919) (    0.0125    0.0116    0.0365)
 a3 = (   -0.5966    0.3343    0.1792) (    0.0091    0.0063    0.0055)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  176.1832   75.2650 -120.0325    0.3012    0.3989    0.5750
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0015    0.0072    0.0349      0.0023    0.0022    0.0363

# Number of computed bands
            137            225
# Figure of merit at the beginning and the end of the refinement
         3.0554         7.5087
# Chi-squares at the beginning and the end of the refinement
    1.7472    0.8184
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0951    0.0702
    2    2    0    1   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.0705    0.0995
    3   -3   -1   -3   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.1381    0.0967
    4    3   -1    1   -0.1926   -0.5922   -0.1957   -0.5833    0.0094    1    0.1469    0.1078
    5    2    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0909    0.0654
    6   -1   -1   -3   -0.1092    0.1239   -0.1085    0.1216    0.0024    1    0.1081    0.0778
    7    3   -1    3    0.1205   -0.5961    0.1201   -0.5973    0.0012    1    0.1872    0.1302
    8    2    0    3    0.1087   -0.2276    0.1454   -0.2240    0.0369    1    0.1167    0.1017
    9    1   -1   -3   -0.2048    0.0518   -0.1952    0.0486    0.0102    1    0.1090    0.0726
   10    0    0    1    0.2224   -0.1259    0.2251   -0.1274    0.0031    1    0.0321    0.0467
   11    1   -1    3    0.5365   -0.6150    0.5303   -0.6130    0.0065    1    0.1752    0.1248
   12    3   -1   -3   -0.1922   -0.0413   -0.1829   -0.0381    0.0099    1    0.1402    0.0984
   13   -2    0    3    0.1670    0.0151    0.1990   -0.0092    0.0402    1    0.1116    0.0927
   14   -1   -1    5    0.5302   -0.1466    0.5293   -0.1451    0.0017    1    0.2085    0.1473
   15    3   -1   -1   -0.3433   -0.2471   -0.3362   -0.2357    0.0134    1    0.1240    0.0881
   16   -2    0    2    0.1187    0.0352    0.1275    0.0362    0.0088    1    0.0866    0.0679
   17   -1   -1    3    0.7311   -0.0737    0.7293   -0.0807    0.0073    1    0.1613    0.1198
   18    0   -2    4    1.0707   -0.5071    1.0696   -0.4972    0.0100    1    0.3598    0.2483
   19   -2    0    1    0.0367    0.0253    0.0442    0.0295    0.0086    1    0.0679    0.0994
   20   -3   -1    3    0.4372    0.1699    0.4423    0.1634    0.0083    1    0.1654    0.1178
   21    2    0    0   -0.0363   -0.0632   -0.0341   -0.0579    0.0057    1    0.0614    0.0568
   22   -3   -1    1    0.2879    0.3322    0.3053    0.3413    0.0197    1    0.1262    0.0899
   23   -3   -1   -1    0.0329    0.2669    0.0347    0.2716    0.0050    1    0.1141    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7205   -0.0480   -0.7310   -0.0567    0.0136    1          0.0717          0.0702
    2    6    0    2   -0.0287   -0.1440   -0.0130   -0.1762    0.0358    1          0.1428          0.0995
    3   -3   -1   -3   -0.0282    0.0884   -0.0262    0.0895    0.0023    1          0.1012          0.0967
    4    3   -1    1   -0.2009   -0.5966   -0.1957   -0.5833    0.0142    1          0.1095          0.1078
    5    2    0    2    0.0591   -0.2258    0.0560   -0.2234    0.0040    1          0.0664          0.0654
    6   -1   -1   -3   -0.1091    0.1138   -0.1085    0.1216    0.0078    1          0.0809          0.0778
    7    3   -1    3    0.1257   -0.6036    0.1201   -0.5973    0.0084    1          0.1401          0.1302
    8    2    0    4    0.1443   -0.2211    0.1454   -0.2240    0.0031    1          0.1077          0.1017
    9    1   -1   -3   -0.1916    0.0427   -0.1952    0.0486    0.0069    1          0.0825          0.0726
   10    0    0    2    0.2222   -0.1309    0.2251   -0.1274    0.0045    1          0.0485          0.0467
   11    1   -1    3    0.5396   -0.6132    0.5303   -0.6130    0.0093    1          0.1342          0.1248
   12    3   -1   -3   -0.1783   -0.0411   -0.1829   -0.0381    0.0055    1          0.1049          0.0984
   13   -2    0    4    0.1970   -0.0173    0.1990   -0.0092    0.0084    1          0.1058          0.0927
   14   -1   -1    5    0.5251   -0.1559    0.5293   -0.1451    0.0116    1          0.1592          0.1473
   15    3   -1   -1   -0.3386   -0.2356   -0.3362   -0.2357    0.0024    1          0.0918          0.0881
   16   -2    0    2    0.1294    0.0270    0.1275    0.0362    0.0094    1          0.0650          0.0679
   17   -1   -1    3    0.7263   -0.0906    0.7293   -0.0807    0.0103    1          0.1244          0.1198
   18    0   -2    4    1.0607   -0.5134    1.0696   -0.4972    0.0185    1          0.2799          0.2483
   19   -6    0    2    0.0170    0.0061    0.0442    0.0295    0.0359    1          0.1410          0.0994
   20   -3   -1    3    0.4507    0.1537    0.4423    0.1634    0.0128    1          0.1261          0.1178
   21    2    0    0   -0.0305   -0.0606   -0.0341   -0.0579    0.0045    1          0.0444          0.0568
   22   -3   -1    1    0.3090    0.3327    0.3053    0.3413    0.0093    1          0.0953          0.0899
   23   -3   -1   -1    0.0352    0.2753    0.0347    0.2716    0.0037    1          0.0839          0.0816

###            No.287                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2610    1.7797    1.0899   89.9148  125.1463   90.1539      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2582    1.7833    1.0926   90.0000  125.3280   90.0000      0.3589         1.1515    1.6322    3.5055    4.9687    3.0442
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0781    0.0845    0.0320    0.0000    5.0183    0.0000      0.0393         0.0489    0.1101    0.4414    0.5932    0.3453
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6167    0.4099   -0.6263)
 a2 = (   -0.2847   -0.4830   -0.0377)
 a3 = (   -0.9454    0.5352    0.2810)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6189    0.4143   -0.6280) (    0.0361    0.0135    0.0438)
 a2 = (   -0.2834   -0.4823   -0.0389) (    0.0131    0.0235    0.0026)
 a3 = (   -0.9466    0.5336    0.2787) (    0.0459    0.0279    0.0213)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -96.1419   40.4169 -115.7491    0.3859    3.3968    0.5595
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003    0.0002      0.0023    0.0023    0.1152

# Number of computed bands
            195             63
# Figure of merit at the beginning and the end of the refinement
         3.3663         7.4789
# Chi-squares at the beginning and the end of the refinement
    0.4909    0.3905
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    0   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2    0   -4    1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3   -1    3   -1   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4   -2   -6    2   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5    0   -2    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6   -1    1   -1   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7   -1   -3    2    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8    0   -2    2    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9   -1   -1   -1   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1   -1    2    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12   -1   -3   -1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13    0    2    2    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14   -1    1    3    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15   -1   -3    0   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16    0    4    2    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17   -2    2    4    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18   -2    0    3    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19    0    6    2    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20   -1    3    2    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21    0   -4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22   -1    3    1    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23   -1    3    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7345   -0.0557   -0.7310   -0.0567    0.0036    1          0.0535          0.0702
    2    0   -4    1   -0.0130   -0.1756   -0.0130   -0.1762    0.0006    1          0.0798          0.0995
    3   -1    3   -1   -0.0264    0.0889   -0.0262    0.0895    0.0006    1          0.0781          0.0967
    4   -1   -3    1   -0.1958   -0.5882   -0.1957   -0.5833    0.0048    1          0.0830          0.1078
    5    0   -2    1    0.0570   -0.2238    0.0560   -0.2234    0.0011    1          0.0515          0.0654
    6   -1    1   -1   -0.1076    0.1200   -0.1085    0.1216    0.0018    1          0.0616          0.0778
    7   -1   -3    2    0.1206   -0.5959    0.1201   -0.5973    0.0015    1          0.1060          0.1302
    8    0   -2    2    0.1433   -0.2194    0.1454   -0.2240    0.0050    1          0.0827          0.1017
    9   -1   -1   -1   -0.1972    0.0494   -0.1952    0.0486    0.0021    1          0.0625          0.0726
   10    0    0    1    0.2236   -0.1262    0.2251   -0.1274    0.0019    1          0.0369          0.0467
   11   -1   -1    2    0.5344   -0.6122    0.5303   -0.6130    0.0041    1          0.0995          0.1248
   12   -1   -3   -1   -0.1847   -0.0385   -0.1829   -0.0381    0.0019    1          0.0802          0.0984
   13    0    2    2    0.1948   -0.0084    0.1990   -0.0092    0.0042    1          0.0803          0.0927
   14   -1    1    3    0.5275   -0.1486    0.5293   -0.1451    0.0039    1          0.1191          0.1473
   15   -1   -3    0   -0.3389   -0.2388   -0.3362   -0.2357    0.0041    1          0.0703          0.0881
   16    0    2    1    0.1230    0.0346    0.1275    0.0362    0.0047    1          0.0497          0.0679
   17   -1    1    2    0.7274   -0.0800    0.7293   -0.0807    0.0021    1          0.0920          0.1198
   18   -2    0    3    1.0597   -0.5111    1.0696   -0.4972    0.0171    1          0.2025          0.2483
   19    0    4    1    0.0411    0.0271    0.0442    0.0295    0.0040    1          0.0776          0.0994
   20   -1    3    2    0.4416    0.1646    0.4423    0.1634    0.0014    1          0.0946          0.1178
   21    0   -4    0   -0.0349   -0.0603   -0.0341   -0.0579    0.0025    1          0.0695          0.0568
   22   -1    3    1    0.2956    0.3326    0.3053    0.3413    0.0130    1          0.0718          0.0899
   23   -1    3    0    0.0339    0.2702    0.0347    0.2716    0.0017    1          0.0644          0.0816

###            No.288                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2584    1.7827    1.0908   90.0735  125.1838   89.8782      0.3076
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2581    1.7833    1.0895   90.0000  125.0945   90.0000      0.3589         1.1548    1.6369    3.5058    4.9692    3.0357
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0160    0.1797    0.0991    0.0000    1.0338    0.0000      0.0262         0.1108    0.0310    0.2593    0.6179    0.3538
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3255   -0.1229   -0.9079)
 a2 = (    0.2842    0.4821    0.0376)
 a3 = (    0.9450   -0.5350   -0.2809)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3277   -0.1194   -0.9067) (    0.0288    0.0218    0.0132)
 a2 = (    0.2834    0.4823    0.0389) (    0.0278    0.0493    0.0029)
 a3 = (    0.9466   -0.5336   -0.2787) (    0.0971    0.0564    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -85.7495   69.3755   58.0676    0.3337    2.2554    0.3886
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003    0.0002      0.0023    0.0023    0.1152

# Number of computed bands
            175             64
# Figure of merit at the beginning and the end of the refinement
         3.4923         7.4372
# Chi-squares at the beginning and the end of the refinement
    0.4970    0.3905
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0914    0.0702
    2    0    4   -1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.0683    0.0995
    3   -1   -3    2   -0.0266    0.0895   -0.0262    0.0895    0.0004    1    0.0669    0.0967
    4   -2    6    0   -0.1963   -0.5845   -0.1957   -0.5833    0.0013    1    0.1421    0.1078
    5    0    2   -1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0441    0.0654
    6   -1   -1    2   -0.1073    0.1197   -0.1085    0.1216    0.0022    1    0.0527    0.0778
    7   -1    3   -1    0.1182   -0.5951    0.1201   -0.5973    0.0030    1    0.0908    0.1302
    8    0    2   -2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.0709    0.1017
    9   -1    1    2   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0535    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1    1   -1    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0854    0.1248
   12   -1    3    2   -0.1821   -0.0376   -0.1829   -0.0381    0.0009    1    0.0686    0.0984
   13    0   -2   -2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.0689    0.0927
   14   -1   -1   -2    0.5300   -0.1507    0.5293   -0.1451    0.0056    1    0.1023    0.1473
   15   -1    3    1   -0.3365   -0.2364   -0.3362   -0.2357    0.0008    1    0.0601    0.0881
   16    0   -4   -2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0853    0.0679
   17   -2   -2   -2    0.7311   -0.0827    0.7293   -0.0807    0.0026    1    0.1586    0.1198
   18   -2    0   -1    1.0599   -0.5186    1.0696   -0.4972    0.0235    1    0.1741    0.2483
   19    0   -6   -2    0.0744    0.0377    0.0442    0.0295    0.0313    1    0.1077    0.0994
   20   -1   -3   -1    0.4453    0.1654    0.4423    0.1634    0.0036    1    0.0812    0.1178
   21    0    4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0596    0.0568
   22   -1   -3    0    0.2983    0.3351    0.3053    0.3413    0.0093    1    0.0617    0.0899
   23   -1   -3    1    0.0341    0.2723    0.0347    0.2716    0.0009    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7345   -0.0557   -0.7310   -0.0567    0.0036    1          0.0535          0.0702
    2    0    4   -1   -0.0130   -0.1756   -0.0130   -0.1762    0.0006    1          0.0798          0.0995
    3   -1   -3    2   -0.0264    0.0889   -0.0262    0.0895    0.0006    1          0.0781          0.0967
    4   -1    3    0   -0.1958   -0.5882   -0.1957   -0.5833    0.0048    1          0.0830          0.1078
    5    0    2   -1    0.0570   -0.2238    0.0560   -0.2234    0.0011    1          0.0515          0.0654
    6   -1   -1    2   -0.1076    0.1200   -0.1085    0.1216    0.0018    1          0.0616          0.0778
    7   -1    3   -1    0.1206   -0.5959    0.1201   -0.5973    0.0015    1          0.1060          0.1302
    8    0    2   -2    0.1433   -0.2194    0.1454   -0.2240    0.0050    1          0.0827          0.1017
    9   -1    1    2   -0.1972    0.0494   -0.1952    0.0486    0.0021    1          0.0625          0.0726
   10    0    0   -1    0.2236   -0.1262    0.2251   -0.1274    0.0019    1          0.0369          0.0467
   11   -1    1   -1    0.5344   -0.6122    0.5303   -0.6130    0.0041    1          0.0995          0.1248
   12   -1    3    2   -0.1847   -0.0385   -0.1829   -0.0381    0.0019    1          0.0802          0.0984
   13    0   -2   -2    0.1948   -0.0084    0.1990   -0.0092    0.0042    1          0.0803          0.0927
   14   -1   -1   -2    0.5275   -0.1486    0.5293   -0.1451    0.0039    1          0.1191          0.1473
   15   -1    3    1   -0.3389   -0.2388   -0.3362   -0.2357    0.0041    1          0.0703          0.0881
   16    0   -2   -1    0.1230    0.0346    0.1275    0.0362    0.0047    1          0.0497          0.0679
   17   -1   -1   -1    0.7274   -0.0800    0.7293   -0.0807    0.0021    1          0.0920          0.1198
   18   -2    0   -1    1.0597   -0.5111    1.0696   -0.4972    0.0171    1          0.2024          0.2483
   19    0   -4   -1    0.0411    0.0271    0.0442    0.0295    0.0040    1          0.0776          0.0994
   20   -1   -3   -1    0.4416    0.1646    0.4423    0.1634    0.0014    1          0.0945          0.1178
   21    0    4    0   -0.0349   -0.0603   -0.0341   -0.0579    0.0025    1          0.0695          0.0568
   22   -1   -3    0    0.2956    0.3326    0.3053    0.3413    0.0130    1          0.0718          0.0899
   23   -1   -3    1    0.0339    0.2702    0.0347    0.2716    0.0017    1          0.0644          0.0816

###            No.289                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2700    1.7769    1.0834   89.6144  125.1051   90.5266      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2460    1.7947    1.0848   90.0000  124.4648   90.0000      0.3643         1.1487    1.6545    3.4206    4.9270    2.9779
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0761    0.0876    0.0301    0.0000    5.0974    0.0000      0.0393         0.0499    0.1108    0.4237    0.5829    0.3314
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6088   -0.4145    0.6196)
 a2 = (   -0.2851   -0.4838   -0.0378)
 a3 = (    0.9510   -0.5360   -0.2851)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6139   -0.4106    0.6341) (    0.0366    0.0140    0.0438)
 a2 = (   -0.2816   -0.4793   -0.0377) (    0.0134    0.0240    0.0026)
 a3 = (    0.9420   -0.5310   -0.2845) (    0.0470    0.0285    0.0215)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   95.9365  139.0880   64.0581    0.3824    3.4277    0.5528
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0001    0.0166      0.0023    0.0023    0.1142

# Number of computed bands
             95             79
# Figure of merit at the beginning and the end of the refinement
         4.1659         7.0853
# Chi-squares at the beginning and the end of the refinement
    0.4921    0.3050
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2    0   -4   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3    1    3    1   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4    2   -6   -2   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5    0   -2   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6    1    1    1   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7    1   -3   -2    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8    0   -2   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9    1   -1    1   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10    0    0   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11    1   -1   -2    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12    1   -3    1   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13    0    2   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14    1    1   -3    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15    1   -3    0   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16    0    4   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17    2    2   -4    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18    2    0   -3    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19    0    4   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20    1    3   -2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21    0   -4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22    1    3   -1    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23    1    3    0    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7333   -0.0564   -0.7310   -0.0567    0.0023    1          0.0556          0.0702
    2    0   -4   -1   -0.0129   -0.1741   -0.0130   -0.1762    0.0021    1          0.0819          0.0995
    3    1    3    1   -0.0266    0.0895   -0.0262    0.0895    0.0005    1          0.0801          0.0967
    4    1   -3   -1   -0.1944   -0.5868   -0.1957   -0.5833    0.0037    1          0.0861          0.1078
    5    0   -2   -1    0.0569   -0.2234    0.0560   -0.2234    0.0010    1          0.0530          0.0654
    6    1    1    1   -0.1071    0.1195   -0.1085    0.1216    0.0025    1          0.0632          0.0778
    7    1   -3   -2    0.1212   -0.5951    0.1201   -0.5973    0.0025    1          0.1102          0.1302
    8    0   -2   -2    0.1438   -0.2199    0.1454   -0.2240    0.0044    1          0.0852          0.1017
    9    1   -1    1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0641          0.0726
   10    0    0   -1    0.2255   -0.1272    0.2251   -0.1274    0.0005    1          0.0380          0.0467
   11    1   -1   -2    0.5349   -0.6119    0.5303   -0.6130    0.0047    1          0.1044          0.1248
   12    1   -3    1   -0.1816   -0.0377   -0.1829   -0.0381    0.0013    1          0.0822          0.0984
   13    0    2   -2    0.1981   -0.0085    0.1990   -0.0092    0.0010    1          0.0828          0.0927
   14    1    1   -3    0.5298   -0.1495    0.5293   -0.1451    0.0044    1          0.1242          0.1473
   15    1   -3    0   -0.3366   -0.2373   -0.3362   -0.2357    0.0016    1          0.0724          0.0881
   16    0    2   -1    0.1265    0.0357    0.1275    0.0362    0.0011    1          0.0511          0.0679
   17    1    1   -2    0.7298   -0.0811    0.7293   -0.0807    0.0005    1          0.0966          0.1198
   18    2    0   -3    1.0588   -0.5115    1.0696   -0.4972    0.0179    1          0.2145          0.2483
   19    0    4   -1    0.0440    0.0292    0.0442    0.0295    0.0004    1          0.0796          0.0994
   20    1    3   -2    0.4454    0.1654    0.4423    0.1634    0.0036    1          0.0984          0.1178
   21    0   -4    0   -0.0337   -0.0577   -0.0341   -0.0579    0.0005    1          0.0713          0.0568
   22    1    3   -1    0.2987    0.3352    0.3053    0.3413    0.0090    1          0.0746          0.0899
   23    1    3    0    0.0342    0.2727    0.0347    0.2716    0.0011    1          0.0664          0.0816

###            No.290                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    2.7619    0.8724    0.8750   90.0380  108.4408   90.3647      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    2.7860    0.8647    0.8707   90.0000  107.5364   90.0000      0.3194         3.1997    0.9931    8.7217    2.7070    2.7258
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0460    0.0628    0.0625    0.0000    2.9922    0.0000      0.0210         0.1808    0.0138    0.5917    0.2653    0.2654
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0671    0.0715   -0.3689)
 a2 = (    1.0942    0.3079   -0.1475)
 a3 = (    0.2029   -1.0087   -0.6269)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0688    0.0713   -0.3632) (    0.0024    0.0081    0.0017)
 a2 = (    1.1034    0.3135   -0.1476) (    0.0816    0.0217    0.0062)
 a3 = (    0.2063   -1.0152   -0.6145) (    0.0241    0.0760    0.0076)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.5366  103.3085   14.1189    0.4081    1.2254    0.3678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0254      0.0023    0.0023    0.0797

# Number of computed bands
            205            199
# Figure of merit at the beginning and the end of the refinement
         2.6364         6.0388
# Chi-squares at the beginning and the end of the refinement
    0.5830    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -3    1    0   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2    3    1   -3   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3   -4    0    2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4   -1    1   -2   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5    2    0   -2    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6   -5    1    2   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7    0    0   -2    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8    3   -1   -3    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9   -4    2    1   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11   -1   -1   -2    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12   -2    2    0   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13    1   -3   -1    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14   -1   -3   -2    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15   -2    2   -1   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16    0   -2    0    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17   -2   -2   -1    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18   -4   -2   -2    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19   -1   -3    1    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20   -2   -2    0    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21    1    1   -1   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22   -4   -2    1    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23   -5   -1    2    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -3    1    0   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2    3    1   -3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3   -6    0    3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4   -1    1   -2   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5    2    0   -2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6   -5    1    2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7    0    0   -3    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8    3   -1   -3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9   -4    2    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10    1   -1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -1   -1   -2    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12   -3    3    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13    1   -3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14   -1   -3   -2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15   -2    2   -1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17   -2   -2   -1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18   -4   -2   -2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19   -1   -3    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -3   -3    0    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21    1    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22   -4   -2    1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -5   -1    2    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.291                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2354    2.6152    0.8745   90.2674  134.9314   90.2045      0.9229
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2329    2.6432    0.8695   90.0000  135.1032   90.0000      0.3190         1.4178    3.0397    3.8647    8.2857    2.7258
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0390    0.2536    0.0299    0.0000    1.8040    0.0000      0.0482         0.0345    0.2888    0.5970    1.4838    0.4227
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.0902   -0.3107    0.1493)
 a2 = (    0.0667   -0.0699    0.3700)
 a3 = (   -1.3603    0.7701    0.4076)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.0974   -0.3071    0.1487) (    0.0096    0.0364    0.0140)
 a2 = (    0.0689   -0.0693    0.3655) (    0.0109    0.0124    0.0334)
 a3 = (   -1.3718    0.7796    0.4063) (    0.0250    0.0517    0.0323)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.6276   77.0877 -166.0816    0.7333    1.0751    1.9585
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004   -0.0004   -0.0116      0.0036    0.0095    0.0951

# Number of computed bands
            146            222
# Figure of merit at the beginning and the end of the refinement
         0.9444         5.7968
# Chi-squares at the beginning and the end of the refinement
   19.8563    0.0250
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    3    0   -0.7400   -0.0580   -0.7310   -0.0567    0.0091    1    0.1990    0.0702
    2   -2    0    1   -0.0343   -0.0581   -0.0130   -0.1762    0.1200    1    0.1292    0.0995
    3    1    1   -1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0964    0.0967
    4   -3    3    2   -0.1950   -0.5882   -0.1957   -0.5833    0.0049    1    0.3111    0.1078
    5   -2    0    2    0.0562   -0.2249    0.0560   -0.2234    0.0016    1    0.1919    0.0654
    6    0    2   -1   -0.1623    0.0989   -0.1085    0.1216    0.0585    1    0.1466    0.0778
    7   -1    1    1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1315    0.1302
    8   -2    0    2    0.0562   -0.2249    0.1454   -0.2240    0.0892    1    0.1919    0.1017
    9   -1    1    0   -0.1829   -0.0381   -0.1952    0.0486    0.0875    1    0.0987    0.0726
   10    0    0    1    0.2269   -0.1285    0.2251   -0.1274    0.0021    1    0.1371    0.0467
   11   -1    3    2    0.5359   -0.6150    0.5303   -0.6130    0.0059    1    0.3763    0.1248
   12   -1    1    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0987    0.0984
   13    2    0    0    0.1267    0.0361    0.1990   -0.0092    0.0853    1    0.1852    0.0927
   14    1    1    1    0.3787   -0.0619    0.5293   -0.1451    0.1721    0    0.2369    0.1473
   15   -3    3    1   -0.3379   -0.2389   -0.3362   -0.2357    0.0036    1    0.2619    0.0881
   16    2    0    0    0.1267    0.0361    0.1275    0.0362    0.0008    1    0.1852    0.0679
   17    1    3    1    0.7317   -0.0812    0.7293   -0.0807    0.0024    1    0.3481    0.1198
   18    0    2    1    0.7400   -0.3802    1.0696   -0.4972    0.3497    0    0.2421    0.2483
   19    1    1   -1   -0.0262    0.0895    0.0442    0.0295    0.0924    1    0.0964    0.0994
   20    1    1    0    0.4457    0.1657    0.4423    0.1634    0.0041    1    0.1177    0.1178
   21   -2    0    1   -0.0343   -0.0581   -0.0341   -0.0579    0.0002    1    0.1292    0.0568
   22    2    2   -1    0.1539    0.3431    0.3053    0.3413    0.1514    1    0.1627    0.0899
   23    3    3   -2    0.0355    0.2723    0.0347    0.2716    0.0011    1    0.2408    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    3    0   -0.7306   -0.0552   -0.7310   -0.0567    0.0015    1          0.0667          0.0702
    2   -4    0    3   -0.0131   -0.1756   -0.0130   -0.1762    0.0006    1          0.1015          0.0995
    3    2    4   -3   -0.0783    0.1162   -0.0262    0.0895    0.0586    1          0.1090          0.0967
    4   -3    3    2   -0.1945   -0.5861   -0.1957   -0.5833    0.0030    1          0.1045          0.1078
    5   -2    0    2    0.0573   -0.2250    0.0560   -0.2234    0.0022    1          0.0656          0.0654
    6    1    3   -2   -0.1044    0.1178   -0.1085    0.1216    0.0056    1          0.0781          0.0778
    7   -3    3    3    0.1207   -0.5949    0.1201   -0.5973    0.0025    1          0.1341          0.1302
    8   -2    0    3    0.1447   -0.2214    0.1454   -0.2240    0.0026    1          0.1055          0.1017
    9   -1    3   -1   -0.1919    0.0493   -0.1952    0.0486    0.0034    1          0.0792          0.0726
   10    0    0    1    0.2269   -0.1283    0.2251   -0.1274    0.0020    1          0.0471          0.0467
   11   -1    3    2    0.5320   -0.6120    0.5303   -0.6130    0.0019    1          0.1254          0.1248
   12   -3    3    0   -0.1802   -0.0364   -0.1829   -0.0381    0.0032    1          0.1017          0.0984
   13    2    0    1    0.1996   -0.0088    0.1990   -0.0092    0.0007    1          0.1025          0.0927
   14    1    3    2    0.5295   -0.1516    0.5293   -0.1451    0.0065    1          0.1515          0.1473
   15   -3    3    1   -0.3363   -0.2359   -0.3362   -0.2357    0.0002    1          0.0886          0.0881
   16    2    0    0    0.1275    0.0360    0.1275    0.0362    0.0002    1          0.0633          0.0679
   17    1    3    1    0.7289   -0.0848    0.7293   -0.0807    0.0041    1          0.1164          0.1198
   18    0    6    2    1.0520   -0.5157    1.0696   -0.4972    0.0256    1          0.2531          0.2483
   19    4    0   -1    0.0442    0.0296    0.0442    0.0295    0.0000    1          0.0987          0.0994
   20    3    3    0    0.4465    0.1636    0.4423    0.1634    0.0041    1          0.1202          0.1178
   21   -2    0    1   -0.0342   -0.0582   -0.0341   -0.0579    0.0003    1          0.0441          0.0568
   22    3    3   -1    0.2998    0.3339    0.3053    0.3413    0.0093    1          0.0910          0.0899
   23    3    3   -2    0.0348    0.2707    0.0347    0.2716    0.0009    1          0.0816          0.0816

###            No.292                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2332    2.6216    0.8717   91.4692  134.7686   88.7244      0.4426
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2336    2.6211    0.8702   90.0000  134.6975   90.0000      0.3115         1.4175    3.0120    3.9599    8.4142    2.7935
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0127    0.0993    0.0122    0.0000    0.5976    0.0000      0.0235         0.0130    0.1209    0.3012    0.7097    0.2141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2757   -1.0779   -0.2581)
 a2 = (    0.0605   -0.0708    0.3701)
 a3 = (   -0.8188   -1.3891   -0.1084)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2740   -1.0772   -0.2554) (    0.0102    0.0032    0.0074)
 a2 = (    0.0698   -0.0696    0.3686) (    0.0046    0.0043    0.0134)
 a3 = (   -0.8224   -1.3878   -0.1065) (    0.0188    0.0103    0.0078)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -13.0522   82.5914  -74.0180    0.3878    0.3094    0.5483
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            225            285
# Figure of merit at the beginning and the end of the refinement
         2.3526         5.7135
# Chi-squares at the beginning and the end of the refinement
    1.2562    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    3   -1   -0.7483   -0.0580   -0.7310   -0.0567    0.0173    1    0.0952    0.0702
    2   -2    0   -1   -0.0132   -0.1752   -0.0130   -0.1762    0.0010    1    0.1418    0.0995
    3    2    2    0   -0.0263    0.0897   -0.0262    0.0895    0.0003    1    0.0923    0.0967
    4   -1    3   -1   -0.1908   -0.5936   -0.1957   -0.5833    0.0114    1    0.1477    0.1078
    5   -2    0    0    0.0575   -0.2248    0.0560   -0.2234    0.0021    1    0.0916    0.0654
    6    3    3   -1   -0.1072    0.1207   -0.1085    0.1216    0.0015    1    0.1089    0.0778
    7   -2    2    0    0.1274   -0.5965    0.1201   -0.5973    0.0073    1    0.1261    0.1302
    8   -4    0    1    0.1452   -0.2208    0.1454   -0.2240    0.0032    1    0.1475    0.1017
    9    3    3   -2   -0.1963    0.0496   -0.1952    0.0486    0.0015    1    0.1103    0.0726
   10   -2    0    1    0.2267   -0.1269    0.2251   -0.1274    0.0017    1    0.0659    0.0467
   11   -3    3    1    0.5409   -0.6029    0.5303   -0.6130    0.0146    1    0.1782    0.1248
   12    2    2   -2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0945    0.0984
   13   -4    0    3    0.1984   -0.0080    0.1990   -0.0092    0.0012    1    0.1439    0.0927
   14   -5    3    3    0.5278   -0.1459    0.5293   -0.1451    0.0017    1    0.2147    0.1473
   15    1    3   -2   -0.3391   -0.2409   -0.3362   -0.2357    0.0060    1    0.1243    0.0881
   16   -2    0    2    0.1266    0.0360    0.1275    0.0362    0.0009    1    0.0888    0.0679
   17   -3    3    2    0.7223   -0.0770    0.7293   -0.0807    0.0080    1    0.1653    0.1198
   18   -4    6    2    1.0489   -0.4893    1.0696   -0.4972    0.0221    1    0.3607    0.2483
   19   -2    0    3    0.0439    0.0294    0.0442    0.0295    0.0003    1    0.1384    0.0994
   20   -2    2    2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1134    0.1178
   21    0    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0617    0.0568
   22   -1    3    2    0.2996    0.3308    0.3053    0.3413    0.0120    1    0.1291    0.0899
   23    1    3    1    0.0368    0.2726    0.0347    0.2716    0.0023    1    0.1148    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    3   -1   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -2    0   -1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    3    3    1   -0.0018    0.0480   -0.0262    0.0895    0.0481    1          0.1296          0.0967
    4   -1    3   -1   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    0    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    3    3   -1   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3    3    0    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -4    0    1    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    3    3   -2   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -2    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -3    3    1    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    3    3   -4   -0.1432   -0.0704   -0.1829   -0.0381    0.0511    1          0.1335          0.0984
   13   -4    0    3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -5    3    3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    1    3   -2   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -2    0    2    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -3    3    2    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -4    6    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -2    0    3    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -3    3    3    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    0    0   -1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -1    3    2    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    1    3    1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.295                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2336    2.6150    0.8734   91.0962  134.7659   89.4261      0.7057
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2372    2.6211    0.8768   90.0000  135.3012   90.0000      0.3115         1.4109    2.9892    3.9716    8.4142    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0129    0.1052    0.0123    0.0000    0.5914    0.0000      0.0240         0.0128    0.1133    0.3082    0.7298    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.0887   -0.3126    0.1432)
 a2 = (    0.0656   -0.0653    0.3711)
 a3 = (   -1.3588    0.7693    0.4039)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.0963   -0.3106    0.1489) (    0.0027    0.0092    0.0064)
 a2 = (    0.0698   -0.0696    0.3686) (    0.0048    0.0045    0.0142)
 a3 = (   -1.3703    0.7666    0.4043) (    0.0111    0.0157    0.0128)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    7.6411   77.0810 -165.9016    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            175            285
# Figure of merit at the beginning and the end of the refinement
         1.1647         5.7135
# Chi-squares at the beginning and the end of the refinement
   18.2014    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    3    0   -0.7485   -0.0679   -0.7310   -0.0567    0.0208    1    0.1535    0.0702
    2   -2    0    2    0.0566   -0.2268   -0.0130   -0.1762    0.0861    1    0.1468    0.0995
    3    1    1   -1   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0734    0.0967
    4   -3    3    2   -0.1931   -0.5909   -0.1957   -0.5833    0.0080    1    0.2389    0.1078
    5   -2    0    2    0.0566   -0.2268    0.0560   -0.2234    0.0035    1    0.1468    0.0654
    6    0    2   -1   -0.1664    0.1005   -0.1085    0.1216    0.0616    1    0.1117    0.0778
    7   -1    1    1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1010    0.1302
    8   -2    0    2    0.0566   -0.2268    0.1454   -0.2240    0.0888    1    0.1468    0.1017
    9    0    2   -1   -0.1664    0.1005   -0.1952    0.0486    0.0593    1    0.1117    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.1044    0.0467
   11   -1    3    2    0.5315   -0.6143    0.5303   -0.6130    0.0017    1    0.2861    0.1248
   12   -1    1    0   -0.1888   -0.0404   -0.1829   -0.0381    0.0064    1    0.0756    0.0984
   13    2    0    0    0.1215    0.0349    0.1990   -0.0092    0.0891    1    0.1410    0.0927
   14    0    2    2    0.4623   -0.2517    0.5293   -0.1451    0.1259    1    0.2596    0.1473
   15   -3    3    1   -0.3410   -0.2449   -0.3362   -0.2357    0.0103    1    0.2013    0.0881
   16    2    0    0    0.1215    0.0349    0.1275    0.0362    0.0061    1    0.1410    0.0679
   17    1    3    1    0.7280   -0.0843    0.7293   -0.0807    0.0039    1    0.2637    0.1198
   18    0    6    2    1.0501   -0.5181    1.0696   -0.4972    0.0287    1    0.5897    0.2483
   19    1   -1    1    0.0671   -0.0139    0.0442    0.0295    0.0492    1    0.1572    0.0994
   20    1    1    0    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0894    0.1178
   21   -2    0    1   -0.0368   -0.0626   -0.0341   -0.0579    0.0054    1    0.0989    0.0568
   22    3    3   -1    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.2044    0.0899
   23    3    3   -2    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1827    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    3    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -4    0    3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    5    3   -4   -0.0018    0.0480   -0.0262    0.0895    0.0481    1          0.1296          0.0967
    4   -3    3    2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    1    3   -2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3    3    3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -2    0    3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -1    3   -1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    0    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1    3    2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12   -5    3    1   -0.1432   -0.0704   -0.1829   -0.0381    0.0511    1          0.1335          0.0984
   13    2    0    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    1    3    2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -3    3    1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    2    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    1    3    1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    0    6    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    4    0   -1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    3    3    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21   -2    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    3    3   -1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    3    3   -2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.296                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2312    2.6299    0.8700   89.7774  134.7477   91.2010      0.6137
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2335    2.6211    0.8768   90.0000  135.1340   90.0000      0.3115         1.4068    2.9892    3.9599    8.4142    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0113    0.1052    0.0123    0.0000    0.5206    0.0000      0.0240         0.0146    0.1133    0.3066    0.7298    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.0910    0.3102   -0.1493)
 a2 = (   -0.0603    0.0705   -0.3689)
 a3 = (    0.8131    1.3954    0.1084)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.0963    0.3106   -0.1489) (    0.0027    0.0092    0.0064)
 a2 = (   -0.0698    0.0696   -0.3686) (    0.0048    0.0045    0.0142)
 a3 = (    0.8224    1.3878    0.1065) (    0.0112    0.0196    0.0085)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -172.3589   77.0810 -165.9016    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            179            287
# Figure of merit at the beginning and the end of the refinement
         1.3944         5.7002
# Chi-squares at the beginning and the end of the refinement
   17.1150    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -3    0   -0.7483   -0.0580   -0.7310   -0.0567    0.0173    1    0.1317    0.0702
    2   -2    0    2    0.0571   -0.2228   -0.0130   -0.1762    0.0842    1    0.1278    0.0995
    3    2   -2   -2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.1288    0.0967
    4   -1   -3    2   -0.1863   -0.5903   -0.1957   -0.5833    0.0117    1    0.2050    0.1078
    5   -2    0    2    0.0571   -0.2228    0.0560   -0.2234    0.0012    1    0.1278    0.0654
    6    2   -2   -1   -0.1612    0.0991   -0.1085    0.1216    0.0573    1    0.0973    0.0778
    7   -1   -1    1    0.1266   -0.5903    0.1201   -0.5973    0.0095    1    0.0873    0.1302
    8   -2    0    2    0.0571   -0.2228    0.1454   -0.2240    0.0884    1    0.1278    0.1017
    9    2   -2   -1   -0.1612    0.0991   -0.1952    0.0486    0.0609    1    0.0973    0.0726
   10   -2    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0915    0.0467
   11   -3   -3    2    0.5335   -0.6000    0.5303   -0.6130    0.0134    1    0.2468    0.1248
   12    2   -2    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1308    0.0984
   13   -2    0    0    0.1266    0.0360    0.1990   -0.0092    0.0853    1    0.1229    0.0927
   14   -4   -2    2    0.4596   -0.2474    0.5293   -0.1451    0.1238    1    0.2262    0.1473
   15    1   -3    1   -0.3378   -0.2420   -0.3362   -0.2357    0.0065    1    0.1723    0.0881
   16   -2    0    0    0.1266    0.0360    0.1275    0.0362    0.0009    1    0.1229    0.0679
   17   -3   -3    1    0.7207   -0.0801    0.7293   -0.0807    0.0087    1    0.2291    0.1198
   18   -4   -6    2    1.0401   -0.4932    1.0696   -0.4972    0.0297    1    0.5017    0.2483
   19   -3    1    1    0.0711   -0.0151    0.0442    0.0295    0.0521    1    0.1372    0.0994
   20   -2   -2    0    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1570    0.1178
   21    0    0    1   -0.0338   -0.0580   -0.0341   -0.0579    0.0004    1    0.0858    0.0568
   22   -1   -3   -1    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1789    0.0899
   23    1   -3   -2    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1599    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -3    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -2    0    3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    3   -3   -4   -0.0018    0.0480   -0.0262    0.0895    0.0481    1          0.1296          0.0967
    4   -1   -3    2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    3   -3   -2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3   -3    3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -4    0    3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    3   -3   -1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -2    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -3   -3    2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    3   -3    1   -0.1432   -0.0704   -0.1829   -0.0381    0.0511    1          0.1335          0.0984
   13   -4    0    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -5   -3    2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    1   -3    1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -2    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -3   -3    1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -4   -6    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -2    0   -1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -3   -3    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    0    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -1   -3   -1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    1   -3   -2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.297                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2354    1.2382    1.4441   90.5229  115.1188   90.0089      0.9229
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2340    1.2286    1.4599   90.0000  115.3691   90.0000      0.3187         0.8453    0.8416    3.8726    3.8555    4.5814
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0423    0.0422    0.0955    0.0000    4.1415    0.0000      0.0437         0.0651    0.0623    0.5474    0.5451    0.6962
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4768    0.6259    0.4245)
 a2 = (   -0.6801    0.3850    0.2038)
 a3 = (    0.1334   -0.1397    0.7400)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4818    0.6282    0.4213) (    0.0086    0.0225    0.0301)
 a2 = (   -0.6853    0.3892    0.2034) (    0.0213    0.0215    0.0125)
 a3 = (    0.1406   -0.1354    0.7325) (    0.0298    0.0384    0.0539)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   61.9833   32.1468   -5.3420    0.9245    2.4331    1.4265
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005   -0.0007   -0.0094      0.0058    0.0074    0.0952

# Number of computed bands
            152            235
# Figure of merit at the beginning and the end of the refinement
         0.9318         5.6665
# Chi-squares at the beginning and the end of the refinement
   19.9419    0.0218
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7400   -0.0580   -0.7310   -0.0567    0.0091    1    0.1990    0.0702
    2    2    0   -1   -0.0343   -0.0581   -0.0130   -0.1762    0.1200    1    0.1292    0.0995
    3   -1   -1    1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0964    0.0967
    4    3    1    0   -0.1950   -0.5882   -0.1957   -0.5833    0.0049    1    0.3111    0.1078
    5    2    2   -1    0.0562   -0.2249    0.0560   -0.2234    0.0016    1    0.1919    0.0654
    6    0   -2    1   -0.1623    0.0989   -0.1085    0.1216    0.0585    1    0.1466    0.0778
    7    1    1    0    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1315    0.1302
    8    2    2   -1    0.0562   -0.2249    0.1454   -0.2240    0.0892    1    0.1919    0.1017
    9    1   -1    0   -0.1829   -0.0381   -0.1952    0.0486    0.0875    1    0.0987    0.0726
   10    0    2    0    0.2269   -0.1285    0.2251   -0.1274    0.0021    1    0.1371    0.0467
   11    1    3    1    0.5359   -0.6150    0.5303   -0.6130    0.0059    1    0.3763    0.1248
   12    1   -1    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0987    0.0984
   13   -2    2    1    0.1267    0.0361    0.1990   -0.0092    0.0853    1    0.1852    0.0927
   14   -1    3    1    0.3787   -0.0619    0.5293   -0.1451    0.1721    0    0.2369    0.1473
   15    3   -1    0   -0.3379   -0.2389   -0.3362   -0.2357    0.0036    1    0.2619    0.0881
   16   -2    2    1    0.1267    0.0361    0.1275    0.0362    0.0008    1    0.1852    0.0679
   17   -1    3    2    0.7317   -0.0812    0.7293   -0.0807    0.0024    1    0.3481    0.1198
   18    0    2    1    0.7400   -0.3802    1.0696   -0.4972    0.3497    0    0.2421    0.2483
   19   -1   -1    1   -0.0262    0.0895    0.0442    0.0295    0.0924    1    0.0964    0.0994
   20   -1    1    1    0.4457    0.1657    0.4423    0.1634    0.0041    1    0.1177    0.1178
   21    2    0   -1   -0.0343   -0.0581   -0.0341   -0.0579    0.0002    1    0.1292    0.0568
   22   -2    0    2    0.1539    0.3431    0.3053    0.3413    0.1514    1    0.1627    0.0899
   23   -3   -1    3    0.0355    0.2723    0.0347    0.2716    0.0011    1    0.2408    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7285   -0.0571   -0.7310   -0.0567    0.0026    1          0.0670          0.0702
    2    4    2   -2   -0.0132   -0.1759   -0.0130   -0.1762    0.0003    1          0.1015          0.0995
    3   -2   -4    3   -0.0786    0.1164   -0.0262    0.0895    0.0589    1          0.1089          0.0967
    4    3    1    0   -0.1954   -0.5852   -0.1957   -0.5833    0.0019    1          0.1049          0.1078
    5    2    2   -1    0.0575   -0.2254    0.0560   -0.2234    0.0025    1          0.0656          0.0654
    6   -1   -3    2   -0.1048    0.1179   -0.1085    0.1216    0.0052    1          0.0781          0.0778
    7    3    3    0    0.1197   -0.5953    0.1201   -0.5973    0.0021    1          0.1345          0.1302
    8    2    4   -1    0.1450   -0.2215    0.1454   -0.2240    0.0025    1          0.1055          0.1017
    9    1   -3    1   -0.1921    0.0492   -0.1952    0.0486    0.0032    1          0.0793          0.0726
   10    0    2    0    0.2271   -0.1280    0.2251   -0.1274    0.0021    1          0.0471          0.0467
   11    1    3    1    0.5310   -0.6138    0.5303   -0.6130    0.0010    1          0.1259          0.1248
   12    3   -3    0   -0.1803   -0.0364   -0.1829   -0.0381    0.0031    1          0.1019          0.0984
   13   -2    4    1    0.1994   -0.0085    0.1990   -0.0092    0.0007    1          0.1026          0.0927
   14   -1    5    2    0.5299   -0.1522    0.5293   -0.1451    0.0071    1          0.1518          0.1473
   15    3   -1    0   -0.3361   -0.2355   -0.3362   -0.2357    0.0003    1          0.0889          0.0881
   16   -2    2    1    0.1272    0.0361    0.1275    0.0362    0.0003    1          0.0634          0.0679
   17   -1    3    2    0.7301   -0.0862    0.7293   -0.0807    0.0055    1          0.1168          0.1198
   18    0    4    3    1.0522   -0.5211    1.0696   -0.4972    0.0296    1          0.2547          0.2483
   19   -4    2    2    0.0439    0.0295    0.0442    0.0295    0.0003    1          0.0987          0.0994
   20   -3    3    3    0.4472    0.1636    0.4423    0.1634    0.0048    1          0.1202          0.1178
   21    2    0   -1   -0.0345   -0.0585   -0.0341   -0.0579    0.0006    1          0.0442          0.0568
   22   -3    1    3    0.3006    0.3346    0.3053    0.3413    0.0082    1          0.0910          0.0899
   23   -3   -1    3    0.0347    0.2714    0.0347    0.2716    0.0002    1          0.0815          0.0816

###            No.298                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2352    1.2360    1.4458   90.3427  115.0273   89.8349      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2462    1.2499    1.4171   90.0000  115.0338   90.0000      0.3178         0.8794    0.8820    3.9215    3.9332    4.4594
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0110    0.0185    0.1532    0.0000    1.0865    0.0000      0.0442         0.0918    0.0958    0.5465    0.5501    0.7856
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7492    0.4577   -0.1661)
 a2 = (    0.4121    0.6940    0.0553)
 a3 = (   -0.1342    0.1431   -0.7377)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7433    0.4506   -0.1698) (    0.0059    0.0048    0.0194)
 a2 = (    0.4046    0.6881    0.0547) (    0.0080    0.0101    0.0048)
 a3 = (   -0.1357    0.1397   -0.7541) (    0.0123    0.0091    0.0840)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -70.3832  168.2581   78.7824    1.6175    1.2853    1.6943
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003    0.0315      0.0023    0.0023    0.1096

# Number of computed bands
            237            302
# Figure of merit at the beginning and the end of the refinement
         2.5120         5.5139
# Chi-squares at the beginning and the end of the refinement
    0.5316    0.1263
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2    2    4   -1   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3   -2   -2    0   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4    1    3   -2   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5    2    2   -1    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6   -3   -1    0   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7    2    2   -2    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8    4    2   -2    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9   -3    1    0   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10    2    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11    3    1   -3    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12   -2    2    0   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13    4   -2   -2    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14    5   -1   -4    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15   -1    3   -1   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16    2   -2   -1    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17    3   -1   -3    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18    4    0   -5    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19    2   -4   -1    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20    2   -2   -2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21    0    2    0   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22    1   -3   -2    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23   -1   -3   -1    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1   -1   -0.7339   -0.0562   -0.7310   -0.0567    0.0029    1          0.0719          0.0702
    2    2    4   -1   -0.0131   -0.1738   -0.0130   -0.1762    0.0024    1          0.1042          0.0995
    3   -3   -5    0   -0.0019    0.0473   -0.0262    0.0895    0.0486    1          0.1358          0.0967
    4    1    3   -2   -0.1944   -0.5866   -0.1957   -0.5833    0.0035    1          0.1108          0.1078
    5    2    2   -1    0.0567   -0.2233    0.0560   -0.2234    0.0007    1          0.0674          0.0654
    6   -3   -1    0   -0.1071    0.1196   -0.1085    0.1216    0.0024    1          0.0803          0.0778
    7    3    3   -3    0.1211   -0.5952    0.1201   -0.5973    0.0023    1          0.1418          0.1302
    8    4    2   -2    0.1437   -0.2201    0.1454   -0.2240    0.0043    1          0.1086          0.1017
    9   -3    1    0   -0.1948    0.0488   -0.1952    0.0486    0.0005    1          0.0815          0.0726
   10    2    0   -1    0.2257   -0.1274    0.2251   -0.1274    0.0006    1          0.0484          0.0467
   11    3    1   -3    0.5355   -0.6120    0.5303   -0.6130    0.0053    1          0.1352          0.1248
   12   -3    5    0   -0.1434   -0.0708   -0.1829   -0.0381    0.0512    1          0.1392          0.0984
   13    4   -2   -2    0.1983   -0.0086    0.1990   -0.0092    0.0009    1          0.1054          0.0927
   14    5   -1   -4    0.5301   -0.1492    0.5293   -0.1451    0.0042    1          0.1597          0.1473
   15   -1    3   -1   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0925          0.0881
   16    2   -2   -1    0.1267    0.0357    0.1275    0.0362    0.0009    1          0.0650          0.0679
   17    3   -1   -3    0.7298   -0.0804    0.7293   -0.0807    0.0006    1          0.1248          0.1198
   18    4    0   -5    1.0597   -0.5099    1.0696   -0.4972    0.0161    1          0.2806          0.2483
   19    2   -4   -1    0.0442    0.0293    0.0442    0.0295    0.0003    1          0.1012          0.0994
   20    3   -3   -3    0.4451    0.1656    0.4423    0.1634    0.0035    1          0.1263          0.1178
   21    0    2    0   -0.0335   -0.0575   -0.0341   -0.0579    0.0008    1          0.0453          0.0568
   22    1   -3   -2    0.2985    0.3348    0.3053    0.3413    0.0094    1          0.0956          0.0899
   23   -1   -3   -1    0.0345    0.2726    0.0347    0.2716    0.0010    1          0.0847          0.0816

###            No.301                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2336    1.2402    1.4401   90.9529  114.7856   89.8379      0.7057
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2257    1.2276    1.4621   90.0000  114.6197   90.0000      0.3215         0.8383    0.8396    3.8127    3.8185    4.5480
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0339    0.0815    0.2117    0.0000    3.4593    0.0000      0.0628         0.1197    0.0953    0.7527    0.7882    1.1062
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3437    0.7626   -0.3124)
 a2 = (    0.6794   -0.3846   -0.2020)
 a3 = (   -0.1312    0.1306   -0.7422)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3458    0.7682   -0.3094) (    0.0387    0.0089    0.0451)
 a2 = (    0.6859   -0.3902   -0.2023) (    0.0470    0.0298    0.0229)
 a3 = (   -0.1375    0.1352   -0.7272) (    0.0568    0.0425    0.1033)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -125.7659  154.8597  -62.7406    2.7876    3.1975    3.8740
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001   -0.0004   -0.0215      0.0079    0.0068    0.1303

# Number of computed bands
            181            227
# Figure of merit at the beginning and the end of the refinement
         1.1517         5.4754
# Chi-squares at the beginning and the end of the refinement
   18.3636    0.0367
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -2   -0.7485   -0.0679   -0.7310   -0.0567    0.0208    1    0.1535    0.0702
    2    2   -2   -1    0.0566   -0.2268   -0.0130   -0.1762    0.0861    1    0.1468    0.0995
    3   -1    1    0   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0734    0.0967
    4    3   -1   -3   -0.1931   -0.5909   -0.1957   -0.5833    0.0080    1    0.2389    0.1078
    5    2   -2   -1    0.0566   -0.2268    0.0560   -0.2234    0.0035    1    0.1468    0.0654
    6    0    2   -1   -0.1664    0.1005   -0.1085    0.1216    0.0616    1    0.1117    0.0778
    7    1   -1   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1010    0.1302
    8    2   -2   -1    0.0566   -0.2268    0.1454   -0.2240    0.0888    1    0.1468    0.1017
    9    0    2   -1   -0.1664    0.1005   -0.1952    0.0486    0.0593    1    0.1117    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.1044    0.0467
   11    1   -3   -2    0.5315   -0.6143    0.5303   -0.6130    0.0017    1    0.2861    0.1248
   12    1    1   -1   -0.1888   -0.0404   -0.1829   -0.0381    0.0064    1    0.0756    0.0984
   13   -2   -2    1    0.1215    0.0349    0.1990   -0.0092    0.0891    1    0.1410    0.0927
   14    0   -4   -1    0.4623   -0.2517    0.5293   -0.1451    0.1259    1    0.2596    0.1473
   15    3    1   -3   -0.3410   -0.2449   -0.3362   -0.2357    0.0103    1    0.2013    0.0881
   16   -2   -2    1    0.1215    0.0349    0.1275    0.0362    0.0061    1    0.1410    0.0679
   17   -1   -3   -1    0.7280   -0.0843    0.7293   -0.0807    0.0039    1    0.2637    0.1198
   18    0   -4   -3    1.0501   -0.5181    1.0696   -0.4972    0.0287    1    0.5897    0.2483
   19   -1   -3    1    0.0671   -0.0139    0.0442    0.0295    0.0492    1    0.1572    0.0994
   20   -1   -1    0    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0894    0.1178
   21    2    0   -1   -0.0368   -0.0626   -0.0341   -0.0579    0.0054    1    0.0989    0.0568
   22   -3   -1    0    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.2044    0.0899
   23   -3    1    0    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1827    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -2   -0.7319   -0.0599   -0.7310   -0.0567    0.0034    1          0.0662          0.0702
    2    4   -2   -2   -0.0140   -0.1757   -0.0130   -0.1762    0.0010    1          0.1016          0.0995
    3   -2    4   -1   -0.0787    0.1166   -0.0262    0.0895    0.0591    1          0.1086          0.0967
    4    3   -1   -3   -0.1950   -0.5842   -0.1957   -0.5833    0.0011    1          0.1040          0.1078
    5    2   -2   -1    0.0564   -0.2259    0.0560   -0.2234    0.0025    1          0.0656          0.0654
    6   -1    3   -1   -0.1050    0.1183   -0.1085    0.1216    0.0048    1          0.0778          0.0778
    7    3   -3   -3    0.1181   -0.5954    0.1201   -0.5973    0.0028    1          0.1334          0.1302
    8    2   -4   -1    0.1444   -0.2228    0.1454   -0.2240    0.0015    1          0.1053          0.1017
    9    1    3   -2   -0.1930    0.0488   -0.1952    0.0486    0.0022    1          0.0790          0.0726
   10    0   -2    0    0.2277   -0.1291    0.2251   -0.1274    0.0031    1          0.0469          0.0467
   11    1   -3   -2    0.5305   -0.6155    0.5303   -0.6130    0.0025    1          0.1244          0.1248
   12    3    3   -3   -0.1804   -0.0371   -0.1829   -0.0381    0.0026    1          0.1017          0.0984
   13   -2   -4    1    0.2000   -0.0086    0.1990   -0.0092    0.0012    1          0.1024          0.0927
   14   -1   -5   -1    0.5312   -0.1526    0.5293   -0.1451    0.0077    1          0.1507          0.1473
   15    3    1   -3   -0.3353   -0.2366   -0.3362   -0.2357    0.0013    1          0.0885          0.0881
   16   -2   -2    1    0.1274    0.0363    0.1275    0.0362    0.0001    1          0.0634          0.0679
   17   -1   -3   -1    0.7308   -0.0858    0.7293   -0.0807    0.0053    1          0.1156          0.1198
   18    0   -4   -3    1.0523   -0.5211    1.0696   -0.4972    0.0295    1          0.2500          0.2483
   19   -4   -2    2    0.0439    0.0296    0.0442    0.0295    0.0003    1          0.0989          0.0994
   20   -3   -3    0    0.4467    0.1640    0.4423    0.1634    0.0044    1          0.1198          0.1178
   21    2    0   -1   -0.0346   -0.0582   -0.0341   -0.0579    0.0005    1          0.0443          0.0568
   22   -3   -1    0    0.3000    0.3335    0.3053    0.3413    0.0094    1          0.0907          0.0899
   23   -3    1    0    0.0354    0.2709    0.0347    0.2716    0.0010    1          0.0815          0.0816

###            No.302                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2358    1.2312    1.4442   90.9693  114.4442   90.2902      0.6137
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2257    1.2276    1.4653   90.0000  114.8859   90.0000      0.3215         0.8365    0.8378    3.8127    3.8185    4.5578
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0650    0.0517    0.1135    0.0000    6.5487    0.0000      0.0543         0.0872    0.0751    0.6751    0.6648    0.8471
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4668    0.6271    0.4231)
 a2 = (   -0.6844    0.3875    0.2034)
 a3 = (    0.1206   -0.1411    0.7378)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4833    0.6330    0.4178) (    0.0124    0.0256    0.0419)
 a2 = (   -0.6859    0.3902    0.2023) (    0.0267    0.0303    0.0157)
 a3 = (    0.1375   -0.1352    0.7272) (    0.0486    0.0504    0.0735)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   61.8771   31.7881   -5.2009    1.1699    3.3730    1.7658
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001   -0.0004   -0.0215      0.0079    0.0068    0.1303

# Number of computed bands
            185            227
# Figure of merit at the beginning and the end of the refinement
         1.3792         5.4753
# Chi-squares at the beginning and the end of the refinement
   17.3839    0.0367
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7483   -0.0580   -0.7310   -0.0567    0.0173    1    0.1317    0.0702
    2    2    2   -1    0.0571   -0.2228   -0.0130   -0.1762    0.0842    1    0.1278    0.0995
    3   -2   -2    2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.1288    0.0967
    4    3    1    0   -0.1863   -0.5903   -0.1957   -0.5833    0.0117    1    0.2050    0.1078
    5    2    2   -1    0.0571   -0.2228    0.0560   -0.2234    0.0012    1    0.1278    0.0654
    6    0   -2    1   -0.1612    0.0991   -0.1085    0.1216    0.0573    1    0.0973    0.0778
    7    1    1    0    0.1266   -0.5903    0.1201   -0.5973    0.0095    1    0.0873    0.1302
    8    2    2   -1    0.0571   -0.2228    0.1454   -0.2240    0.0884    1    0.1278    0.1017
    9    0   -2    1   -0.1612    0.0991   -0.1952    0.0486    0.0609    1    0.0973    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0915    0.0467
   11    1    3    1    0.5335   -0.6000    0.5303   -0.6130    0.0134    1    0.2468    0.1248
   12    2   -2    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1308    0.0984
   13   -2    2    1    0.1266    0.0360    0.1990   -0.0092    0.0853    1    0.1229    0.0927
   14    0    4    1    0.4596   -0.2474    0.5293   -0.1451    0.1238    1    0.2262    0.1473
   15    3   -1    0   -0.3378   -0.2420   -0.3362   -0.2357    0.0065    1    0.1723    0.0881
   16   -2    2    1    0.1266    0.0360    0.1275    0.0362    0.0009    1    0.1229    0.0679
   17   -1    3    2    0.7207   -0.0801    0.7293   -0.0807    0.0087    1    0.2291    0.1198
   18    0    4    3    1.0401   -0.4932    1.0696   -0.4972    0.0297    1    0.5017    0.2483
   19   -1    3    0    0.0711   -0.0151    0.0442    0.0295    0.0521    1    0.1372    0.0994
   20   -2    2    2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1570    0.1178
   21    2    0   -1   -0.0338   -0.0580   -0.0341   -0.0579    0.0004    1    0.0858    0.0568
   22   -3    1    3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1789    0.0899
   23   -3   -1    3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1599    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7319   -0.0599   -0.7310   -0.0567    0.0034    1          0.0662          0.0702
    2    4    2   -2   -0.0140   -0.1757   -0.0130   -0.1762    0.0010    1          0.1016          0.0995
    3   -2   -4    3   -0.0787    0.1166   -0.0262    0.0895    0.0591    1          0.1086          0.0967
    4    3    1    0   -0.1950   -0.5842   -0.1957   -0.5833    0.0011    1          0.1040          0.1078
    5    2    2   -1    0.0564   -0.2259    0.0560   -0.2234    0.0025    1          0.0656          0.0654
    6   -1   -3    2   -0.1050    0.1183   -0.1085    0.1216    0.0048    1          0.0778          0.0778
    7    3    3    0    0.1181   -0.5954    0.1201   -0.5973    0.0028    1          0.1334          0.1302
    8    2    4   -1    0.1444   -0.2228    0.1454   -0.2240    0.0015    1          0.1053          0.1017
    9    1   -3    1   -0.1930    0.0488   -0.1952    0.0486    0.0022    1          0.0790          0.0726
   10    0    2    0    0.2277   -0.1291    0.2251   -0.1274    0.0031    1          0.0469          0.0467
   11    1    3    1    0.5305   -0.6155    0.5303   -0.6130    0.0025    1          0.1244          0.1248
   12    3   -3    0   -0.1804   -0.0371   -0.1829   -0.0381    0.0026    1          0.1017          0.0984
   13   -2    4    1    0.2000   -0.0086    0.1990   -0.0092    0.0012    1          0.1024          0.0927
   14   -1    5    2    0.5312   -0.1526    0.5293   -0.1451    0.0077    1          0.1507          0.1473
   15    3   -1    0   -0.3353   -0.2366   -0.3362   -0.2357    0.0013    1          0.0885          0.0881
   16   -2    2    1    0.1274    0.0363    0.1275    0.0362    0.0001    1          0.0634          0.0679
   17   -1    3    2    0.7308   -0.0858    0.7293   -0.0807    0.0053    1          0.1156          0.1198
   18    0    4    3    1.0523   -0.5211    1.0696   -0.4972    0.0295    1          0.2500          0.2483
   19   -4    2    2    0.0439    0.0296    0.0442    0.0295    0.0003    1          0.0989          0.0994
   20   -3    3    3    0.4467    0.1640    0.4423    0.1634    0.0044    1          0.1197          0.1178
   21    2    0   -1   -0.0346   -0.0582   -0.0341   -0.0579    0.0005    1          0.0443          0.0568
   22   -3    1    3    0.3000    0.3335    0.3053    0.3413    0.0094    1          0.0907          0.0899
   23   -3   -1    3    0.0354    0.2709    0.0347    0.2716    0.0010    1          0.0815          0.0816

###            No.303                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2379    1.2352    1.4430   91.0976  114.9647   89.9076      0.4073
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2338    1.2334    1.4470   90.0000  114.7306   90.0000      0.3128         0.8526    0.8524    3.9440    3.9429    4.6256
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0167    0.0190    0.0366    0.0000    1.6830    0.0000      0.0230         0.0284    0.0270    0.2948    0.2961    0.3595
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4721    0.6250    0.4249)
 a2 = (   -0.6825    0.3847    0.2046)
 a3 = (    0.1256   -0.1387    0.7413)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4775    0.6259    0.4202) (    0.0038    0.0100    0.0138)
 a2 = (   -0.6837    0.3860    0.2020) (    0.0112    0.0078    0.0053)
 a3 = (    0.1362   -0.1433    0.7347) (    0.0126    0.0114    0.0236)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   62.1151   32.1900   -5.3247    0.5078    1.1132    0.6499
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            235            317
# Figure of merit at the beginning and the end of the refinement
         2.8598         5.4676
# Chi-squares at the beginning and the end of the refinement
    0.4025    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7464   -0.0593   -0.7310   -0.0567    0.0156    1    0.0877    0.0702
    2    4    2   -2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3   -2   -2    2   -0.0263    0.0897   -0.0262    0.0895    0.0003    1    0.0849    0.0967
    4    3    1    0   -0.1923   -0.5922   -0.1957   -0.5833    0.0095    1    0.1361    0.1078
    5    2    2   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1   -3    2   -0.1072    0.1207   -0.1085    0.1216    0.0015    1    0.1001    0.0778
    7    2    2    0    0.1245   -0.5974    0.1201   -0.5973    0.0044    1    0.1162    0.1302
    8    2    4   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1   -3    1   -0.1963    0.0496   -0.1952    0.0486    0.0015    1    0.1015    0.0726
   10    0    2    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1    3    1    0.5384   -0.6092    0.5303   -0.6130    0.0090    1    0.1644    0.1248
   12    2   -2    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0869    0.0984
   13   -2    4    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -1    5    2    0.5307   -0.1491    0.5293   -0.1451    0.0043    1    0.1975    0.1473
   15    3   -1    0   -0.3389   -0.2407   -0.3362   -0.2357    0.0056    1    0.1145    0.0881
   16   -2    2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -1    3    2    0.7279   -0.0808    0.7293   -0.0807    0.0014    1    0.1524    0.1198
   18    0    4    3    1.0531   -0.5024    1.0696   -0.4972    0.0173    1    0.3340    0.2483
   19   -4    2    2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -2    2    2    0.4459    0.1642    0.4423    0.1634    0.0036    1    0.1042    0.1178
   21    2    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -3    1    3    0.3011    0.3334    0.3053    0.3413    0.0090    1    0.1186    0.0899
   23   -3   -1    3    0.0365    0.2735    0.0347    0.2716    0.0026    1    0.1056    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    4    2   -2   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3   -5   -3    4   -0.0020    0.0475   -0.0262    0.0895    0.0484    1          0.1306          0.0967
    4    3    1    0   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    2    2   -1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -1   -3    2   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    3    3    0    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    2    4   -1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    1   -3    1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    3    1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12    5   -3   -1   -0.1432   -0.0709   -0.1829   -0.0381    0.0515    1          0.1331          0.0984
   13   -2    4    1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14   -1    5    2    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15    3   -1    0   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16   -2    2    1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17   -1    3    2    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    0    4    3    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19   -4    2    2    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20   -3    3    3    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    2    0   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -3    1    3    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23   -3   -1    3    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.305                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2360    1.2352    1.4456   89.6934  115.0093   90.1651      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2338    1.2334    1.4470   90.0000  114.7306   90.0000      0.3128         0.8526    0.8524    3.9440    3.9429    4.6256
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0167    0.0190    0.0366    0.0000    1.6830    0.0000      0.0230         0.0284    0.0270    0.2948    0.2961    0.3595
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4792   -0.6225   -0.4241)
 a2 = (   -0.6821    0.3862    0.2027)
 a3 = (   -0.1342    0.1431   -0.7377)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4775   -0.6259   -0.4202) (    0.0038    0.0100    0.0138)
 a2 = (   -0.6837    0.3860    0.2020) (    0.0112    0.0078    0.0053)
 a3 = (   -0.1362    0.1433   -0.7347) (    0.0126    0.0114    0.0236)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -62.1151  147.8100  174.6753    0.5078    1.1132    0.6499
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            237            319
# Figure of merit at the beginning and the end of the refinement
         2.5120         5.4561
# Chi-squares at the beginning and the end of the refinement
    0.5283    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2   -4    2    2   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3    2   -2   -2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4   -3    1    0   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5   -2    2    1    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6    1   -3   -2   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7   -2    2    0    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8   -2    4    1    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9   -1   -3   -1   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11   -1    3   -1    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12   -2   -2    0   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13    2    4   -1    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14    1    5   -2    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15   -3   -1    0   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16    2    2   -1    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17    1    3   -2    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18    0    4   -3    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19    4    2   -2    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20    2    2   -2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21   -2    0    1   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22    3    1   -3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23    3   -1   -3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2   -4    2    2   -0.0130   -0.1734   -0.0130   -0.1762    0.0028    1          0.0997          0.0995
    3    5   -3   -4   -0.0020    0.0475   -0.0262    0.0895    0.0484    1          0.1306          0.0967
    4   -3    1    0   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5   -2    2    1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    1   -3   -2   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7   -3    3    0    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8   -2    4    1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9   -1   -3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12   -5   -3    1   -0.1432   -0.0709   -0.1829   -0.0381    0.0515    1          0.1331          0.0984
   13    2    4   -1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    1    5   -2    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15   -3   -1    0   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    2    2   -1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    1    3   -2    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    0    4   -3    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19    4    2   -2    0.0446    0.0294    0.0442    0.0295    0.0004    1          0.0971          0.0994
   20    3    3   -3    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21   -2    0    1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22    3    1   -3    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23    3   -1   -3    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.306                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    2.7105    0.8828    0.8712   89.0916  106.3385   91.0839      0.9185
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    2.7980    0.8603    0.8777   90.0000  108.7986   90.0000      0.3207         3.1880    0.9802    8.7238    2.6823    2.7364
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1772    0.2070    0.2107    0.0000   10.6615    0.0000      0.0422         0.5769    0.0872    1.2731    0.7354    0.7490
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0708    0.0854   -0.3681)
 a2 = (    1.0753    0.3240   -0.1495)
 a3 = (    0.2014   -1.0015   -0.6224)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0679    0.0655   -0.3656) (    0.0106    0.0351    0.0073)
 a2 = (    1.1091    0.3141   -0.1497) (    0.2726    0.0707    0.0181)
 a3 = (    0.2029   -1.0117   -0.6196) (    0.0793    0.2436    0.0240)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.5748  102.3667   14.1817    1.4341    5.4388    1.0941
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0015    0.0001   -0.0248      0.0129    0.0057    0.2587

# Number of computed bands
            156            259
# Figure of merit at the beginning and the end of the refinement
         0.9317         5.1661
# Chi-squares at the beginning and the end of the refinement
   34.4915    0.0106
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -3    1    0   -0.7395   -0.0389   -0.7310   -0.0567    0.0197    1    0.1968    0.0702
    2    2    0   -2    0.0551   -0.2201   -0.0130   -0.1762    0.0811    1    0.1915    0.0995
    3   -2    0    1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0977    0.0967
    4   -1    1   -2   -0.1950   -0.5882   -0.1957   -0.5833    0.0049    1    0.3066    0.1078
    5    2    0   -2    0.0551   -0.2201    0.0560   -0.2234    0.0033    1    0.1915    0.0654
    6   -3    1    1   -0.1603    0.1005   -0.1085    0.1216    0.0559    1    0.1466    0.0778
    7    0    0   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1296    0.1302
    8    2    0   -2    0.0551   -0.2201    0.1454   -0.2240    0.0904    1    0.1915    0.1017
    9   -1    1    0   -0.1829   -0.0381   -0.1952    0.0486    0.0875    1    0.0973    0.0726
   10    1   -1   -1    0.2269   -0.1285    0.2251   -0.1274    0.0021    1    0.1351    0.0467
   11   -1   -1   -2    0.5488   -0.6213    0.5303   -0.6130    0.0202    1    0.3728    0.1248
   12   -1    1    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0973    0.0984
   13    0   -2    0    0.1274    0.0384    0.1990   -0.0092    0.0859    1    0.1827    0.0927
   14    0   -2   -1    0.3831   -0.0576    0.5293   -0.1451    0.1704    0    0.2329    0.1473
   15   -2    2   -1   -0.3379   -0.2389   -0.3362   -0.2357    0.0036    1    0.2581    0.0881
   16    0   -2    0    0.1274    0.0384    0.1275    0.0362    0.0022    1    0.1827    0.0679
   17   -2   -2   -1    0.7448   -0.0615    0.7293   -0.0807    0.0247    1    0.3448    0.1198
   18   -1   -1   -1    0.7618   -0.3740    1.0696   -0.4972    0.3315    1    0.2405    0.2483
   19   -2    0    1   -0.0262    0.0895    0.0442    0.0295    0.0924    1    0.0977    0.0994
   20   -1   -1    0    0.4419    0.1801    0.4423    0.1634    0.0167    1    0.1166    0.1178
   21    1    1   -1   -0.0319   -0.0561   -0.0341   -0.0579    0.0029    1    0.1291    0.0568
   22   -3   -1    1    0.1421    0.3398    0.3053    0.3413    0.1632    1    0.1642    0.0899
   23   -3   -1    1    0.1421    0.3398    0.0347    0.2716    0.1272    1    0.1642    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -3    1    0   -0.7349   -0.0658   -0.7310   -0.0567    0.0099    1          0.0661          0.0702
    2    3    1   -3   -0.0162   -0.1759   -0.0130   -0.1762    0.0031    1          0.1000          0.0995
    3   -7   -1    4   -0.0033    0.0488   -0.0262    0.0895    0.0467    1          0.1303          0.0967
    4   -1    1   -2   -0.2012   -0.5886   -0.1957   -0.5833    0.0076    1          0.1032          0.1078
    5    2    0   -2    0.0557   -0.2274    0.0560   -0.2234    0.0041    1          0.0645          0.0654
    6   -5    1    2   -0.1114    0.1206   -0.1085    0.1216    0.0031    1          0.0769          0.0778
    7    0    0   -3    0.1196   -0.6034    0.1201   -0.5973    0.0061    1          0.1322          0.1302
    8    3   -1   -3    0.1456   -0.2235    0.1454   -0.2240    0.0005    1          0.1037          0.1017
    9   -4    2    1   -0.1970    0.0467   -0.1952    0.0486    0.0026    1          0.0788          0.0726
   10    1   -1   -1    0.2281   -0.1271    0.2251   -0.1274    0.0030    1          0.0466          0.0467
   11   -1   -1   -2    0.5410   -0.6163    0.5303   -0.6130    0.0111    1          0.1240          0.1248
   12   -3    3    0   -0.1814   -0.0382   -0.1829   -0.0381    0.0015    1          0.1018          0.0984
   13    1   -3   -1    0.1985   -0.0076    0.1990   -0.0092    0.0016    1          0.1024          0.0927
   14   -1   -3   -2    0.5318   -0.1479    0.5293   -0.1451    0.0037    1          0.1504          0.1473
   15   -2    2   -1   -0.3371   -0.2356   -0.3362   -0.2357    0.0009    1          0.0883          0.0881
   16    0   -2    0    0.1266    0.0361    0.1275    0.0362    0.0009    1          0.0635          0.0679
   17   -2   -2   -1    0.7295   -0.0809    0.7293   -0.0807    0.0003    1          0.1154          0.1198
   18   -4   -2   -2    1.0595   -0.5112    1.0696   -0.4972    0.0173    1          0.2493          0.2483
   19   -1   -3    1    0.0441    0.0299    0.0442    0.0295    0.0004    1          0.0990          0.0994
   20   -3   -3    0    0.4462    0.1631    0.4423    0.1634    0.0038    1          0.1200          0.1178
   21    1    1   -1   -0.0354   -0.0565   -0.0341   -0.0579    0.0019    1          0.0439          0.0568
   22   -4   -2    1    0.3050    0.3342    0.3053    0.3413    0.0071    1          0.0907          0.0899
   23   -5   -1    2    0.0366    0.2786    0.0347    0.2716    0.0072    1          0.0806          0.0816

###            No.312                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2619    1.7790    1.0908   89.9509  125.2438   90.0787      0.4543
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2273    1.8087    1.0783   90.0000  123.3236   90.0000      0.4270         1.1382    1.6774    2.8739    4.2356    2.5250
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0702    0.0881    0.0270    0.0000    4.9825    0.0000      0.0420         0.0492    0.1062    0.3272    0.4653    0.2565
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6164   -0.4133    0.6250)
 a2 = (   -0.2848   -0.4832   -0.0377)
 a3 = (    0.9457   -0.5354   -0.2811)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6068   -0.4084    0.6450) (    0.0361    0.0140    0.0422)
 a2 = (   -0.2796   -0.4754   -0.0380) (    0.0133    0.0237    0.0026)
 a3 = (    0.9335   -0.5260   -0.2894) (    0.0465    0.0282    0.0209)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   95.9263  138.3228   63.9687    0.3820    3.3296    0.5497
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0413      0.0023    0.0023    0.1076

# Number of computed bands
             83            400
# Figure of merit at the beginning and the end of the refinement
        28.7743         4.2150
# Chi-squares at the beginning and the end of the refinement
    0.0421    0.0318
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0673    0.0702
    2    0   -4   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1012    0.0995
    3    1    3    1   -0.0261    0.0886   -0.0262    0.0895    0.0009    1    0.0989    0.0967
    4    1   -3   -1   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1048    0.1078
    5    0   -2   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0653    0.0654
    6    1    1    1   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0778    0.0778
    7    1   -3   -2    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.1342    0.1302
    8    0   -2   -2    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1049    0.1017
    9    1   -1    1   -0.1943    0.0490   -0.1952    0.0486    0.0010    1    0.0789    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -1   -2    0.5316   -0.6124    0.5303   -0.6130    0.0014    1    0.1260    0.1248
   12    1   -3    1   -0.1813   -0.0376   -0.1829   -0.0381    0.0016    1    0.1014    0.0984
   13    0    2   -2    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1019    0.0927
   14    1    1   -3    0.5286   -0.1497    0.5293   -0.1451    0.0047    1    0.1513    0.1473
   15    1   -3    0   -0.3354   -0.2363   -0.3362   -0.2357    0.0010    1    0.0887    0.0881
   16    0    2   -1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0631    0.0679
   17    1    1   -2    0.7279   -0.0814    0.7293   -0.0807    0.0016    1    0.1168    0.1198
   18    2    0   -3    1.0556   -0.5129    1.0696   -0.4972    0.0211    1    0.2565    0.2483
   19    0    4   -1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0984    0.0994
   20    1    3   -2    0.4432    0.1648    0.4423    0.1634    0.0016    1    0.1202    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0441    0.0568
   22    1    3   -1    0.2968    0.3328    0.3053    0.3413    0.0120    1    0.0912    0.0899
   23    1    3    0    0.0345    0.2704    0.0347    0.2716    0.0012    1    0.0817    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7343   -0.0559   -0.7310   -0.0567    0.0033    1          0.0681          0.0702
    2    0   -4   -1   -0.0131   -0.1736   -0.0130   -0.1762    0.0026    1          0.0977          0.0995
    3    1    3    1   -0.0267    0.0898   -0.0262    0.0895    0.0006    1          0.0955          0.0967
    4    1   -3   -1   -0.1944   -0.5868   -0.1957   -0.5833    0.0037    1          0.1047          0.1078
    5    0   -2   -1    0.0566   -0.2232    0.0560   -0.2234    0.0006    1          0.0633          0.0654
    6    1    1    1   -0.1072    0.1196   -0.1085    0.1216    0.0023    1          0.0754          0.0778
    7    1   -3   -2    0.1212   -0.5953    0.1201   -0.5973    0.0023    1          0.1340          0.1302
    8    0   -2   -2    0.1436   -0.2201    0.1454   -0.2240    0.0043    1          0.1019          0.1017
    9    1   -1    1   -0.1948    0.0488   -0.1952    0.0486    0.0005    1          0.0765          0.0726
   10    0    0   -1    0.2257   -0.1275    0.2251   -0.1274    0.0006    1          0.0455          0.0467
   11    1   -1   -2    0.5359   -0.6118    0.5303   -0.6130    0.0057    1          0.1283          0.1248
   12    1   -3    1   -0.1813   -0.0379   -0.1829   -0.0381    0.0016    1          0.0981          0.0984
   13    0    2   -2    0.1985   -0.0086    0.1990   -0.0092    0.0007    1          0.0989          0.0927
   14    1    1   -3    0.5302   -0.1491    0.5293   -0.1451    0.0041    1          0.1508          0.1473
   15    1   -3    0   -0.3363   -0.2372   -0.3362   -0.2357    0.0015    1          0.0871          0.0881
   16    0    2   -1    0.1269    0.0357    0.1275    0.0362    0.0007    1          0.0610          0.0679
   17    1    1   -2    0.7297   -0.0800    0.7293   -0.0807    0.0008    1          0.1183          0.1198
   18    3    1   -5    0.9422   -0.2804    1.0696   -0.4972    0.2515    0          0.3701          0.2483
   19    0    4   -1    0.0445    0.0294    0.0442    0.0295    0.0003    1          0.0949          0.0994
   20    1    3   -2    0.4451    0.1656    0.4423    0.1634    0.0035    1          0.1191          0.1178
   21    0   -2    0   -0.0333   -0.0572   -0.0341   -0.0579    0.0011    1          0.0424          0.0568
   22    1    3   -1    0.2986    0.3348    0.3053    0.3413    0.0093    1          0.0902          0.0899
   23    1    3    0    0.0347    0.2728    0.0347    0.2716    0.0011    1          0.0796          0.0816

###            No.320                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2366    1.7975    1.0916   90.3455  124.4837   89.4980      0.4581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2224    1.8133    1.1050   90.0000  125.2554   90.0000      0.4235         1.1063    1.6410    2.8861    4.2813    2.6089
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0206    0.2011    0.1055    0.0000    1.3627    0.0000      0.0304         0.1126    0.0460    0.2131    0.5658    0.3118
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3272    0.1041    0.9190)
 a2 = (    0.2822    0.4776    0.0425)
 a3 = (   -0.9363    0.5301    0.2783)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3286    0.1176    0.9391) (    0.0360    0.0265    0.0158)
 a2 = (    0.2789    0.4742    0.0382) (    0.0294    0.0539    0.0031)
 a3 = (   -0.9319    0.5247    0.2907) (    0.1029    0.0582    0.0072)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   85.7701  109.9602 -121.9099    0.3980    2.7063    0.4586
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0000    0.0004    0.0462      0.0024    0.0024    0.1205

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         6.3733         3.9996
# Chi-squares at the beginning and the end of the refinement
    0.3096    0.0355
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7639   -0.0442   -0.7310   -0.0567    0.0352    0    0.0702    0.0702
    2    0    4    1   -0.0144   -0.1826   -0.0130   -0.1762    0.0065    1    0.1013    0.0995
    3    1   -3   -2   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4    1    3    0   -0.2065   -0.6112   -0.1957   -0.5833    0.0299    0    0.1077    0.1078
    5    0    2    1    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0654    0.0654
    6    1   -1   -2   -0.1107    0.1256   -0.1085    0.1216    0.0046    1    0.0784    0.0778
    7    1    3    1    0.1243   -0.6159    0.1201   -0.5973    0.0190    1    0.1369    0.1302
    8    0    2    2    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1050    0.1017
    9    1    1   -2   -0.2073    0.0543   -0.1952    0.0486    0.0134    1    0.0796    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1    1    0.5533   -0.6268    0.5303   -0.6130    0.0268    1    0.1294    0.1248
   12    1    3   -2   -0.1970   -0.0393   -0.1829   -0.0381    0.0142    1    0.1019    0.0984
   13    0   -2    2    0.1932   -0.0083    0.1990   -0.0092    0.0058    1    0.1015    0.0927
   14    1   -1    2    0.5364   -0.1484    0.5293   -0.1451    0.0078    1    0.1523    0.1473
   15    1    3   -1   -0.3570   -0.2469   -0.3362   -0.2357    0.0236    0    0.0903    0.0881
   16    0   -2    1    0.1193    0.0338    0.1275    0.0362    0.0086    1    0.0628    0.0679
   17    1   -1    1    0.7395   -0.0749    0.7293   -0.0807    0.0117    1    0.1184    0.1198
   18    2    0    1    1.0947   -0.5081    1.0696   -0.4972    0.0274    1    0.2671    0.2483
   19    0   -4    1    0.0363    0.0242    0.0442    0.0295    0.0095    1    0.0981    0.0994
   20    1   -3    1    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21    0    2    0   -0.0390   -0.0660   -0.0341   -0.0579    0.0094    1    0.0440    0.0568
   22    1   -3    0    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    1   -3   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7380   -0.0565   -0.7310   -0.0567    0.0070    1          0.0683          0.0702
    2    0    4    1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0972          0.0995
    3    1   -3   -2   -0.0268    0.0901   -0.0262    0.0895    0.0009    1          0.0949          0.0967
    4    1    3    0   -0.1942   -0.5889   -0.1957   -0.5833    0.0058    1          0.1048          0.1078
    5    0    2    1    0.0567   -0.2237    0.0560   -0.2234    0.0008    1          0.0630          0.0654
    6    1   -1   -2   -0.1077    0.1201   -0.1085    0.1216    0.0017    1          0.0749          0.0778
    7    1    3    1    0.1223   -0.5963    0.1201   -0.5973    0.0024    1          0.1341          0.1302
    8    0    2    2    0.1438   -0.2205    0.1454   -0.2240    0.0039    1          0.1015          0.1017
    9    1    1   -2   -0.1957    0.0490   -0.1952    0.0486    0.0006    1          0.0761          0.0726
   10    0    0    1    0.2259   -0.1276    0.2251   -0.1274    0.0008    1          0.0453          0.0467
   11    1    1    1    0.5372   -0.6114    0.5303   -0.6130    0.0070    1          0.1287          0.1248
   12    1    3   -2   -0.1821   -0.0381   -0.1829   -0.0381    0.0007    1          0.0976          0.0984
   13    0   -2    2    0.1985   -0.0087    0.1990   -0.0092    0.0006    1          0.0984          0.0927
   14    1   -1    2    0.5304   -0.1491    0.5293   -0.1451    0.0041    1          0.1508          0.1473
   15    1    3   -1   -0.3375   -0.2384   -0.3362   -0.2357    0.0030    1          0.0869          0.0881
   16    0   -2    1    0.1269    0.0357    0.1275    0.0362    0.0008    1          0.0607          0.0679
   17    1   -1    1    0.7295   -0.0800    0.7293   -0.0807    0.0007    1          0.1186          0.1198
   18    3   -1    2    0.9416   -0.2797    1.0696   -0.4972    0.2523    0          0.3715          0.2483
   19    0   -4    1    0.0443    0.0293    0.0442    0.0295    0.0003    1          0.0943          0.0994
   20    1   -3    1    0.4454    0.1653    0.4423    0.1634    0.0036    1          0.1190          0.1178
   21    0    2    0   -0.0336   -0.0575   -0.0341   -0.0579    0.0007    1          0.0422          0.0568
   22    1   -3    0    0.2993    0.3348    0.3053    0.3413    0.0089    1          0.0900          0.0899
   23    1   -3   -1    0.0349    0.2733    0.0347    0.2716    0.0017    1          0.0793          0.0816

###            No.321                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2539    1.7678    1.0861   90.9390  123.8104   89.9213      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2230    1.8098    1.1046   90.0000  125.1146   90.0000      0.4232         1.1072    1.6383    2.8902    4.2766    2.6103
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0144    0.1766    0.0987    0.0000    0.9567    0.0000      0.0287         0.1021    0.0299    0.1986    0.5079    0.2927
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3044    0.1076    0.9039)
 a2 = (    0.2776    0.4913    0.0406)
 a3 = (   -0.9338    0.5286    0.2776)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3259    0.1156    0.9378) (    0.0278    0.0210    0.0122)
 a2 = (    0.2796    0.4750    0.0386) (    0.0266    0.0471    0.0031)
 a3 = (   -0.9304    0.5241    0.2905) (    0.0926    0.0537    0.0067)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   85.7387  109.8071 -121.9310    0.3378    2.1006    0.4014
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0493      0.0023    0.0023    0.1051

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         8.6014         3.9457
# Chi-squares at the beginning and the end of the refinement
    0.2420    0.0259
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2    0    4    1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    1   -3   -2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4    1    3    0   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5    0    2    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    1   -1   -2   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7    1    3    1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8    0    2    2    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    1    1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    1    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12    1    3   -2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    0   -2    2    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    1   -1    2    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15    1    3   -1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    0   -2    1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    1   -1    1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    2    0    1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    0   -4    1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    1   -3    1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21    0    2    0   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    1   -3    0    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    1   -3   -1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1   -1   -0.7333   -0.0557   -0.7310   -0.0567    0.0024    1          0.0684          0.0702
    2    0    4    1   -0.0133   -0.1740   -0.0130   -0.1762    0.0022    1          0.0975          0.0995
    3    1   -3   -2   -0.0262    0.0888   -0.0262    0.0895    0.0006    1          0.0952          0.0967
    4    1    3    0   -0.1947   -0.5858   -0.1957   -0.5833    0.0027    1          0.1050          0.1078
    5    0    2    1    0.0563   -0.2236    0.0560   -0.2234    0.0004    1          0.0632          0.0654
    6    1   -1   -2   -0.1066    0.1192   -0.1085    0.1216    0.0030    1          0.0751          0.0778
    7    1    3    1    0.1204   -0.5951    0.1201   -0.5973    0.0022    1          0.1344          0.1302
    8    0    2    2    0.1434   -0.2204    0.1454   -0.2240    0.0041    1          0.1017          0.1017
    9    1    1   -2   -0.1946    0.0486   -0.1952    0.0486    0.0006    1          0.0762          0.0726
   10    0    0    1    0.2255   -0.1274    0.2251   -0.1274    0.0004    1          0.0453          0.0467
   11    1    1    1    0.5357   -0.6118    0.5303   -0.6130    0.0055    1          0.1289          0.1248
   12    1    3   -2   -0.1813   -0.0382   -0.1829   -0.0381    0.0015    1          0.0979          0.0984
   13    0   -2    2    0.1977   -0.0085    0.1990   -0.0092    0.0014    1          0.0985          0.0927
   14    1   -1    2    0.5294   -0.1483    0.5293   -0.1451    0.0032    1          0.1509          0.1473
   15    1    3   -1   -0.3359   -0.2372   -0.3362   -0.2357    0.0015    1          0.0871          0.0881
   16    0   -2    1    0.1260    0.0355    0.1275    0.0362    0.0017    1          0.0608          0.0679
   17    1   -1    1    0.7281   -0.0786    0.7293   -0.0807    0.0025    1          0.1186          0.1198
   18    3   -1    2    0.9413   -0.2782    1.0696   -0.4972    0.2537    0          0.3723          0.2483
   19    0   -4    1    0.0437    0.0287    0.0442    0.0295    0.0010    1          0.0946          0.0994
   20    1   -3    1    0.4427    0.1654    0.4423    0.1634    0.0020    1          0.1190          0.1178
   21    0    2    0   -0.0336   -0.0579   -0.0341   -0.0579    0.0005    1          0.0424          0.0568
   22    1   -3    0    0.2965    0.3326    0.3053    0.3413    0.0124    1          0.0901          0.0899
   23    1   -3   -1    0.0348    0.2706    0.0347    0.2716    0.0011    1          0.0795          0.0816

###            No.322                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9865    1.4245    1.4234   90.0056   90.5253   89.8298      0.3817
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9750    1.4348    1.4300   90.0000   91.2980   90.0000      0.3396         0.6818    1.0034    2.8710    4.2251    4.2107
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0013    0.1504    0.1444    0.0000    3.4395    0.0000      0.0223         0.0680    0.0140    0.1883    0.5224    0.5069
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1795    0.1789   -0.9816)
 a2 = (    0.3557    0.6034    0.0471)
 a3 = (    0.5919   -0.3351   -0.1759)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1767    0.1832   -0.9938) (    0.0303    0.0132    0.0077)
 a2 = (    0.3525    0.5993    0.0478) (    0.0361    0.0637    0.0039)
 a3 = (    0.5884   -0.3315   -0.1821) (    0.0628    0.0364    0.0049)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -85.9497  103.7949   60.5046    0.3252    1.8503    0.3885
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0397      0.0023    0.0023    0.1080

# Number of computed bands
            147            400
# Figure of merit at the beginning and the end of the refinement
         7.3583         3.9013
# Chi-squares at the beginning and the end of the refinement
    0.1337    0.0317
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7519   -0.0597   -0.7310   -0.0567    0.0211    1    0.0729    0.0702
    2    0    4   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1062    0.0995
    3   -1   -3    3   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.1041    0.0967
    4   -1    3   -1   -0.1979   -0.5946   -0.1957   -0.5833    0.0115    1    0.1118    0.1078
    5    0    2   -2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0686    0.0654
    6   -1   -1    3   -0.1130    0.1263   -0.1085    0.1216    0.0066    1    0.0821    0.0778
    7   -1    3   -3    0.1208   -0.6018    0.1201   -0.5973    0.0045    1    0.1428    0.1302
    8    0    2   -4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1103    0.1017
    9   -1    1    3   -0.2039    0.0512   -0.1952    0.0486    0.0090    1    0.0834    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0492    0.0467
   11   -1    1   -3    0.5389   -0.6210    0.5303   -0.6130    0.0117    1    0.1349    0.1248
   12   -1    3    3   -0.1888   -0.0391   -0.1829   -0.0381    0.0060    1    0.1070    0.0984
   13    0   -2   -4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1072    0.0927
   14   -1   -1   -5    0.5351   -0.1524    0.5293   -0.1451    0.0093    1    0.1607    0.1473
   15   -1    3    1   -0.3440   -0.2426   -0.3362   -0.2357    0.0104    1    0.0943    0.0881
   16    0   -2   -2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0663    0.0679
   17   -1   -1   -3    0.7395   -0.0845    0.7293   -0.0807    0.0108    1    0.1250    0.1198
   18   -2    0   -4    1.0713   -0.5241    1.0696   -0.4972    0.0270    1    0.2781    0.2483
   19    0   -4   -2    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1034    0.0994
   20   -1   -3   -3    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1276    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0463    0.0568
   22   -1   -3   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0969    0.0899
   23   -1   -3    1    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7342   -0.0559   -0.7310   -0.0567    0.0033    1          0.0681          0.0702
    2    0    4   -3    0.0217   -0.2069   -0.0130   -0.1762    0.0464    1          0.1109          0.0995
    3   -1   -3    3   -0.0267    0.0898   -0.0262    0.0895    0.0006    1          0.0956          0.0967
    4   -1    3   -1   -0.1945   -0.5867   -0.1957   -0.5833    0.0036    1          0.1047          0.1078
    5    0    2   -2    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0633          0.0654
    6   -1   -1    3   -0.1072    0.1196   -0.1085    0.1216    0.0023    1          0.0754          0.0778
    7   -1    3   -3    0.1212   -0.5953    0.1201   -0.5973    0.0023    1          0.1340          0.1302
    8    0    2   -4    0.1436   -0.2201    0.1454   -0.2240    0.0043    1          0.1020          0.1017
    9   -1    1    3   -0.1948    0.0488   -0.1952    0.0486    0.0004    1          0.0766          0.0726
   10    0    0   -2    0.2257   -0.1275    0.2251   -0.1274    0.0006    1          0.0455          0.0467
   11   -1    1   -3    0.5359   -0.6119    0.5303   -0.6130    0.0056    1          0.1281          0.1248
   12   -1    3    3   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0982          0.0984
   13    0   -2   -4    0.1984   -0.0086    0.1990   -0.0092    0.0007    1          0.0990          0.0927
   14   -1   -1   -5    0.5302   -0.1492    0.5293   -0.1451    0.0041    1          0.1508          0.1473
   15   -1    3    1   -0.3363   -0.2372   -0.3362   -0.2357    0.0015    1          0.0871          0.0881
   16    0   -2   -2    0.1269    0.0357    0.1275    0.0362    0.0007    1          0.0610          0.0679
   17   -1   -1   -3    0.7297   -0.0801    0.7293   -0.0807    0.0007    1          0.1182          0.1198
   18   -2    0   -5    0.8610   -0.4298    1.0696   -0.4972    0.2192    0          0.2502          0.2483
   19    0   -6   -2    0.0127    0.0108    0.0442    0.0295    0.0366    1          0.1340          0.0994
   20   -1   -3   -3    0.4451    0.1656    0.4423    0.1634    0.0035    1          0.1191          0.1178
   21    0    2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0425          0.0568
   22   -1   -3   -1    0.2986    0.3348    0.3053    0.3413    0.0093    1          0.0902          0.0899
   23   -1   -3    1    0.0347    0.2728    0.0347    0.2716    0.0011    1          0.0796          0.0816

###            No.323                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5580    1.6037    0.8014   90.3364   91.7992   88.0701      0.6045
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5813    1.5876    0.7967   90.0000   89.8315   90.0000      0.2830         1.9849    1.9928    5.5871    5.6094    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0637    0.0112    0.0000    0.7793    0.0000      0.0218         0.0278    0.0755    0.4296    0.4866    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6128   -0.1738    0.0844)
 a2 = (   -0.0952    0.1189   -0.6051)
 a3 = (    0.2577   -1.1890   -0.2805)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6033   -0.1709    0.0820) (    0.0015    0.0051    0.0035)
 a2 = (   -0.1152    0.1150   -0.6085) (    0.0079    0.0074    0.0235)
 a3 = (    0.3015   -1.1856   -0.2811) (    0.0119    0.0167    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  172.3589  102.9190   14.0984    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            400            181
# Figure of merit at the beginning and the end of the refinement
         1.7419         3.8473
# Chi-squares at the beginning and the end of the refinement
    4.7409    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2   -2    0   -2   -0.0351   -0.1347   -0.0130   -0.1762    0.0470    1    0.1509    0.0995
    3    1   -1    2    0.0000    0.0481   -0.0262    0.0895    0.0489    1    0.1395    0.0967
    4   -1   -1   -1   -0.2061   -0.5694   -0.1957   -0.5833    0.0173    1    0.1099    0.1078
    5    0    0   -1    0.0488   -0.2253    0.0560   -0.2234    0.0074    1    0.0683    0.0654
    6   -1   -1    1   -0.1045    0.1228   -0.1085    0.1216    0.0041    1    0.0804    0.0778
    7    0   -2   -3    0.1047   -0.5979    0.1201   -0.5973    0.0155    1    0.2835    0.1302
    8    2    0   -2    0.1776   -0.2071    0.1454   -0.2240    0.0364    1    0.1551    0.1017
    9   -4   -2    1   -0.1920    0.0484   -0.1952    0.0486    0.0032    1    0.1650    0.0726
   10    2    0   -1    0.2292   -0.1300    0.2251   -0.1274    0.0048    1    0.0980    0.0467
   11    1   -1   -1    0.5355   -0.6189    0.5303   -0.6130    0.0079    1    0.1330    0.1248
   12   -3   -1    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    4    0   -1    0.2208   -0.0403    0.1990   -0.0092    0.0380    1    0.1543    0.0927
   14    3   -1   -1    0.5293   -0.1451    0.5293   -0.1451    0.0000    1    0.1604    0.1473
   15   -4   -2   -1   -0.3275   -0.2262   -0.3362   -0.2357    0.0130    1    0.1883    0.0881
   16    2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    4   -2   -1    0.7185   -0.0730    0.7293   -0.0807    0.0133    1    0.2483    0.1198
   18    2   -2   -1    1.0538   -0.4918    1.0696   -0.4972    0.0166    1    0.2689    0.2483
   19    4    0    1    0.0150    0.0129    0.0442    0.0295    0.0336    1    0.1506    0.0994
   20    3   -1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21   -2    0   -1   -0.0328   -0.0520   -0.0341   -0.0579    0.0061    1    0.0949    0.0568
   22    4   -2    1    0.2981    0.3158    0.3053    0.3413    0.0265    0    0.1972    0.0899
   23    1   -1    1    0.0470    0.2678    0.0347    0.2716    0.0129    1    0.0870    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -2    0   -3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    0   -2    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2   -2   -2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    0    0   -2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6   -2   -2    2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    0   -2   -3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8    2    0   -3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -4   -2    1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    2    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    2   -2   -2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12   -6   -2    0   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    6    0   -1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    6   -2   -2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -4   -2   -1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    4    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    4   -2   -1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    4   -4   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    6    0    1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    6   -2    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21   -2    0   -1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    4   -2    1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    2   -2    2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.324                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5554    1.6009    0.8041   90.1779   91.9476   91.9132      0.6026
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5813    1.5876    0.7967   90.0000   89.8315   90.0000      0.2830         1.9849    1.9928    5.5871    5.6094    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0637    0.0112    0.0000    0.7793    0.0000      0.0218         0.0278    0.0755    0.4296    0.4866    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6139    0.1741   -0.0846)
 a2 = (   -0.0953    0.1191   -0.6061)
 a3 = (   -0.2555    1.1879    0.2683)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6033    0.1709   -0.0820) (    0.0015    0.0051    0.0035)
 a2 = (   -0.1152    0.1150   -0.6085) (    0.0079    0.0074    0.0235)
 a3 = (   -0.3015    1.1856    0.2811) (    0.0119    0.0167    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -172.3589   77.0810 -165.9016    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            400            181
# Figure of merit at the beginning and the end of the refinement
         1.7427         3.8473
# Chi-squares at the beginning and the end of the refinement
    4.7565    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0702    0.0702
    2    2    0    2   -0.0332   -0.1261   -0.0130   -0.1762    0.0540    1    0.1499    0.0995
    3   -1   -1   -2    0.0002    0.0578   -0.0262    0.0895    0.0412    1    0.1392    0.0967
    4    1   -1    1   -0.2047   -0.5607   -0.1957   -0.5833    0.0243    1    0.1083    0.1078
    5    0    0    1    0.0464   -0.2158    0.0560   -0.2234    0.0122    1    0.0676    0.0654
    6    1   -1   -1   -0.1104    0.1296   -0.1085    0.1216    0.0082    1    0.0805    0.0778
    7    0   -2    3    0.1020   -0.5889    0.1201   -0.5973    0.0200    1    0.2787    0.1302
    8   -2    0    2    0.1720   -0.2005    0.1454   -0.2240    0.0354    1    0.1534    0.1017
    9    4   -2   -1   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1650    0.0726
   10   -2    0    1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0972    0.0467
   11   -1   -1    1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1308    0.1248
   12    3   -1    0   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1075    0.0984
   13   -4    0    1    0.2166   -0.0393    0.1990   -0.0092    0.0349    1    0.1535    0.0927
   14   -3   -1    1    0.5244   -0.1432    0.5293   -0.1451    0.0052    1    0.1588    0.1473
   15    4   -2    1   -0.3241   -0.2232   -0.3362   -0.2357    0.0174    1    0.1872    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0678    0.0679
   17   -4   -2    1    0.7144   -0.0718    0.7293   -0.0807    0.0174    1    0.2462    0.1198
   18   -2   -2    1    1.0491   -0.4881    1.0696   -0.4972    0.0224    1    0.2655    0.2483
   19   -4    0   -1    0.0183    0.0157    0.0442    0.0295    0.0293    1    0.1505    0.0994
   20   -3   -1    0    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1290    0.1178
   21    2    0    1   -0.0292   -0.0461   -0.0341   -0.0579    0.0129    1    0.0946    0.0568
   22   -4   -2   -1    0.3016    0.3186    0.3053    0.3413    0.0230    0    0.1979    0.0899
   23   -1   -1   -1    0.0491    0.2765    0.0347    0.2716    0.0152    1    0.0873    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2    2    0    3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    0   -2   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    2   -2    2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    0    0    2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    2   -2   -2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    0   -2    3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -2    0    3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    4   -2   -1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -2    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2   -2    2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    6   -2    0   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13   -6    0    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -6   -2    2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    4   -2    1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -4    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -4   -2    1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -4   -4    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -6    0   -1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -6   -2    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    2    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -4   -2   -1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23   -2   -2   -2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.325                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5813    1.6016    0.7898   90.2611   90.3111   89.0763      0.3914
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5813    1.5876    0.7967   90.0000   90.1685   90.0000      0.2830         1.9849    1.9928    5.5871    5.6094    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0637    0.0112    0.0000    0.7793    0.0000      0.0218         0.0278    0.0755    0.4296    0.4866    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6032    0.1711   -0.0831)
 a2 = (    0.1057   -0.1161    0.6044)
 a3 = (    0.3081   -1.1963   -0.2779)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6033    0.1709   -0.0820) (    0.0015    0.0051    0.0035)
 a2 = (    0.1152   -0.1150    0.6085) (    0.0079    0.0074    0.0235)
 a3 = (    0.3015   -1.1856   -0.2811) (    0.0119    0.0167    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6411  102.9190   14.0984    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            179            181
# Figure of merit at the beginning and the end of the refinement
         3.1429         3.8473
# Chi-squares at the beginning and the end of the refinement
    2.1835    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0912    0.0702
    2    2    0   -3   -0.0121   -0.1689   -0.0130   -0.1762    0.0073    1    0.1385    0.0995
    3    0    2    3   -0.0268    0.0902   -0.0262    0.0895    0.0010    1    0.1361    0.0967
    4    2    2   -2   -0.1855   -0.5793   -0.1957   -0.5833    0.0110    1    0.1420    0.1078
    5    0    0   -1    0.0561   -0.2179    0.0560   -0.2234    0.0055    1    0.0447    0.0654
    6    1    1    1   -0.1059    0.1189   -0.1085    0.1216    0.0037    1    0.0534    0.0778
    7    0    2   -3    0.1237   -0.5822    0.1201   -0.5973    0.0155    1    0.1825    0.1302
    8   -2    0   -2    0.1749   -0.1967    0.1454   -0.2240    0.0401    1    0.1021    0.1017
    9    4    2    1   -0.1918    0.0487   -0.1952    0.0486    0.0034    1    0.1079    0.0726
   10   -2    0   -1    0.2225   -0.1255    0.2251   -0.1274    0.0033    1    0.0643    0.0467
   11   -1    1   -1    0.5271   -0.5948    0.5303   -0.6130    0.0185    1    0.0852    0.1248
   12    3    1    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0691    0.0984
   13   -4    0   -1    0.2166   -0.0408    0.1990   -0.0092    0.0362    1    0.1000    0.0927
   14   -3    1   -1    0.5210   -0.1468    0.5293   -0.1451    0.0084    1    0.1034    0.1473
   15    4    2   -1   -0.3308   -0.2355   -0.3362   -0.2357    0.0054    1    0.1203    0.0881
   16   -4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0866    0.0679
   17   -4    2   -1    0.7159   -0.0798    0.7293   -0.0807    0.0134    1    0.1593    0.1198
   18   -2    2   -1    1.0331   -0.4929    1.0696   -0.4972    0.0367    1    0.1709    0.2483
   19   -4    0    1    0.0144    0.0129    0.0442    0.0295    0.0341    1    0.0950    0.0994
   20   -3    1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0824    0.1178
   21    2    0   -1   -0.0316   -0.0542   -0.0341   -0.0579    0.0045    1    0.0603    0.0568
   22   -4    2    1    0.2971    0.3316    0.3053    0.3413    0.0127    1    0.1253    0.0899
   23   -1    1    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0561    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2    2    0   -3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    0    2    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    2    2   -2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    0    0   -2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    2    2    2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    0    2   -3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -2    0   -3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    4    2    1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -2    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2    2   -2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    6    2    0   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13   -6    0   -1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -6    2   -2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    4    2   -1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -4    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -4    2   -1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -4    4   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -6    0    1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -6    2    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    2    0   -1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -4    2    1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23   -2    2    2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.326                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.6021    1.5818    0.7893   89.9748   90.0755   90.9223      0.2976
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.6092    1.5712    0.7911   90.0000   89.3261   90.0000      0.2902         2.0342    1.9862    5.5446    5.4139    2.7258
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0007    0.1141    0.0568    0.0000    2.0693    0.0000      0.0191         0.1468    0.0276    0.3649    0.5306    0.2654
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1056    0.1161   -0.6042)
 a2 = (    0.6030    0.1710   -0.0831)
 a3 = (    0.3000   -1.1977   -0.2843)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1136    0.1177   -0.5996) (    0.0039    0.0134    0.0028)
 a2 = (    0.6072    0.1725   -0.0812) (    0.0449    0.0119    0.0034)
 a3 = (    0.3028   -1.1958   -0.2766) (    0.0257    0.0900    0.0077)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.5366  103.3085   14.1189    0.4080    1.2254    0.3678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0254      0.0023    0.0023    0.0797

# Number of computed bands
            183            184
# Figure of merit at the beginning and the end of the refinement
         3.6665         3.7834
# Chi-squares at the beginning and the end of the refinement
    0.2966    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0693    0.0702
    2    0    2   -3   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1    0.1056    0.0995
    3   -2    0    3   -0.0249    0.0857   -0.0262    0.0895    0.0040    1    0.1032    0.0967
    4   -2    2   -2   -0.1896   -0.5812   -0.1957   -0.5833    0.0065    1    0.1086    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0682    0.0654
    6   -2    2    2   -0.1028    0.1165   -0.1085    0.1216    0.0076    1    0.0808    0.0778
    7   -2    0   -3    0.1206   -0.5886    0.1201   -0.5973    0.0087    1    0.1395    0.1302
    8    0   -2   -3    0.1430   -0.2208    0.1454   -0.2240    0.0040    1    0.1096    0.1017
    9   -2    4    1   -0.1901    0.0485   -0.1952    0.0486    0.0051    1    0.0817    0.0726
   10    0   -2   -1    0.2261   -0.1285    0.2251   -0.1274    0.0014    1    0.0489    0.0467
   11   -2   -2   -2    0.5288   -0.6039    0.5303   -0.6130    0.0092    1    0.1307    0.1248
   12   -2    6    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.1051    0.0984
   13    0   -6   -1    0.1994   -0.0087    0.1990   -0.0092    0.0006    1    0.1064    0.0927
   14   -2   -6   -2    0.5256   -0.1491    0.5293   -0.1451    0.0055    1    0.1580    0.1473
   15   -2    4   -1   -0.3321   -0.2358   -0.3362   -0.2357    0.0041    1    0.0918    0.0881
   16    0   -4    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0658    0.0679
   17   -2   -4   -1    0.7206   -0.0811    0.7293   -0.0807    0.0087    1    0.1214    0.1198
   18   -4   -4   -2    1.0401   -0.5008    1.0696   -0.4972    0.0297    1    0.2632    0.2483
   19    0   -6    1    0.0445    0.0298    0.0442    0.0295    0.0004    1    0.1027    0.0994
   20   -2   -6    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.1255    0.1178
   21    0    2   -1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0460    0.0568
   22   -2   -4    1    0.2955    0.3286    0.3053    0.3413    0.0161    1    0.0951    0.0899
   23   -2   -2    2    0.0354    0.2667    0.0347    0.2716    0.0051    1    0.0851    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2    0    2   -3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3   -2    0    3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4   -2    2   -2   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5    0    0   -2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6   -2    2    2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7   -2    0   -3    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8    0   -2   -3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9   -2    4    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10    0   -2   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -2   -2   -2    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12   -2    6    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13    0   -6   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14   -2   -6   -2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15   -2    4   -1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -4    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17   -2   -4   -1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18   -4   -4   -2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19    0   -6    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -2   -6    0    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21    0    2   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22   -2   -4    1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -2   -2    2    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.328                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3924    2.2570    0.6789   90.1973  110.3654   90.0191      0.5736
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3699    2.2480    0.6865   90.0000  108.9236   90.0000      0.2816         1.9955    3.2745    4.8651    7.9835    2.4381
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0071    0.0428    0.0121    0.0000    0.8704    0.0000      0.0185         0.0364    0.0758    0.3205    0.5459    0.1658
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3888    0.4494    0.4835)
 a2 = (    0.3562    0.0276    0.2620)
 a3 = (    0.1796    1.5106   -0.3933)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3949    0.4491    0.4877) (    0.0045    0.0055    0.0039)
 a2 = (    0.3571    0.0276    0.2638) (    0.0083    0.0034    0.0036)
 a3 = (    0.1901    1.4717   -0.4112) (    0.0157    0.0280    0.0105)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   46.8276  119.9310  159.3297    0.4341    0.5218    0.5400
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0020      0.0024    0.0026    0.0127

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.4014         3.4881
# Chi-squares at the beginning and the end of the refinement
    3.8143    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0672    0.0702
    2    1    1    1   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1030    0.0995
    3   -1    1   -1   -0.0240    0.0819   -0.0262    0.0895    0.0078    1    0.1004    0.0967
    4    2    4    1   -0.1906   -0.5809   -0.1957   -0.5833    0.0056    1    0.2115    0.1078
    5    2    0    1    0.0557   -0.2242    0.0560   -0.2234    0.0009    1    0.1325    0.0654
    6   -2    4   -1   -0.1023    0.1163   -0.1085    0.1216    0.0081    1    0.1568    0.0778
    7    4    2    1    0.1165   -0.5908    0.1201   -0.5973    0.0075    1    0.2709    0.1302
    8    3   -1    1    0.1087   -0.2292    0.1454   -0.2240    0.0370    1    0.1701    0.1017
    9   -1    3    0   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0786    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0465    0.0467
   11    2    0    0    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.1256    0.1248
   12   -1    5    1   -0.1463   -0.0746   -0.1829   -0.0381    0.0517    0    0.1356    0.0984
   13    3   -5   -1    0.1691    0.0162    0.1990   -0.0092    0.0392    1    0.1621    0.0927
   14    5   -3   -1    0.6087   -0.1246    0.5293   -0.1451    0.0820    1    0.2641    0.1473
   15    0    6    1   -0.3339   -0.2416   -0.3362   -0.2357    0.0063    1    0.1790    0.0881
   16    2   -4   -1    0.1201    0.0364    0.1275    0.0362    0.0074    1    0.1258    0.0679
   17    4   -2   -1    0.7302   -0.0692    0.7293   -0.0807    0.0116    1    0.2324    0.1198
   18    6    0   -1    1.0722   -0.5061    1.0696   -0.4972    0.0093    1    0.5220    0.2483
   19    1   -3   -1    0.0373    0.0260    0.0442    0.0295    0.0077    1    0.0988    0.0994
   20    2   -2   -1    0.4319    0.1725    0.4423    0.1634    0.0139    1    0.1190    0.1178
   21    0    2    1   -0.0359   -0.0630   -0.0341   -0.0579    0.0054    1    0.0896    0.0568
   22    1   -1   -1    0.2786    0.3281    0.3053    0.3413    0.0298    0    0.0909    0.0899
   23    0    0   -1    0.0305    0.2568    0.0347    0.2716    0.0155    1    0.0827    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7326   -0.0569   -0.7310   -0.0567    0.0016    1          0.0665          0.0702
    2    3    1    2    0.0215   -0.2072   -0.0130   -0.1762    0.0464    1          0.1123          0.0995
    3   -1   -1   -3    0.0107    0.0968   -0.0262    0.0895    0.0376    1          0.1212          0.0967
    4    2    4    1   -0.1958   -0.5865   -0.1957   -0.5833    0.0032    1          0.1032          0.1078
    5    2    0    1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6   -2    4   -1   -0.1077    0.1197   -0.1085    0.1216    0.0021    1          0.0765          0.0778
    7    4    2    1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1323          0.1302
    8    4   -2    1    0.1442   -0.2204    0.1454   -0.2240    0.0037    1          0.1031          0.1017
    9   -2    6    0   -0.1944    0.0482   -0.1952    0.0486    0.0009    1          0.0778          0.0726
   10    2   -2    0    0.2262   -0.1272    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    4    0    0    0.5375   -0.6116    0.5303   -0.6130    0.0073    1          0.1248          0.1248
   12   -1    5    1   -0.1425   -0.0702   -0.1829   -0.0381    0.0516    0          0.0664          0.0984
   13    4   -6   -1    0.1986   -0.0085    0.1990   -0.0092    0.0008    1          0.1007          0.0927
   14    6   -4   -1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1498          0.1473
   15    0    6    1   -0.3357   -0.2360   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    2   -4   -1    0.1272    0.0357    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    4   -2   -1    0.7286   -0.0794    0.7293   -0.0807    0.0015    1          0.1158          0.1198
   18    6    0   -1    1.0596   -0.5067    1.0696   -0.4972    0.0138    1          0.2544          0.2483
   19    0   -4   -3    0.0146    0.0325    0.0442    0.0295    0.0297    1          0.1203          0.0994
   20    4   -4   -2    0.4449    0.1647    0.4423    0.1634    0.0029    1          0.1191          0.1178
   21    0    2    1   -0.0333   -0.0567   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    2   -2   -2    0.3001    0.3340    0.3053    0.3413    0.0089    1          0.0903          0.0899
   23    0    0   -2    0.0355    0.2739    0.0347    0.2716    0.0024    1          0.0804          0.0816

###            No.329                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3819    2.2190    0.6917   90.8712  109.4192   89.1320      0.5799
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3738    2.2382    0.6897   90.0000  109.4201   90.0000      0.2775         1.9918    3.2452    4.9507    8.0659    2.4855
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0104    0.0502    0.0164    0.0000    1.2271    0.0000      0.0205         0.0454    0.0907    0.3683    0.6238    0.1933
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3838   -0.4506   -0.4883)
 a2 = (    0.3624    0.0281    0.2665)
 a3 = (   -0.1720   -1.4653    0.4163)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3919   -0.4536   -0.4862) (    0.0065    0.0087    0.0049)
 a2 = (    0.3596    0.0282    0.2636) (    0.0100    0.0036    0.0042)
 a3 = (   -0.1856   -1.4699    0.4103) (    0.0183    0.0346    0.0115)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -46.8724   59.6634  -20.8368    0.4794    0.8200    0.6074
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0010    0.0003   -0.0031      0.0025    0.0028    0.0168

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.4157         3.3427
# Chi-squares at the beginning and the end of the refinement
    4.4265    0.1218
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0691    0.0702
    2   -1    1   -1   -0.0134   -0.1731   -0.0130   -0.1762    0.0031    1    0.1017    0.0995
    3    1    1    1   -0.0287    0.0943   -0.0262    0.0895    0.0054    1    0.0998    0.0967
    4   -2    4   -1   -0.2021   -0.5865   -0.1957   -0.5833    0.0071    1    0.2139    0.1078
    5   -2    0   -1    0.0561   -0.2227    0.0560   -0.2234    0.0007    1    0.1316    0.0654
    6    2    4    1   -0.1116    0.1230   -0.1085    0.1216    0.0035    1    0.1584    0.0778
    7   -4    2   -1    0.1154   -0.6007    0.1201   -0.5973    0.0058    1    0.2739    0.1302
    8   -3   -1   -1    0.1096   -0.2277    0.1454   -0.2240    0.0360    1    0.1698    0.1017
    9    1    3    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0804    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0471    0.0467
   11   -2    0    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1287    0.1248
   12    1    5   -1   -0.1460   -0.0712   -0.1829   -0.0381    0.0496    0    0.1368    0.0984
   13   -3   -5    1    0.1738    0.0141    0.1990   -0.0092    0.0342    1    0.1644    0.0927
   14   -5   -3    1    0.6174   -0.1366    0.5293   -0.1451    0.0885    1    0.2708    0.1473
   15    0    6   -1   -0.3395   -0.2364   -0.3362   -0.2357    0.0033    1    0.1812    0.0881
   16   -2   -4    1    0.1267    0.0359    0.1275    0.0362    0.0009    1    0.1272    0.0679
   17   -4   -2    1    0.7452   -0.0860    0.7293   -0.0807    0.0167    1    0.2397    0.1198
   18   -5   -1    1    0.9638   -0.2983    1.0696   -0.4972    0.2252    1    0.3714    0.2483
   19   -1   -3    1    0.0442    0.0295    0.0442    0.0295    0.0000    1    0.0990    0.0994
   20   -2   -2    1    0.4536    0.1691    0.4423    0.1634    0.0126    1    0.1215    0.1178
   21    0    2   -1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0886    0.0568
   22   -1   -1    1    0.3035    0.3447    0.3053    0.3413    0.0038    1    0.0923    0.0899
   23    0    0    1    0.0329    0.2802    0.0347    0.2716    0.0088    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7298   -0.0576   -0.7310   -0.0567    0.0016    1          0.0652          0.0702
    2   -3    1   -2    0.0223   -0.2070   -0.0130   -0.1762    0.0469    1          0.1103          0.0995
    3    1   -1    3    0.0115    0.0972   -0.0262    0.0895    0.0384    1          0.1188          0.0967
    4   -2    4   -1   -0.1963   -0.5850   -0.1957   -0.5833    0.0017    1          0.1012          0.1078
    5   -2    0   -1    0.0571   -0.2234    0.0560   -0.2234    0.0012    1          0.0629          0.0654
    6    2    4    1   -0.1074    0.1202   -0.1085    0.1216    0.0017    1          0.0753          0.0778
    7   -4    2   -1    0.1192   -0.5959    0.1201   -0.5973    0.0017    1          0.1295          0.1302
    8   -4   -2   -1    0.1441   -0.2202    0.1454   -0.2240    0.0040    1          0.1012          0.1017
    9    2    6    0   -0.1945    0.0487   -0.1952    0.0486    0.0008    1          0.0765          0.0726
   10   -2   -2    0    0.2260   -0.1277    0.2251   -0.1274    0.0009    1          0.0452          0.0467
   11   -4    0    0    0.5329   -0.6159    0.5303   -0.6130    0.0039    1          0.1218          0.1248
   12    1    5   -1   -0.1428   -0.0704   -0.1829   -0.0381    0.0515    0          0.0652          0.0984
   13   -4   -6    1    0.1990   -0.0092    0.1990   -0.0092    0.0001    1          0.0986          0.0927
   14   -6   -4    1    0.5310   -0.1522    0.5293   -0.1451    0.0072    1          0.1464          0.1473
   15    0    6   -1   -0.3357   -0.2358   -0.3362   -0.2357    0.0006    1          0.0858          0.0881
   16   -2   -4    1    0.1278    0.0352    0.1275    0.0362    0.0010    1          0.0610          0.0679
   17   -4   -2    1    0.7326   -0.0856    0.7293   -0.0807    0.0058    1          0.1131          0.1198
   18   -6    0    1    1.0590   -0.5223    1.0696   -0.4972    0.0273    1          0.2486          0.2483
   19    0   -4    3    0.0155    0.0324    0.0442    0.0295    0.0289    1          0.1179          0.0994
   20   -4   -4    2    0.4489    0.1639    0.4423    0.1634    0.0066    1          0.1162          0.1178
   21    0    2   -1   -0.0327   -0.0572   -0.0341   -0.0579    0.0016    1          0.0424          0.0568
   22   -2   -2    2    0.3031    0.3364    0.3053    0.3413    0.0054    1          0.0881          0.0899
   23    0    0    2    0.0358    0.2753    0.0347    0.2716    0.0038    1          0.0787          0.0816

###            No.330                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3851    2.2323    0.6846   89.6691  109.1084   90.2110      0.5581
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3797    2.2465    0.6867   90.0000  110.0105   90.0000      0.2851         2.0090    3.2712    4.8399    7.8808    2.4091
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0088    0.0381    0.0118    0.0000    1.0021    0.0000      0.0200         0.0304    0.0663    0.3407    0.5684    0.1739
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5777    0.4003    0.2997)
 a2 = (    0.1296   -0.3599    0.2331)
 a3 = (    1.2388   -0.1371   -0.9146)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5853    0.4099    0.2906) (    0.0047    0.0051    0.0062)
 a2 = (    0.1327   -0.3550    0.2335) (    0.0038    0.0073    0.0033)
 a3 = (    1.2457   -0.1341   -0.9120) (    0.0201    0.0143    0.0173)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   35.6867  139.7735   63.7481    0.6903    0.4960    0.7495
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0003    0.0008   -0.0071      0.0028    0.0028    0.0171

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.5599         3.3186
# Chi-squares at the beginning and the end of the refinement
    4.4032    0.0298
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7509   -0.0429   -0.7310   -0.0567    0.0242    1    0.0666    0.0702
    2    3   -5   -1    0.0101   -0.2060   -0.0130   -0.1762    0.0378    1    0.1608    0.0995
    3    1    3    1   -0.0337    0.0125   -0.0262    0.0895    0.0773    0    0.1131    0.0967
    4    4   -2   -1   -0.1997   -0.6040   -0.1957   -0.5833    0.0211    1    0.2076    0.1078
    5    2   -4   -1    0.0582   -0.2298    0.0560   -0.2234    0.0068    1    0.1279    0.0654
    6    0    6    1   -0.1045    0.1191   -0.1085    0.1216    0.0046    1    0.1525    0.0778
    7    2   -2   -1    0.1253   -0.6062    0.1201   -0.5973    0.0102    1    0.1322    0.1302
    8    1   -3   -1    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1026    0.1017
    9    2    4    1   -0.1979    0.0527   -0.1952    0.0486    0.0049    1    0.1541    0.0726
   10    0   -2   -1    0.2255   -0.1290    0.2251   -0.1274    0.0016    1    0.0913    0.0467
   11    1   -1   -1    0.5423   -0.6155    0.5303   -0.6130    0.0123    1    0.1243    0.1248
   12    3    3    1   -0.2035    0.0010   -0.1829   -0.0381    0.0442    1    0.1718    0.0984
   13   -1   -1   -1    0.1957   -0.0097    0.1990   -0.0092    0.0033    1    0.0989    0.0927
   14    0   -2   -2    0.4400   -0.1598    0.5293   -0.1451    0.0906    1    0.1887    0.1473
   15    2    0    0   -0.3505   -0.2429   -0.3362   -0.2357    0.0160    1    0.0866    0.0881
   16   -2    0   -1    0.1223    0.0339    0.1275    0.0362    0.0057    1    0.1222    0.0679
   17    0    0   -1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1142    0.1198
   18    2    0   -3    1.0665   -0.5047    1.0696   -0.4972    0.0082    1    0.5133    0.2483
   19    0    4    1   -0.0057    0.0051    0.0442    0.0295    0.0555    1    0.1134    0.0994
   20   -1    1   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1167    0.1178
   21    1   -1    0   -0.0383   -0.0650   -0.0341   -0.0579    0.0082    1    0.0427    0.0568
   22   -2    4   -1    0.2947    0.3304    0.3053    0.3413    0.0152    1    0.1774    0.0899
   23   -1    3    0    0.0339    0.2657    0.0347    0.2716    0.0060    1    0.0794    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7311   -0.0567   -0.7310   -0.0567    0.0001    1          0.0663          0.0702
    2    4   -6   -1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1          0.0996          0.0995
    3   -1    7    1   -0.0593    0.1118   -0.0262    0.0895    0.0400    0          0.0852          0.0967
    4    4   -2   -1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1          0.1030          0.1078
    5    2   -4   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6    0    6    1   -0.1084    0.1191   -0.1085    0.1216    0.0024    1          0.0771          0.0778
    7    4   -4   -2    0.1218   -0.5969    0.1201   -0.5973    0.0017    1          0.1320          0.1302
    8    2   -6   -2    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1035          0.1017
    9    2    4    1   -0.1943    0.0475   -0.1952    0.0486    0.0014    1          0.0783          0.0726
   10    0   -2   -1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0463          0.0467
   11    2   -2   -2    0.5383   -0.6112    0.5303   -0.6130    0.0081    1          0.1241          0.1248
   12    4    2    1   -0.1801   -0.0380   -0.1829   -0.0381    0.0027    1          0.1006          0.0984
   13   -2   -2   -2    0.1983   -0.0088    0.1990   -0.0092    0.0007    1          0.1013          0.0927
   14    0   -2   -3    0.5297   -0.1481    0.5293   -0.1451    0.0030    1          0.1498          0.1473
   15    4    0    0   -0.3357   -0.2358   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16   -2    0   -1    0.1273    0.0354    0.1275    0.0362    0.0008    1          0.0627          0.0679
   17    0    0   -2    0.7285   -0.0793    0.7293   -0.0807    0.0017    1          0.1154          0.1198
   18    2    0   -3    1.0607   -0.5060    1.0696   -0.4972    0.0126    1          0.2521          0.2483
   19   -4    2   -1    0.0452    0.0295    0.0442    0.0295    0.0010    1          0.0976          0.0994
   20   -2    2   -2    0.4452    0.1647    0.4423    0.1634    0.0031    1          0.1193          0.1178
   21    3   -3    0   -0.0332   -0.0565   -0.0341   -0.0579    0.0017    1          0.0653          0.0568
   22   -2    4   -1    0.3003    0.3349    0.3053    0.3413    0.0081    1          0.0904          0.0899
   23   -2    6    0    0.0347    0.2746    0.0347    0.2716    0.0030    1          0.0807          0.0816

###            No.332                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3815    2.2329    0.6884   89.9435  109.6344   90.7253      0.6310
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3797    2.2465    0.6867   90.0000  110.0105   90.0000      0.2851         2.0090    3.2712    4.8399    7.8808    2.4091
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0088    0.0381    0.0118    0.0000    1.0021    0.0000      0.0200         0.0304    0.0663    0.3407    0.5684    0.1739
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5822   -0.4081   -0.2919)
 a2 = (    0.1289   -0.3608    0.2319)
 a3 = (   -1.2370    0.1369    0.9109)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5853   -0.4099   -0.2906) (    0.0047    0.0051    0.0062)
 a2 = (    0.1327   -0.3550    0.2335) (    0.0038    0.0073    0.0033)
 a3 = (   -1.2457    0.1341    0.9120) (    0.0201    0.0143    0.0173)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -35.6867   40.2265 -116.2519    0.6903    0.4960    0.7495
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0003    0.0008   -0.0071      0.0028    0.0028    0.0171

# Number of computed bands
            386            400
# Figure of merit at the beginning and the end of the refinement
         1.2977         3.3186
# Chi-squares at the beginning and the end of the refinement
    5.0845    0.0298
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7335   -0.0488   -0.7310   -0.0567    0.0082    1    0.0739    0.0702
    2   -3   -5    1    0.0084   -0.1977   -0.0130   -0.1762    0.0304    1    0.1826    0.0995
    3   -1    3   -1   -0.0307    0.0113   -0.0262    0.0895    0.0783    0    0.1278    0.0967
    4   -4   -2    1   -0.1951   -0.5829   -0.1957   -0.5833    0.0007    1    0.2317    0.1078
    5   -2   -4    1    0.0548   -0.2232    0.0560   -0.2234    0.0012    1    0.1448    0.0654
    6    0    6   -1   -0.1035    0.1185   -0.1085    0.1216    0.0059    1    0.1724    0.0778
    7   -2   -2    1    0.1169   -0.5925    0.1201   -0.5973    0.0058    1    0.1479    0.1302
    8   -1   -3    1    0.1415   -0.2210    0.1454   -0.2240    0.0049    1    0.1159    0.1017
    9   -2    4   -1   -0.1927    0.0505   -0.1952    0.0486    0.0031    1    0.1739    0.0726
   10    0   -2    1    0.2249   -0.1292    0.2251   -0.1274    0.0017    1    0.1031    0.0467
   11   -1   -1    1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1387    0.1248
   12   -3    3   -1   -0.1960   -0.0003   -0.1829   -0.0381    0.0400    1    0.1942    0.0984
   13    1   -1    1    0.1983   -0.0091    0.1990   -0.0092    0.0007    1    0.1122    0.0927
   14    0   -2    2    0.4388   -0.1599    0.5293   -0.1451    0.0917    1    0.2130    0.1473
   15   -2    0    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0975    0.0881
   16    2    0    1    0.1261    0.0357    0.1275    0.0362    0.0015    1    0.1391    0.0679
   17    0    0    1    0.7275   -0.0805    0.7293   -0.0807    0.0019    1    0.1286    0.1198
   18   -2    0    3    1.0570   -0.5093    1.0696   -0.4972    0.0175    1    0.5764    0.2483
   19    0    4   -1   -0.0053    0.0048    0.0442    0.0295    0.0553    1    0.1282    0.0994
   20    1    1    1    0.4417    0.1652    0.4423    0.1634    0.0019    1    0.1324    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0487    0.0568
   22    2    4    1    0.2935    0.3304    0.3053    0.3413    0.0161    1    0.2021    0.0899
   23    1    3    0    0.0349    0.2663    0.0347    0.2716    0.0053    1    0.0905    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7311   -0.0567   -0.7310   -0.0567    0.0001    1          0.0663          0.0702
    2   -4   -6    1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1          0.0996          0.0995
    3    1    7   -1   -0.0593    0.1118   -0.0262    0.0895    0.0400    0          0.0852          0.0967
    4   -4   -2    1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1          0.1030          0.1078
    5   -2   -4    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0643          0.0654
    6    0    6   -1   -0.1084    0.1191   -0.1085    0.1216    0.0024    1          0.0771          0.0778
    7   -4   -4    2    0.1218   -0.5969    0.1201   -0.5973    0.0017    1          0.1320          0.1302
    8   -2   -6    2    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1035          0.1017
    9   -2    4   -1   -0.1943    0.0475   -0.1952    0.0486    0.0014    1          0.0783          0.0726
   10    0   -2    1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0463          0.0467
   11   -2   -2    2    0.5383   -0.6112    0.5303   -0.6130    0.0081    1          0.1241          0.1248
   12   -4    2   -1   -0.1801   -0.0380   -0.1829   -0.0381    0.0027    1          0.1006          0.0984
   13    2   -2    2    0.1983   -0.0088    0.1990   -0.0092    0.0007    1          0.1013          0.0927
   14    0   -2    3    0.5297   -0.1481    0.5293   -0.1451    0.0030    1          0.1498          0.1473
   15   -4    0    0   -0.3357   -0.2358   -0.3362   -0.2357    0.0005    1          0.0875          0.0881
   16    2    0    1    0.1273    0.0354    0.1275    0.0362    0.0008    1          0.0627          0.0679
   17    0    0    2    0.7285   -0.0793    0.7293   -0.0807    0.0017    1          0.1154          0.1198
   18   -2    0    3    1.0607   -0.5060    1.0696   -0.4972    0.0126    1          0.2521          0.2483
   19    4    2    1    0.0452    0.0295    0.0442    0.0295    0.0010    1          0.0976          0.0994
   20    2    2    2    0.4452    0.1647    0.4423    0.1634    0.0031    1          0.1193          0.1178
   21   -3   -3    0   -0.0332   -0.0565   -0.0341   -0.0579    0.0017    1          0.0653          0.0568
   22    2    4    1    0.3003    0.3349    0.3053    0.3413    0.0081    1          0.0904          0.0899
   23    2    6    0    0.0347    0.2746    0.0347    0.2716    0.0030    1          0.0807          0.0816

###            No.337                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3781    2.2522    0.6833   90.1199  109.4386   90.0288      0.6691
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3731    2.2480    0.6850   90.0000  108.9238   90.0000      0.2816         2.0046    3.2820    4.8761    7.9834    2.4325
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0072    0.0519    0.0139    0.0000    0.8704    0.0000      0.0190         0.0366    0.0669    0.3307    0.5705    0.1717
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0934   -0.7364    0.2029)
 a2 = (   -0.3570   -0.0277   -0.2625)
 a3 = (    0.7870   -0.9097   -0.9806)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0950   -0.7358    0.2056) (    0.0075    0.0019    0.0053)
 a2 = (   -0.3571   -0.0276   -0.2638) (    0.0095    0.0035    0.0049)
 a3 = (    0.7897   -0.8982   -0.9754) (    0.0192    0.0168    0.0202)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  155.7568  139.4365   63.7556    0.6098    0.4599    0.7004
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0020      0.0024    0.0026    0.0127

# Number of computed bands
            334            400
# Figure of merit at the beginning and the end of the refinement
         1.2017         3.2780
# Chi-squares at the beginning and the end of the refinement
    5.8366    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0785    0.0702
    2   -3   -1   -1    0.0096   -0.2012   -0.0130   -0.1762    0.0337    1    0.1930    0.0995
    3    0   -4    1   -0.0278    0.0100   -0.0262    0.0895    0.0794    1    0.1358    0.0967
    4   -2   -4   -1   -0.1949   -0.5870   -0.1957   -0.5833    0.0038    1    0.2471    0.1078
    5   -2    0   -1    0.0572   -0.2268    0.0560   -0.2234    0.0037    1    0.1534    0.0654
    6    2   -4    1   -0.1040    0.1165   -0.1085    0.1216    0.0068    1    0.1822    0.0778
    7   -1   -1   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1580    0.1302
    8   -1    1   -1    0.1454   -0.2239    0.1454   -0.2240    0.0001    1    0.1232    0.1017
    9    0   -6    1   -0.1907    0.0484   -0.1952    0.0486    0.0045    1    0.1846    0.0726
   10    0    2   -1    0.2292   -0.1305    0.2251   -0.1274    0.0051    1    0.1099    0.0467
   11    0    0   -1    0.5334   -0.6165    0.5303   -0.6130    0.0046    1    0.1488    0.1248
   12   -1   -7    1   -0.1936   -0.0012   -0.1829   -0.0381    0.0384    0    0.2063    0.0984
   13    1    3   -1    0.2024   -0.0094    0.1990   -0.0092    0.0035    1    0.1195    0.0927
   14    1    3   -2    0.4435   -0.1619    0.5293   -0.1451    0.0875    1    0.2280    0.1473
   15   -1   -3    0   -0.3359   -0.2364   -0.3362   -0.2357    0.0007    1    0.1035    0.0881
   16    2    4   -1    0.1298    0.0364    0.1275    0.0362    0.0023    1    0.1477    0.0679
   17    1    1   -1    0.7341   -0.0864    0.7293   -0.0807    0.0074    1    0.1380    0.1198
   18    1    1   -2    0.7386   -0.3850    1.0696   -0.4972    0.3495    1    0.2917    0.2483
   19    1   -3    1   -0.0032    0.0028    0.0442    0.0295    0.0544    1    0.1358    0.0994
   20    2    2   -1    0.4499    0.1649    0.4423    0.1634    0.0077    1    0.1412    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0513    0.0568
   22    4    2   -1    0.3012    0.3360    0.3053    0.3413    0.0068    1    0.2143    0.0899
   23    2    0    0    0.0344    0.2712    0.0347    0.2716    0.0005    1    0.0952    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -4    0   -0.7326   -0.0569   -0.7310   -0.0567    0.0016    1          0.0665          0.0702
    2   -4   -2   -1   -0.0135   -0.1736   -0.0130   -0.1762    0.0026    1          0.0992          0.0995
    3    4   -2    1   -0.0268    0.0903   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4   -2   -4   -1   -0.1958   -0.5865   -0.1957   -0.5833    0.0032    1          0.1032          0.1078
    5   -2    0   -1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6    2   -4    1   -0.1077    0.1197   -0.1085    0.1216    0.0021    1          0.0765          0.0778
    7   -2   -2   -2    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1323          0.1302
    8   -2    2   -2    0.1442   -0.2204    0.1454   -0.2240    0.0037    1          0.1031          0.1017
    9    0   -6    1   -0.1944    0.0482   -0.1952    0.0486    0.0009    1          0.0778          0.0726
   10    0    2   -1    0.2262   -0.1272    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    0    0   -2    0.5375   -0.6116    0.5303   -0.6130    0.0073    1          0.1248          0.1248
   12   -1   -7    1   -0.1961   -0.0022   -0.1829   -0.0381    0.0383    0          0.0869          0.0984
   13    2    6   -2    0.1986   -0.0085    0.1990   -0.0092    0.0008    1          0.1007          0.0927
   14    2    4   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1498          0.1473
   15   -2   -6    0   -0.3357   -0.2360   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    2    4   -1    0.1272    0.0357    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    2    2   -2    0.7286   -0.0794    0.7293   -0.0807    0.0015    1          0.1158          0.1198
   18    2    0   -3    1.0596   -0.5067    1.0696   -0.4972    0.0138    1          0.2544          0.2483
   19    4    6   -1    0.0449    0.0296    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    4    4   -2    0.4449    0.1647    0.4423    0.1634    0.0029    1          0.1191          0.1178
   21   -3   -3    0   -0.0333   -0.0567   -0.0341   -0.0579    0.0015    1          0.0650          0.0568
   22    4    2   -1    0.3001    0.3341    0.3053    0.3413    0.0089    1          0.0903          0.0899
   23    4    0    0    0.0355    0.2739    0.0347    0.2716    0.0024    1          0.0804          0.0816

###            No.338                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3760    2.2332    0.6909   90.0398  109.5985   90.0628      0.7381
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3733    2.2482    0.6848   90.0000  108.9098   90.0000      0.2812         2.0054    3.2831    4.8841    7.9958    2.4354
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0073    0.0569    0.0142    0.0000    0.8913    0.0000      0.0194         0.0371    0.0720    0.3384    0.5881    0.1756
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0911    0.7383   -0.2043)
 a2 = (   -0.3605   -0.0279   -0.2641)
 a3 = (   -0.7809    0.9026    0.9675)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0951    0.7357   -0.2055) (    0.0075    0.0019    0.0053)
 a2 = (   -0.3571   -0.0276   -0.2638) (    0.0105    0.0036    0.0052)
 a3 = (   -0.7902    0.8981    0.9757) (    0.0197    0.0168    0.0210)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -155.7640   40.5735 -116.2414    0.6322    0.4759    0.7397
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0017      0.0024    0.0026    0.0129

# Number of computed bands
            268            400
# Figure of merit at the beginning and the end of the refinement
         1.1024         3.2733
# Chi-squares at the beginning and the end of the refinement
   13.4787    0.0296
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2    2    0    1    0.0556   -0.2209   -0.0130   -0.1762    0.0819    1    0.1684    0.0995
    3    0   -4   -1   -0.0356    0.0127   -0.0262    0.0895    0.0774    1    0.1503    0.0967
    4    2   -4    1   -0.1970   -0.5818   -0.1957   -0.5833    0.0020    1    0.2718    0.1078
    5    2    0    1    0.0556   -0.2209    0.0560   -0.2234    0.0025    1    0.1684    0.0654
    6   -2   -4   -1   -0.1091    0.1213   -0.1085    0.1216    0.0008    1    0.2022    0.0778
    7    1   -1    1    0.1169   -0.5925    0.1201   -0.5973    0.0058    1    0.1725    0.1302
    8    1    1    1    0.1415   -0.2172    0.1454   -0.2240    0.0078    1    0.1348    0.1017
    9    0   -6   -1   -0.1974    0.0493   -0.1952    0.0486    0.0023    1    0.2055    0.0726
   10    0    2    1    0.2219   -0.1251    0.2251   -0.1274    0.0040    1    0.1203    0.0467
   11    0    0    1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1618    0.1248
   12    1   -7   -1   -0.1994   -0.0018   -0.1829   -0.0381    0.0398    0    0.2297    0.0984
   13   -1    3    1    0.1939   -0.0080    0.1990   -0.0092    0.0052    1    0.1313    0.0927
   14   -1    3    2    0.4362   -0.1568    0.5293   -0.1451    0.0939    1    0.2485    0.1473
   15    1   -3    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16   -2    4    1    0.1229    0.0350    0.1275    0.0362    0.0047    1    0.1630    0.0679
   17   -1    1    1    0.7275   -0.0805    0.7293   -0.0807    0.0019    1    0.1500    0.1198
   18   -1    1    2    0.7354   -0.3795    1.0696   -0.4972    0.3542    1    0.3174    0.2483
   19   -1   -3   -1   -0.0093    0.0082    0.0442    0.0295    0.0576    1    0.1500    0.0994
   20   -2    2    1    0.4417    0.1652    0.4423    0.1634    0.0019    1    0.1545    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -4    2    1    0.2961    0.3342    0.3053    0.3413    0.0117    1    0.2359    0.0899
   23   -2    0    0    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -4    0   -0.7331   -0.0570   -0.7310   -0.0567    0.0021    1          0.0664          0.0702
    2    4   -2    1   -0.0135   -0.1739   -0.0130   -0.1762    0.0024    1          0.0990          0.0995
    3   -4   -2   -1   -0.0269    0.0903   -0.0262    0.0895    0.0011    1          0.0969          0.0967
    4    2   -4    1   -0.1959   -0.5871   -0.1957   -0.5833    0.0037    1          0.1031          0.1078
    5    2    0    1    0.0567   -0.2239    0.0560   -0.2234    0.0009    1          0.0640          0.0654
    6   -2   -4   -1   -0.1077    0.1197   -0.1085    0.1216    0.0021    1          0.0764          0.0778
    7    2   -2    2    0.1214   -0.5970    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    2    2    2    0.1443   -0.2206    0.1454   -0.2240    0.0036    1          0.1029          0.1017
    9    0   -6   -1   -0.1945    0.0482   -0.1952    0.0486    0.0008    1          0.0776          0.0726
   10    0    2    1    0.2263   -0.1272    0.2251   -0.1274    0.0013    1          0.0460          0.0467
   11    0    0    2    0.5379   -0.6117    0.5303   -0.6130    0.0077    1          0.1246          0.1248
   12    1   -7   -1   -0.1962   -0.0021   -0.1829   -0.0381    0.0383    0          0.0868          0.0984
   13   -2    6    2    0.1986   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14   -2    4    3    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    2   -6    0   -0.3360   -0.2362   -0.3362   -0.2357    0.0005    1          0.0872          0.0881
   16   -2    4    1    0.1272    0.0357    0.1275    0.0362    0.0005    1          0.0622          0.0679
   17   -2    2    2    0.7286   -0.0795    0.7293   -0.0807    0.0014    1          0.1156          0.1198
   18   -2    0    3    1.0597   -0.5065    1.0696   -0.4972    0.0136    1          0.2540          0.2483
   19   -4    6    1    0.0449    0.0295    0.0442    0.0295    0.0007    1          0.0969          0.0994
   20   -4    4    2    0.4450    0.1646    0.4423    0.1634    0.0029    1          0.1189          0.1178
   21    3   -3    0   -0.0334   -0.0568   -0.0341   -0.0579    0.0013    1          0.0648          0.0568
   22   -4    2    1    0.3002    0.3341    0.3053    0.3413    0.0089    1          0.0901          0.0899
   23   -4    0    0    0.0355    0.2739    0.0347    0.2716    0.0024    1          0.0803          0.0816

###            No.339                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4264    1.4252    0.9839   90.2067   90.6321   90.0414      0.4460
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4303    1.4352    0.9745   90.0000   91.3292   90.0000      0.3393         1.4677    1.4728    4.2155    4.2300    2.8722
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0020    0.0206    0.0958    0.0000    3.4357    0.0000      0.0448         0.1462    0.1523    0.5567    0.5619    0.4728
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5907    0.3344    0.1756)
 a2 = (   -0.3559   -0.6029   -0.0469)
 a3 = (    0.1750   -0.1842    0.9842)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5882    0.3315    0.1822) (    0.0047    0.0047    0.0197)
 a2 = (   -0.3524   -0.5991   -0.0478) (    0.0063    0.0089    0.0040)
 a3 = (    0.1765   -0.1832    0.9944) (    0.0177    0.0123    0.1055)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  104.7584   15.6309   45.3005    1.1727    1.6831    1.2416
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0405      0.0023    0.0023    0.1078

# Number of computed bands
            151            400
# Figure of merit at the beginning and the end of the refinement
         4.0522         3.2722
# Chi-squares at the beginning and the end of the refinement
    0.4198    0.0318
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0855    0.0702
    2    2   -4    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -3    3    1   -0.0286    0.0973   -0.0262    0.0895    0.0082    1    0.1217    0.0967
    4    1   -3    1   -0.1989   -0.5977   -0.1957   -0.5833    0.0147    1    0.1308    0.1078
    5    2   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -3    1    1   -0.1139    0.1281   -0.1085    0.1216    0.0085    1    0.0959    0.0778
    7    3   -3    1    0.1217   -0.6040    0.1201   -0.5973    0.0069    1    0.1669    0.1302
    8    4   -2    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -3   -1    1   -0.2058    0.0522   -0.1952    0.0486    0.0112    1    0.0973    0.0726
   10    2    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    3   -1    1    0.5428   -0.6218    0.5303   -0.6130    0.0152    1    0.1580    0.1248
   12   -3   -3    1   -0.1904   -0.0392   -0.1829   -0.0381    0.0076    1    0.1249    0.0984
   13    4    2    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    5    1    1    0.5364   -0.1514    0.5293   -0.1451    0.0095    1    0.1879    0.1473
   15   -1   -3    1   -0.3463   -0.2437   -0.3362   -0.2357    0.0129    1    0.1101    0.0881
   16    2    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17    3    1    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1463    0.1198
   18    4    0    2    1.0771   -0.5187    1.0696   -0.4972    0.0228    1    0.3268    0.2483
   19    2    4    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    3    3    1    0.4518    0.1678    0.4423    0.1634    0.0105    1    0.1493    0.1178
   21    0   -2    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1    3    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1136    0.0899
   23   -1    3    1    0.0366    0.2822    0.0347    0.2716    0.0107    1    0.1012    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    1   -0.7343   -0.0559   -0.7310   -0.0567    0.0034    1          0.0681          0.0702
    2    2   -4    0   -0.0131   -0.1736   -0.0130   -0.1762    0.0026    1          0.0978          0.0995
    3   -3    3    1   -0.0267    0.0898   -0.0262    0.0895    0.0006    1          0.0956          0.0967
    4    1   -3    1   -0.1944   -0.5868   -0.1957   -0.5833    0.0037    1          0.1047          0.1078
    5    2   -2    0    0.0566   -0.2232    0.0560   -0.2234    0.0007    1          0.0633          0.0654
    6   -3    1    1   -0.1072    0.1197   -0.1085    0.1216    0.0023    1          0.0754          0.0778
    7    3   -3    1    0.1212   -0.5953    0.1201   -0.5973    0.0023    1          0.1340          0.1302
    8    4   -2    0    0.1436   -0.2201    0.1454   -0.2240    0.0043    1          0.1020          0.1017
    9   -3   -1    1   -0.1948    0.0488   -0.1952    0.0486    0.0004    1          0.0765          0.0726
   10    2    0    0    0.2257   -0.1275    0.2251   -0.1274    0.0006    1          0.0455          0.0467
   11    3   -1    1    0.5359   -0.6118    0.5303   -0.6130    0.0057    1          0.1282          0.1248
   12   -3   -3    1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0982          0.0984
   13    4    2    0    0.1985   -0.0086    0.1990   -0.0092    0.0007    1          0.0989          0.0927
   14    5    1    1    0.5302   -0.1491    0.5293   -0.1451    0.0041    1          0.1508          0.1473
   15   -1   -3    1   -0.3364   -0.2373   -0.3362   -0.2357    0.0015    1          0.0871          0.0881
   16    2    2    0    0.1269    0.0357    0.1275    0.0362    0.0007    1          0.0610          0.0679
   17    3    1    1    0.7297   -0.0801    0.7293   -0.0807    0.0007    1          0.1183          0.1198
   18    5    1    2    0.8819   -0.2078    1.0696   -0.4972    0.3449    0          0.2395          0.2483
   19    2    4    0    0.0444    0.0293    0.0442    0.0295    0.0003    1          0.0949          0.0994
   20    3    3    1    0.4451    0.1655    0.4423    0.1634    0.0035    1          0.1191          0.1178
   21    0   -2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0425          0.0568
   22    1    3    1    0.2986    0.3348    0.3053    0.3413    0.0093    1          0.0902          0.0899
   23   -1    3    1    0.0347    0.2728    0.0347    0.2716    0.0011    1          0.0796          0.0816

###            No.340                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3623    2.2617    0.6883   90.1365  109.4389   90.1674      0.5504
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3701    2.2503    0.6860   90.0000  108.9858   90.0000      0.2813         1.9972    3.2802    4.8706    7.9995    2.4387
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0074    0.0542    0.0151    0.0000    0.9044    0.0000      0.0194         0.0391    0.0672    0.3373    0.5849    0.1767
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0976    0.7447   -0.2046)
 a2 = (   -0.3552   -0.0236   -0.2622)
 a3 = (   -0.7830    0.9051    0.9701)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0956    0.7380   -0.2048) (    0.0077    0.0021    0.0058)
 a2 = (   -0.3567   -0.0270   -0.2637) (    0.0098    0.0037    0.0051)
 a3 = (   -0.7884    0.8971    0.9746) (    0.0203    0.0177    0.0213)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -155.9040   40.5438 -116.1499    0.6639    0.4696    0.7472
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0034      0.0024    0.0027    0.0130

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.6615         3.2711
# Chi-squares at the beginning and the end of the refinement
    3.4549    0.0226
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7348   -0.0489   -0.7310   -0.0567    0.0087    1    0.0645    0.0702
    2    3   -1    1    0.0083   -0.1952   -0.0130   -0.1762    0.0286    1    0.1588    0.0995
    3   -3   -3   -1   -0.0566    0.1115   -0.0262    0.0895    0.0376    1    0.1670    0.0967
    4    2   -4    1   -0.1947   -0.5816   -0.1957   -0.5833    0.0020    1    0.2012    0.1078
    5    2    0    1    0.0542   -0.2210    0.0560   -0.2234    0.0030    1    0.1260    0.0654
    6   -2   -4   -1   -0.1051    0.1203   -0.1085    0.1216    0.0036    1    0.1503    0.0778
    7    1   -1    1    0.1166   -0.5911    0.1201   -0.5973    0.0071    1    0.1286    0.1302
    8    1    1    1    0.1405   -0.2196    0.1454   -0.2240    0.0066    1    0.1008    0.1017
    9    0   -6   -1   -0.1936    0.0507   -0.1952    0.0486    0.0026    1    0.1515    0.0726
   10    0    2    1    0.2244   -0.1289    0.2251   -0.1274    0.0016    1    0.0898    0.0467
   11    0    0    1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1209    0.1248
   12    1   -7   -1   -0.1962   -0.0003   -0.1829   -0.0381    0.0401    0    0.1691    0.0984
   13   -1    3    1    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.0978    0.0927
   14   -1    3    2    0.4393   -0.1601    0.5293   -0.1451    0.0913    1    0.1855    0.1473
   15    1   -3    0   -0.3354   -0.2352   -0.3362   -0.2357    0.0010    1    0.0848    0.0881
   16   -2    4    1    0.1275    0.0361    0.1275    0.0362    0.0001    1    0.1212    0.0679
   17   -1    1    1    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.1123    0.1198
   18   -2    0    3    1.0588   -0.5101    1.0696   -0.4972    0.0169    1    0.5006    0.2483
   19   -1   -3   -1   -0.0066    0.0060    0.0442    0.0295    0.0560    1    0.1116    0.0994
   20   -2    2    1    0.4441    0.1661    0.4423    0.1634    0.0032    1    0.1157    0.1178
   21    1   -1    0   -0.0328   -0.0557   -0.0341   -0.0579    0.0026    1    0.0424    0.0568
   22   -4    2    1    0.2959    0.3331    0.3053    0.3413    0.0125    1    0.1766    0.0899
   23   -2    0    0    0.0354    0.2701    0.0347    0.2716    0.0017    1    0.0791    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -4    0   -0.7325   -0.0561   -0.7310   -0.0567    0.0016    1          0.0665          0.0702
    2    4   -2    1   -0.0135   -0.1739   -0.0130   -0.1762    0.0024    1          0.0994          0.0995
    3   -4   -2   -1   -0.0264    0.0893   -0.0262    0.0895    0.0003    1          0.0973          0.0967
    4    2   -4    1   -0.1955   -0.5859   -0.1957   -0.5833    0.0025    1          0.1033          0.1078
    5    2    0    1    0.0563   -0.2238    0.0560   -0.2234    0.0005    1          0.0642          0.0654
    6   -2   -4   -1   -0.1069    0.1192   -0.1085    0.1216    0.0028    1          0.0766          0.0778
    7    2   -2    2    0.1206   -0.5960    0.1201   -0.5973    0.0014    1          0.1323          0.1302
    8    2    2    2    0.1437   -0.2206    0.1454   -0.2240    0.0038    1          0.1031          0.1017
    9    0   -6   -1   -0.1944    0.0482   -0.1952    0.0486    0.0009    1          0.0777          0.0726
   10    0    2    1    0.2258   -0.1273    0.2251   -0.1274    0.0007    1          0.0461          0.0467
   11    0    0    2    0.5370   -0.6115    0.5303   -0.6130    0.0068    1          0.1247          0.1248
   12    1   -7   -1   -0.1963   -0.0024   -0.1829   -0.0381    0.0381    0          0.0869          0.0984
   13   -2    6    2    0.1979   -0.0086    0.1990   -0.0092    0.0012    1          0.1006          0.0927
   14   -2    4    3    0.5294   -0.1478    0.5293   -0.1451    0.0027    1          0.1496          0.1473
   15    2   -6    0   -0.3354   -0.2364   -0.3362   -0.2357    0.0011    1          0.0874          0.0881
   16   -2    4    1    0.1263    0.0354    0.1275    0.0362    0.0014    1          0.0623          0.0679
   17   -2    2    2    0.7275   -0.0781    0.7293   -0.0807    0.0032    1          0.1156          0.1198
   18   -2    0    3    1.0601   -0.5046    1.0696   -0.4972    0.0120    1          0.2544          0.2483
   19   -4    6    1    0.0442    0.0288    0.0442    0.0295    0.0007    1          0.0971          0.0994
   20   -4    4    2    0.4427    0.1648    0.4423    0.1634    0.0015    1          0.1190          0.1178
   21    3   -3    0   -0.0334   -0.0575   -0.0341   -0.0579    0.0008    1          0.0651          0.0568
   22   -4    2    1    0.2975    0.3322    0.3053    0.3413    0.0120    1          0.0903          0.0899
   23   -4    0    0    0.0354    0.2714    0.0347    0.2716    0.0007    1          0.0806          0.0816

###            No.343                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    2.0819    0.9806    0.9798   89.9994   90.6437   90.4213      0.2787
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    2.0924    0.9778    0.9778   90.0000   91.2755   90.0000      0.2464         2.1399    1.0000    8.4934    3.9690    3.9690
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0029    0.1060    0.1019    0.0000    3.5655    0.0000      0.0172         0.2201    0.0147    0.5942    0.5120    0.4980
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0817    0.0886   -0.4650)
 a2 = (    0.5167    0.8766    0.0684)
 a3 = (    0.8599   -0.4868   -0.2556)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0814    0.0861   -0.4631) (    0.0147    0.0065    0.0037)
 a2 = (    0.5220    0.8766    0.0713) (    0.0555    0.0963    0.0058)
 a3 = (    0.8582   -0.4894   -0.2654) (    0.0944    0.0557    0.0064)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -85.8856  103.7631   60.2080    0.3516    1.9306    0.4026
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0022   -0.0026    0.0029      0.0026    0.0023    0.1160

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         3.0437         3.2664
# Chi-squares at the beginning and the end of the refinement
    0.7694    0.4736
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -3    1    1   -0.7405   -0.0567   -0.7310   -0.0567    0.0095    1    0.0753    0.0702
    2    0    4   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1127    0.0995
    3   -3   -1    4   -0.0492    0.0480   -0.0262    0.0895    0.0474    1    0.1068    0.0967
    4   -3    3   -1   -0.1928   -0.5877   -0.1957   -0.5833    0.0053    1    0.1169    0.1078
    5    0    2   -2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0728    0.0654
    6   -3   -1    3   -0.1068    0.1204   -0.1085    0.1216    0.0020    1    0.0866    0.0778
    7   -3    3   -3    0.1218   -0.5939    0.1201   -0.5973    0.0038    1    0.1499    0.1302
    8    0    2   -4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1170    0.1017
    9   -3    1    3   -0.1958    0.0498   -0.1952    0.0486    0.0013    1    0.0877    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0522    0.0467
   11   -3    1   -3    0.5338   -0.6082    0.5303   -0.6130    0.0059    1    0.1407    0.1248
   12   -3    3    3   -0.1827   -0.0377   -0.1829   -0.0381    0.0003    1    0.1127    0.0984
   13    0   -2   -4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1137    0.0927
   14   -3   -1   -4    0.6045   -0.1311    0.5293   -0.1451    0.0765    0    0.1482    0.1473
   15   -3    3    1   -0.3377   -0.2388   -0.3362   -0.2357    0.0034    1    0.0988    0.0881
   16    0   -2   -2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0703    0.0679
   17   -3   -1   -3    0.7252   -0.0809    0.7293   -0.0807    0.0042    1    0.1305    0.1198
   18   -6    0   -4    1.0505   -0.5043    1.0696   -0.4972    0.0204    1    0.2855    0.2483
   19    1   -3   -3    0.0215    0.0055    0.0442    0.0295    0.0330    1    0.1043    0.0994
   20   -3   -3   -3    0.4432    0.1637    0.4423    0.1634    0.0009    1    0.1344    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0491    0.0568
   22   -3   -3   -1    0.2983    0.3319    0.3053    0.3413    0.0117    1    0.1019    0.0899
   23   -3   -3    1    0.0357    0.2715    0.0347    0.2716    0.0011    1    0.0911    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -3    1    1   -0.7269   -0.0552   -0.7310   -0.0567    0.0044    1          0.0660          0.0702
    2    0    4   -2   -0.0127   -0.1776   -0.0130   -0.1762    0.0014    1          0.1004          0.0995
    3   -3   -1    4   -0.0392    0.0431   -0.0262    0.0895    0.0481    1          0.0943          0.0967
    4   -3    3   -1   -0.1929   -0.5838   -0.1957   -0.5833    0.0028    1          0.1043          0.1078
    5    0    2   -2    0.0592   -0.2291    0.0560   -0.2234    0.0066    1          0.0649          0.0654
    6   -3   -1    3   -0.0970    0.1150   -0.1085    0.1216    0.0132    1          0.0762          0.0778
    7   -3    3   -3    0.1215   -0.5967    0.1201   -0.5973    0.0015    1          0.1343          0.1302
    8    0    2   -4    0.1494   -0.2262    0.1454   -0.2240    0.0046    1          0.1044          0.1017
    9   -3    1    3   -0.1841    0.0500   -0.1952    0.0486    0.0112    1          0.0773          0.0726
   10    0    0   -2    0.2348   -0.1301    0.2251   -0.1274    0.0101    1          0.0466          0.0467
   11   -3    1   -3    0.5359   -0.6133    0.5303   -0.6130    0.0056    1          0.1264          0.1248
   12   -4    2    4   -0.1891    0.0244   -0.1829   -0.0381    0.0628    1          0.1085          0.0984
   13    0   -2   -4    0.2064   -0.0068    0.1990   -0.0092    0.0079    1          0.1013          0.0927
   14   -3   -1   -4    0.6117   -0.1326    0.5293   -0.1451    0.0833    0          0.1327          0.1473
   15   -3    3    1   -0.3316   -0.2329   -0.3362   -0.2357    0.0054    1          0.0875          0.0881
   16    0   -2   -2    0.1322    0.0390    0.1275    0.0362    0.0055    1          0.0625          0.0679
   17   -3   -1   -3    0.7313   -0.0827    0.7293   -0.0807    0.0027    1          0.1169          0.1198
   18   -6    0   -4    1.0514   -0.5109    1.0696   -0.4972    0.0228    1          0.2555          0.2483
   19    1   -3   -3    0.0286    0.0093    0.0442    0.0295    0.0255    1          0.0927          0.0994
   20   -3   -3   -4    0.4540    0.0910    0.4423    0.1634    0.0734    1          0.1377          0.1178
   21    0    2    0   -0.0334   -0.0573   -0.0341   -0.0579    0.0010    1          0.0436          0.0568
   22   -3   -3   -1    0.3003    0.3306    0.3053    0.3413    0.0118    1          0.0902          0.0899
   23   -3   -3    1    0.0384    0.2663    0.0347    0.2716    0.0065    1          0.0803          0.0816

###            No.345                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3747    2.2398    0.6893   90.1428  109.5586   90.0404      0.3977
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3723    2.2615    0.6784   90.0000  108.2146   90.0000      0.2877         2.0229    3.3336    4.7707    7.8617    2.3583
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0450    0.0120    0.0000    0.8731    0.0000      0.0189         0.0372    0.0799    0.3142    0.5394    0.1604
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3918    0.4529    0.4872)
 a2 = (    0.3590    0.0278    0.2640)
 a3 = (    0.1875    1.4740   -0.4028)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3929    0.4477    0.4833) (    0.0045    0.0055    0.0039)
 a2 = (    0.3538    0.0256    0.2640) (    0.0086    0.0033    0.0037)
 a3 = (    0.2114    1.4770   -0.4265) (    0.0159    0.0284    0.0098)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   46.5470  119.7801  158.9341    0.4389    0.5234    0.5426
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0017    0.0096    0.0023      0.0023    0.0027    0.0127

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         2.3623         3.2518
# Chi-squares at the beginning and the end of the refinement
    1.4819    0.6833
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0469    0.0702
    2    1    1    1   -0.0140   -0.1771   -0.0130   -0.1762    0.0014    1    0.0702    0.0995
    3   -1    1   -1   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.0685    0.0967
    4    2    4    1   -0.1978   -0.5867   -0.1957   -0.5833    0.0039    1    0.1464    0.1078
    5    2    0    1    0.0566   -0.2260    0.0560   -0.2234    0.0027    1    0.0908    0.0654
    6   -2    4   -1   -0.1061    0.1185   -0.1085    0.1216    0.0039    1    0.1082    0.0778
    7    4    2    1    0.1183   -0.5973    0.1201   -0.5973    0.0018    1    0.1875    0.1302
    8    3   -1    1    0.1106   -0.2302    0.1454   -0.2240    0.0354    1    0.1170    0.1017
    9   -1    3    0   -0.1952    0.0491   -0.1952    0.0486    0.0005    1    0.0549    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0325    0.0467
   11    2    0    0    0.5323   -0.6152    0.5303   -0.6130    0.0030    1    0.0877    0.1248
   12   -1    5    1   -0.1462   -0.0715   -0.1829   -0.0381    0.0496    0    0.0940    0.0984
   13    3   -5   -1    0.1712    0.0138    0.1990   -0.0092    0.0360    1    0.1132    0.0927
   14    6   -4   -1    0.5283   -0.1505    0.5293   -0.1451    0.0054    1    0.2107    0.1473
   15    0    6    1   -0.3383   -0.2371   -0.3362   -0.2357    0.0025    1    0.1239    0.0881
   16    2   -4   -1    0.1236    0.0349    0.1275    0.0362    0.0041    1    0.0876    0.0679
   17    4   -2   -1    0.7280   -0.0830    0.7293   -0.0807    0.0026    1    0.1624    0.1198
   18    6    0   -1    1.0567   -0.5176    1.0696   -0.4972    0.0241    1    0.3593    0.2483
   19    1   -3   -1    0.0409    0.0273    0.0442    0.0295    0.0040    1    0.0683    0.0994
   20    2   -2   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0832    0.1178
   21    0    2    1   -0.0359   -0.0606   -0.0341   -0.0579    0.0032    1    0.0612    0.0568
   22    1   -1   -1    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0630    0.0899
   23    0    0   -1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0565    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7387   -0.0631   -0.7310   -0.0567    0.0100    1          0.0681          0.0702
    2    3    1    2    0.0201   -0.2066   -0.0130   -0.1762    0.0450    1          0.1141          0.0995
    3   -2    2   -2   -0.0267    0.0912   -0.0262    0.0895    0.0018    1          0.0995          0.0967
    4    2    4    1   -0.1943   -0.5865   -0.1957   -0.5833    0.0034    1          0.1042          0.1078
    5    2    0    1    0.0537   -0.2242    0.0560   -0.2234    0.0024    1          0.0650          0.0654
    6   -2    4   -1   -0.1106    0.1185   -0.1085    0.1216    0.0037    1          0.0781          0.0778
    7    4    2    1    0.1175   -0.5985    0.1201   -0.5973    0.0029    1          0.1334          0.1302
    8    4   -2    1    0.1399   -0.2245    0.1454   -0.2240    0.0056    1          0.1043          0.1017
    9   -2    6    0   -0.1970    0.0411   -0.1952    0.0486    0.0077    1          0.0792          0.0726
   10    2   -2    0    0.2239   -0.1352    0.2251   -0.1274    0.0079    1          0.0467          0.0467
   11    4    0    0    0.5357   -0.6181    0.5303   -0.6130    0.0074    1          0.1262          0.1248
   12   -1    5    1   -0.1375   -0.0775   -0.1829   -0.0381    0.0601    0          0.0678          0.0984
   13    4   -6   -1    0.1997   -0.0178    0.1990   -0.0092    0.0086    1          0.1027          0.0927
   14    6   -4   -1    0.5296   -0.1563    0.5293   -0.1451    0.0112    1          0.1525          0.1473
   15    0    6    1   -0.3307   -0.2418   -0.3362   -0.2357    0.0082    1          0.0888          0.0881
   16    2   -4   -1    0.1309    0.0270    0.1275    0.0362    0.0098    1          0.0638          0.0679
   17    4   -2   -1    0.7275   -0.0862    0.7293   -0.0807    0.0058    1          0.1181          0.1198
   18    6    0   -1    1.0593   -0.5075    1.0696   -0.4972    0.0146    1          0.2584          0.2483
   19    0   -4   -3    0.0202    0.0313    0.0442    0.0295    0.0240    1          0.1238          0.0994
   20    4   -4   -2    0.4468    0.1555    0.4423    0.1634    0.0090    1          0.1225          0.1178
   21    0    2    1   -0.0275   -0.0582   -0.0341   -0.0579    0.0066    1          0.0444          0.0568
   22    2   -2   -2    0.3058    0.3251    0.3053    0.3413    0.0162    1          0.0935          0.0899
   23    0    0   -2    0.0422    0.2727    0.0347    0.2716    0.0075    1          0.0832          0.0816

###            No.346                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3683    2.2439    0.6880   90.8253  108.7338   88.8437      0.4666
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3723    2.2615    0.6784   90.0000  108.2146   90.0000      0.2877         2.0229    3.3336    4.7707    7.8617    2.3583
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0450    0.0120    0.0000    0.8731    0.0000      0.0189         0.0372    0.0799    0.3142    0.5394    0.1604
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3911   -0.4498   -0.4904)
 a2 = (    0.3545    0.0277    0.2688)
 a3 = (   -0.1870   -1.4647    0.4189)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3929   -0.4477   -0.4833) (    0.0045    0.0055    0.0039)
 a2 = (    0.3538    0.0256    0.2640) (    0.0086    0.0033    0.0037)
 a3 = (   -0.2114   -1.4770    0.4265) (    0.0159    0.0284    0.0098)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -46.5470   60.2199  -21.0659    0.4389    0.5234    0.5426
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0017    0.0096    0.0023      0.0023    0.0027    0.0127

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.8821         3.2518
# Chi-squares at the beginning and the end of the refinement
    1.9242    0.6833
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7536   -0.0589   -0.7310   -0.0567    0.0227    1    0.0562    0.0702
    2   -1    1   -1   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.0817    0.0995
    3    1    1    1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0801    0.0967
    4   -2    4   -1   -0.1980   -0.5956   -0.1957   -0.5833    0.0124    1    0.1726    0.1078
    5   -2    0   -1    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.1057    0.0654
    6    2    4    1   -0.1132    0.1267   -0.1085    0.1216    0.0069    1    0.1266    0.0778
    7   -4    2   -1    0.1213   -0.6023    0.1201   -0.5973    0.0051    1    0.2206    0.1302
    8   -3   -1   -1    0.1099   -0.2283    0.1454   -0.2240    0.0358    1    0.1363    0.1017
    9    1    3    0   -0.2042    0.0515   -0.1952    0.0486    0.0095    1    0.0642    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0378    0.0467
   11   -2    0    0    0.5398   -0.6209    0.5303   -0.6130    0.0124    1    0.1039    0.1248
   12    1    5   -1   -0.1490   -0.0731   -0.1829   -0.0381    0.0487    0    0.1095    0.0984
   13   -3   -5    1    0.1732    0.0140    0.1990   -0.0092    0.0346    1    0.1320    0.0927
   14   -6   -4    1    0.5353   -0.1522    0.5293   -0.1451    0.0093    1    0.2485    0.1473
   15    0    6   -1   -0.3447   -0.2429   -0.3362   -0.2357    0.0111    1    0.1454    0.0881
   16   -2   -4    1    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.1021    0.0679
   17   -4   -2    1    0.7396   -0.0839    0.7293   -0.0807    0.0107    1    0.1930    0.1198
   18   -6    0    1    1.0723   -0.5224    1.0696   -0.4972    0.0254    1    0.4323    0.2483
   19   -1   -3    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.0795    0.0994
   20   -2   -2    1    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.0982    0.1178
   21    0    2   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0712    0.0568
   22   -1   -1    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0746    0.0899
   23    0    0    1    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0665    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7387   -0.0631   -0.7310   -0.0567    0.0100    1          0.0681          0.0702
    2   -3    1   -2    0.0201   -0.2066   -0.0130   -0.1762    0.0450    1          0.1141          0.0995
    3    2    2    2   -0.0267    0.0912   -0.0262    0.0895    0.0018    1          0.0995          0.0967
    4   -2    4   -1   -0.1943   -0.5865   -0.1957   -0.5833    0.0034    1          0.1042          0.1078
    5   -2    0   -1    0.0537   -0.2242    0.0560   -0.2234    0.0024    1          0.0650          0.0654
    6    2    4    1   -0.1106    0.1185   -0.1085    0.1216    0.0037    1          0.0781          0.0778
    7   -4    2   -1    0.1175   -0.5985    0.1201   -0.5973    0.0029    1          0.1334          0.1302
    8   -4   -2   -1    0.1399   -0.2245    0.1454   -0.2240    0.0056    1          0.1043          0.1017
    9    2    6    0   -0.1970    0.0411   -0.1952    0.0486    0.0077    1          0.0792          0.0726
   10   -2   -2    0    0.2239   -0.1352    0.2251   -0.1274    0.0079    1          0.0467          0.0467
   11   -4    0    0    0.5357   -0.6181    0.5303   -0.6130    0.0074    1          0.1262          0.1248
   12    1    5   -1   -0.1375   -0.0775   -0.1829   -0.0381    0.0601    0          0.0678          0.0984
   13   -4   -6    1    0.1997   -0.0178    0.1990   -0.0092    0.0086    1          0.1027          0.0927
   14   -6   -4    1    0.5296   -0.1563    0.5293   -0.1451    0.0112    1          0.1525          0.1473
   15    0    6   -1   -0.3307   -0.2418   -0.3362   -0.2357    0.0082    1          0.0888          0.0881
   16   -2   -4    1    0.1309    0.0270    0.1275    0.0362    0.0098    1          0.0638          0.0679
   17   -4   -2    1    0.7275   -0.0862    0.7293   -0.0807    0.0058    1          0.1181          0.1198
   18   -6    0    1    1.0593   -0.5075    1.0696   -0.4972    0.0146    1          0.2584          0.2483
   19    0   -4    3    0.0202    0.0313    0.0442    0.0295    0.0240    1          0.1238          0.0994
   20   -4   -4    2    0.4468    0.1555    0.4423    0.1634    0.0090    1          0.1225          0.1178
   21    0    2   -1   -0.0275   -0.0582   -0.0341   -0.0579    0.0066    1          0.0444          0.0568
   22   -2   -2    2    0.3058    0.3251    0.3053    0.3413    0.0162    1          0.0935          0.0899
   23    0    0    2    0.0422    0.2727    0.0347    0.2716    0.0075    1          0.0832          0.0816

###            No.347                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3588    2.2452    0.6944   90.0414  109.2625   89.8763      0.4554
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3648    2.2658    0.6910   90.0000  110.6220   90.0000      0.2828         1.9749    3.2787    4.8264    8.0126    2.4438
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0515    0.2418    0.0680    0.0000    5.7403    0.0000      0.0212         0.1232    0.0639    0.4048    1.0448    0.3021
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2726   -0.1024   -0.7231)
 a2 = (   -0.2257   -0.3828   -0.0299)
 a3 = (   -0.9600    0.6435   -0.9956)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2599   -0.0949   -0.7323) (    0.0238    0.0176    0.0107)
 a2 = (   -0.2231   -0.3796   -0.0300) (    0.0231    0.0412    0.0025)
 a3 = (   -0.9717    0.6508   -1.0114) (    0.1213    0.0625    0.0187)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -94.1509  110.2966 -121.8824    0.3401    2.2892    0.4182
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002    0.0233      0.0032    0.0024    0.1181

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         2.0039         3.2499
# Chi-squares at the beginning and the end of the refinement
    0.8680    0.1149
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2   -1   -0.7422   -0.0642   -0.7310   -0.0567    0.0135    1    0.1076    0.0702
    2   -2   -6    1    0.0096   -0.1998   -0.0130   -0.1762    0.0327    0    0.1309    0.0995
    3    1    3   -1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.0783    0.0967
    4   -1   -3    0   -0.1901   -0.5883   -0.1957   -0.5833    0.0075    1    0.0836    0.1078
    5   -2   -4    1    0.0570   -0.2252    0.0560   -0.2234    0.0021    1    0.1040    0.0654
    6    1    1   -1   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0615    0.0778
    7   -4   -6    1    0.1235   -0.5941    0.1201   -0.5973    0.0047    1    0.2153    0.1302
    8   -2   -2    1    0.1448   -0.2217    0.1454   -0.2240    0.0023    1    0.0835    0.1017
    9    1   -1   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0624    0.0726
   10   -2    0    1    0.2272   -0.1281    0.2251   -0.1274    0.0022    1    0.0746    0.0467
   11   -4   -2    1    0.5335   -0.6067    0.5303   -0.6130    0.0070    1    0.2021    0.1248
   12    1   -3   -1   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.0804    0.0984
   13   -2    2    1    0.1995   -0.0084    0.1990   -0.0092    0.0009    1    0.0813    0.0927
   14   -3    1    1    0.5285   -0.1498    0.5293   -0.1451    0.0048    1    0.1212    0.1473
   15    0   -6   -1   -0.3361   -0.2402   -0.3362   -0.2357    0.0045    1    0.1412    0.0881
   16   -2    4    1    0.1273    0.0361    0.1275    0.0362    0.0002    1    0.1006    0.0679
   17   -4    2    1    0.7248   -0.0833    0.7293   -0.0807    0.0052    1    0.1875    0.1198
   18   -6    0    1    1.0430   -0.5055    1.0696   -0.4972    0.0279    1    0.4103    0.2483
   19   -2    6    1    0.0755    0.0383    0.0442    0.0295    0.0326    0    0.1270    0.0994
   20   -4    6    1    0.4451    0.1626    0.4423    0.1634    0.0029    1    0.1930    0.1178
   21    0   -4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0700    0.0568
   22   -1    3    0    0.3014    0.3320    0.3053    0.3413    0.0101    1    0.0728    0.0899
   23    0    6   -1    0.0365    0.2727    0.0347    0.2716    0.0021    1    0.1297    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2   -1   -0.7334   -0.0563   -0.7310   -0.0567    0.0024    1          0.0694          0.0702
    2   -2   -6    1    0.0099   -0.1980   -0.0130   -0.1762    0.0317    0          0.0825          0.0995
    3    3    7   -3   -0.0456    0.1050   -0.0262    0.0895    0.0249    1          0.1358          0.0967
    4   -2   -6    0   -0.1943   -0.5865   -0.1957   -0.5833    0.0035    1          0.1072          0.1078
    5   -2   -4    1    0.0568   -0.2231    0.0560   -0.2234    0.0009    1          0.0656          0.0654
    6    2    2   -2   -0.1072    0.1197   -0.1085    0.1216    0.0023    1          0.0783          0.0778
    7   -4   -6    1    0.1212   -0.5949    0.1201   -0.5973    0.0026    1          0.1372          0.1302
    8   -4   -6    2    0.0952   -0.2288    0.1454   -0.2240    0.0505    1          0.1172          0.1017
    9    2   -2   -2   -0.1949    0.0489   -0.1952    0.0486    0.0004    1          0.0794          0.0726
   10   -2    0    1    0.2255   -0.1272    0.2251   -0.1274    0.0005    1          0.0471          0.0467
   11   -4   -2    1    0.5351   -0.6118    0.5303   -0.6130    0.0049    1          0.1303          0.1248
   12    2   -4   -2   -0.1971   -0.0018   -0.1829   -0.0381    0.0389    1          0.0886          0.0984
   13   -4    4    2    0.1982   -0.0085    0.1990   -0.0092    0.0010    1          0.1025          0.0927
   14   -6    2    2    0.5299   -0.1494    0.5293   -0.1451    0.0043    1          0.1546          0.1473
   15    0   -6   -1   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0898          0.0881
   16   -2    4    1    0.1266    0.0357    0.1275    0.0362    0.0010    1          0.0633          0.0679
   17   -4    2    1    0.7298   -0.0808    0.7293   -0.0807    0.0004    1          0.1205          0.1198
   18   -6    0    1    1.0592   -0.5108    1.0696   -0.4972    0.0171    1          0.2692          0.2483
   19   -2    6    1    0.0753    0.0379    0.0442    0.0295    0.0322    0          0.0798          0.0994
   20   -4    6    1    0.4453    0.1655    0.4423    0.1634    0.0036    1          0.1224          0.1178
   21    0   -6    0   -0.0334   -0.0575   -0.0341   -0.0579    0.0008    1          0.0662          0.0568
   22   -2    6    0    0.2987    0.3351    0.3053    0.3413    0.0090    1          0.0927          0.0899
   23    0    6   -1    0.0344    0.2728    0.0347    0.2716    0.0012    1          0.0823          0.0816

###            No.354                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3631    2.2762    0.6901   90.7514  110.8815   90.7386      0.4546
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3641    2.2673    0.6914   90.0000  110.7251   90.0000      0.2820         1.9730    3.2794    4.8370    8.0398    2.4516
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0516    0.2416    0.0679    0.0000    5.7250    0.0000      0.0211         0.1227    0.0638    0.4051    1.0462    0.3026
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2699    0.0847    0.7326)
 a2 = (   -0.2226   -0.3777   -0.0295)
 a3 = (    0.9520   -0.6751    1.0218)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2598    0.0947    0.7334) (    0.0237    0.0175    0.0106)
 a2 = (   -0.2230   -0.3794   -0.0300) (    0.0230    0.0411    0.0025)
 a3 = (    0.9708   -0.6506    1.0128) (    0.1210    0.0623    0.0186)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   94.1542   69.7439   58.1169    0.3396    2.2806    0.4182
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002    0.0254      0.0032    0.0024    0.1176

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.8933         3.2313
# Chi-squares at the beginning and the end of the refinement
    1.3977    0.1151
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    1   -0.7709   -0.0443   -0.7310   -0.0567    0.0418    0    0.1104    0.0702
    2    2   -6   -1    0.0100   -0.1989   -0.0130   -0.1762    0.0323    0    0.1292    0.0995
    3   -1    3    1   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0783    0.0967
    4    1   -3    0   -0.1991   -0.6091   -0.1957   -0.5833    0.0260    1    0.0839    0.1078
    5    2   -4   -1    0.0571   -0.2237    0.0560   -0.2234    0.0012    1    0.1027    0.0654
    6   -1    1    1   -0.1132    0.1289   -0.1085    0.1216    0.0087    1    0.0618    0.0778
    7    4   -6   -1    0.1290   -0.6084    0.1201   -0.5973    0.0142    1    0.2150    0.1302
    8    2   -2   -1    0.1438   -0.2199    0.1454   -0.2240    0.0044    1    0.0826    0.1017
    9   -1   -1    1   -0.2062    0.0545   -0.1952    0.0486    0.0125    1    0.0624    0.0726
   10    2    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0738    0.0467
   11    4   -2   -1    0.5527   -0.6165    0.5303   -0.6130    0.0226    1    0.2039    0.1248
   12   -1   -3    1   -0.1923   -0.0380   -0.1829   -0.0381    0.0095    1    0.0797    0.0984
   13    2    2   -1    0.1981   -0.0091    0.1990   -0.0092    0.0009    1    0.0803    0.0927
   14    3    1   -1    0.5364   -0.1491    0.5293   -0.1451    0.0081    1    0.1208    0.1473
   15    0   -6    1   -0.3531   -0.2456   -0.3362   -0.2357    0.0196    1    0.1407    0.0881
   16    2    4   -1    0.1267    0.0354    0.1275    0.0362    0.0011    1    0.0992    0.0679
   17    4    2   -1    0.7388   -0.0771    0.7293   -0.0807    0.0101    1    0.1887    0.1198
   18    6    0   -1    1.0828   -0.4983    1.0696   -0.4972    0.0133    1    0.4223    0.2483
   19    2    6   -1    0.0752    0.0378    0.0442    0.0295    0.0321    0    0.1251    0.0994
   20    4    6   -1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1928    0.1178
   21    0   -4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0690    0.0568
   22    1    3    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0731    0.0899
   23    0    6    1    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.1305    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    1   -0.7335   -0.0563   -0.7310   -0.0567    0.0025    1          0.0695          0.0702
    2    2   -6   -1    0.0099   -0.1980   -0.0130   -0.1762    0.0316    0          0.0824          0.0995
    3   -3    7    3   -0.0456    0.1050   -0.0262    0.0895    0.0249    1          0.1356          0.0967
    4    2   -6    0   -0.1943   -0.5865   -0.1957   -0.5833    0.0035    1          0.1072          0.1078
    5    2   -4   -1    0.0568   -0.2231    0.0560   -0.2234    0.0009    1          0.0656          0.0654
    6   -2    2    2   -0.1072    0.1197   -0.1085    0.1216    0.0023    1          0.0782          0.0778
    7    4   -6   -1    0.1212   -0.5949    0.1201   -0.5973    0.0026    1          0.1373          0.1302
    8    4   -6   -2    0.0951   -0.2288    0.1454   -0.2240    0.0505    1          0.1170          0.1017
    9   -2   -2    2   -0.1949    0.0489   -0.1952    0.0486    0.0004    1          0.0793          0.0726
   10    2    0   -1    0.2255   -0.1272    0.2251   -0.1274    0.0005    1          0.0471          0.0467
   11    4   -2   -1    0.5351   -0.6118    0.5303   -0.6130    0.0050    1          0.1304          0.1248
   12   -2   -4    2   -0.1970   -0.0018   -0.1829   -0.0381    0.0389    1          0.0885          0.0984
   13    4    4   -2    0.1982   -0.0086    0.1990   -0.0092    0.0010    1          0.1024          0.0927
   14    6    2   -2    0.5299   -0.1493    0.5293   -0.1451    0.0043    1          0.1546          0.1473
   15    0   -6    1   -0.3364   -0.2373   -0.3362   -0.2357    0.0016    1          0.0898          0.0881
   16    2    4   -1    0.1267    0.0357    0.1275    0.0362    0.0009    1          0.0632          0.0679
   17    4    2   -1    0.7298   -0.0807    0.7293   -0.0807    0.0004    1          0.1206          0.1198
   18    6    0   -1    1.0594   -0.5106    1.0696   -0.4972    0.0169    1          0.2698          0.2483
   19    2    6   -1    0.0753    0.0379    0.0442    0.0295    0.0322    0          0.0797          0.0994
   20    4    6   -1    0.4453    0.1655    0.4423    0.1634    0.0036    1          0.1224          0.1178
   21    0   -6    0   -0.0334   -0.0575   -0.0341   -0.0579    0.0008    1          0.0661          0.0568
   22    2    6    0    0.2987    0.3351    0.3053    0.3413    0.0090    1          0.0927          0.0899
   23    0    6    1    0.0344    0.2728    0.0347    0.2716    0.0012    1          0.0823          0.0816

###            No.355                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9989    1.4061    1.4244   90.6316   91.2690   89.7908      0.5121
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9408    1.4788    1.4382   90.0000   88.2706   90.0000      0.3373         0.6542    1.0282    2.7894    4.3844    4.2641
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0017    0.1521    0.1420    0.0000    3.4164    0.0000      0.0221         0.0635    0.0145    0.1831    0.5350    0.5056
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2040   -0.1910    0.9616)
 a2 = (   -0.3537   -0.6150   -0.0497)
 a3 = (    0.5917   -0.3350   -0.1759)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1834   -0.1907    1.0300) (    0.0303    0.0138    0.0078)
 a2 = (   -0.3441   -0.5803   -0.0462) (    0.0346    0.0605    0.0040)
 a3 = (    0.5828   -0.3307   -0.1867) (    0.0609    0.0356    0.0051)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   94.0346  103.8415   60.3021    0.3113    1.7995    0.3890
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0013    0.0073    0.0892      0.0023    0.0023    0.1004

# Number of computed bands
            127            400
# Figure of merit at the beginning and the end of the refinement
         2.9769         3.2250
# Chi-squares at the beginning and the end of the refinement
    1.9323    0.8376
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0956    0.0702
    2    0   -2   -1   -0.0129   -0.1749   -0.0130   -0.1762    0.0013    1    0.0723    0.0995
    3    1    3    3   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1417    0.0967
    4    1   -3   -1   -0.1964   -0.5802   -0.1957   -0.5833    0.0032    1    0.1493    0.1078
    5    0   -2   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0932    0.0654
    6    1    1    3   -0.1055    0.1175   -0.1085    0.1216    0.0050    1    0.1112    0.0778
    7    1   -3   -3    0.1139   -0.5942    0.1201   -0.5973    0.0069    1    0.1909    0.1302
    8    0   -2   -3    0.1091   -0.2284    0.1454   -0.2240    0.0366    1    0.1198    0.1017
    9    1   -1    3   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1124    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0330    0.0467
   11    1   -1   -3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1791    0.1248
   12    1   -3    3   -0.1834   -0.0392   -0.1829   -0.0381    0.0012    1    0.1444    0.0984
   13    0    2   -3    0.1711    0.0155    0.1990   -0.0092    0.0372    1    0.1147    0.0927
   14    1    1   -5    0.5345   -0.1494    0.5293   -0.1451    0.0068    1    0.2135    0.1473
   15    1   -3    1   -0.3345   -0.2377   -0.3362   -0.2357    0.0026    1    0.1268    0.0881
   16    0    2   -2    0.1227    0.0364    0.1275    0.0362    0.0048    1    0.0890    0.0679
   17    1    1   -3    0.7400   -0.0765    0.7293   -0.0807    0.0115    1    0.1653    0.1198
   18    2    0   -4    1.0821   -0.5292    1.0696   -0.4972    0.0344    1    0.3721    0.2483
   19    0    2   -1    0.0400    0.0275    0.0442    0.0295    0.0047    1    0.0697    0.0994
   20    1    3   -3    0.4414    0.1729    0.4423    0.1634    0.0096    1    0.1691    0.1178
   21    0   -2    0   -0.0349   -0.0607   -0.0341   -0.0579    0.0028    1    0.0629    0.0568
   22    1    3   -1    0.2868    0.3368    0.3053    0.3413    0.0190    1    0.1287    0.0899
   23    1    3    1    0.0297    0.2652    0.0347    0.2716    0.0081    1    0.1165    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7263   -0.0459   -0.7310   -0.0567    0.0118    1          0.0737          0.0702
    2    0   -6   -2   -0.0283   -0.1439   -0.0130   -0.1762    0.0357    1          0.1388          0.0995
    3    1    3    3   -0.0277    0.0870   -0.0262    0.0895    0.0029    1          0.0983          0.0967
    4    1   -3   -1   -0.1970   -0.5968   -0.1957   -0.5833    0.0136    1          0.1113          0.1078
    5    0   -2   -2    0.0584   -0.2252    0.0560   -0.2234    0.0031    1          0.0650          0.0654
    6    1    1    3   -0.1075    0.1135   -0.1085    0.1216    0.0081    1          0.0785          0.0778
    7    1   -3   -3    0.1257   -0.6005    0.1201   -0.5973    0.0064    1          0.1423          0.1302
    8    0   -2   -4    0.1430   -0.2214    0.1454   -0.2240    0.0036    1          0.1055          0.1017
    9    1   -1    3   -0.1917    0.0438   -0.1952    0.0486    0.0060    1          0.0798          0.0726
   10    0    0   -2    0.2220   -0.1325    0.2251   -0.1274    0.0060    1          0.0473          0.0467
   11    1   -1   -3    0.5365   -0.6129    0.5303   -0.6130    0.0062    1          0.1393          0.1248
   12    1   -3    3   -0.1792   -0.0413   -0.1829   -0.0381    0.0049    1          0.1011          0.0984
   13    0    2   -4    0.1981   -0.0179    0.1990   -0.0092    0.0088    1          0.1023          0.0927
   14    1    1   -5    0.5260   -0.1579    0.5293   -0.1451    0.0132    1          0.1603          0.1473
   15    1   -3    1   -0.3393   -0.2383   -0.3362   -0.2357    0.0040    1          0.0907          0.0881
   16    0    2   -2    0.1301    0.0273    0.1275    0.0362    0.0092    1          0.0626          0.0679
   17    1    1   -3    0.7281   -0.0915    0.7293   -0.0807    0.0108    1          0.1282          0.1198
   18    2    0   -5    0.8580   -0.4351    1.0696   -0.4972    0.2205    0          0.2760          0.2483
   19    0    6   -2    0.0167    0.0061    0.0442    0.0295    0.0361    1          0.1357          0.0994
   20    1    3   -3    0.4514    0.1555    0.4423    0.1634    0.0120    1          0.1258          0.1178
   21    0   -4    0   -0.0305   -0.0610   -0.0341   -0.0579    0.0048    1          0.0858          0.0568
   22    1    3   -1    0.3061    0.3334    0.3053    0.3413    0.0079    1          0.0950          0.0899
   23    1    3    1    0.0343    0.2725    0.0347    0.2716    0.0009    1          0.0825          0.0816

###            No.356                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2600    1.7868    1.0889   90.0862  125.3368   89.9852      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2346    1.8111    1.0883   90.0000  124.7222   90.0000      0.3015         1.1344    1.6642    4.0950    6.0074    3.6097
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0120    0.0354    0.0161    0.0000    0.8048    0.0000      0.0203         0.0140    0.0293    0.2789    0.4217    0.2491
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7782    0.0904    0.5768)
 a2 = (    0.1670   -0.4448    0.2958)
 a3 = (   -0.0426    0.6102    0.9450)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7949    0.0901    0.5755) (    0.0046    0.0081    0.0059)
 a2 = (    0.1609   -0.4406    0.2913) (    0.0054    0.0100    0.0041)
 a3 = (   -0.0412    0.6056    0.9388) (    0.0120    0.0115    0.0111)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   47.9071   51.8999  139.2000    0.4894    0.4941    0.5128
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0083   -0.0004   -0.0161      0.0024    0.0023    0.0145

# Number of computed bands
            179            202
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.2204
# Chi-squares at the beginning and the end of the refinement
    1.2806    0.8859
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    2   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2   -1   -5    3    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    0    4   -1   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4   -2   -2    4   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    0   -4    2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -2    6    0   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    0   -2    2    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    1   -3    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -2    2    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    2   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -2    2    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12   -3    1    2   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13    3   -1   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    3   -1    0    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15   -4    0    4   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    4    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    4    0    0    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18    2    0    1    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19    5    1   -3    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    3    1   -1    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21   -2   -2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    2    2   -1    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23    2    6   -2    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    2   -0.7306   -0.0588   -0.7310   -0.0567    0.0022    1          0.0867          0.0702
    2   -1   -5    3   -0.0014   -0.2023   -0.0130   -0.1762    0.0286    1          0.1064          0.0995
    3    0    4   -1   -0.0342    0.0899   -0.0262    0.0895    0.0080    1          0.0636          0.0967
    4   -2   -2    4   -0.2148   -0.5844   -0.1957   -0.5833    0.0192    1          0.1360          0.1078
    5    0   -4    2    0.0479   -0.2295    0.0560   -0.2234    0.0101    1          0.0845          0.0654
    6   -1    3    0   -0.1151    0.1184   -0.1085    0.1216    0.0073    1          0.0503          0.0778
    7    0   -2    2    0.1089   -0.6060    0.1201   -0.5973    0.0142    1          0.0871          0.1302
    8    1   -3    1    0.1395   -0.2257    0.1454   -0.2240    0.0061    1          0.0681          0.1017
    9   -2    2    1   -0.1982    0.0466   -0.1952    0.0486    0.0036    1          0.0518          0.0726
   10    1   -1    0    0.2227   -0.1279    0.2251   -0.1274    0.0024    1          0.0307          0.0467
   11    1   -1    1    0.5340   -0.6176    0.5303   -0.6130    0.0059    1          0.0820          0.1248
   12   -3    1    2   -0.1836   -0.0352   -0.1829   -0.0381    0.0029    1          0.0671          0.0984
   13    3   -1   -1    0.1927   -0.0081    0.1990   -0.0092    0.0063    1          0.0677          0.0927
   14    3   -1    0    0.5232   -0.1480    0.5293   -0.1451    0.0068    1          0.0993          0.1473
   15   -2    0    2   -0.3420   -0.2279   -0.3362   -0.2357    0.0097    1          0.0580          0.0881
   16    4    0   -2    0.1211    0.0359    0.1275    0.0362    0.0064    1          0.0841          0.0679
   17    4    0    0    0.7180   -0.0819    0.7293   -0.0807    0.0114    1          0.1528          0.1198
   18    2    0    1    1.0484   -0.5087    1.0696   -0.4972    0.0241    1          0.1647          0.2483
   19    5    1   -3    0.0699    0.0387    0.0442    0.0295    0.0273    1          0.1060          0.0994
   20    3    1   -1    0.4376    0.1589    0.4423    0.1634    0.0065    1          0.0793          0.1178
   21   -2   -2    2   -0.0426   -0.0550   -0.0341   -0.0579    0.0089    1          0.0577          0.0568
   22    2    2   -1    0.3001    0.3288    0.3053    0.3413    0.0136    1          0.0598          0.0899
   23    1    3   -1    0.0325    0.2766    0.0347    0.2716    0.0055    1          0.0528          0.0816

###            No.357                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2613    1.7773    1.0914   90.2958  125.1671   89.8708      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2346    1.8111    1.0853   90.0000  124.4970   90.0000      0.3015         1.1375    1.6687    4.0953    6.0078    3.6003
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0102    0.0310    0.0180    0.0000    0.6891    0.0000      0.0204         0.0164    0.0345    0.2796    0.4200    0.2512
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7346   -0.5150   -0.3684)
 a2 = (   -0.1667    0.4485   -0.2960)
 a3 = (    0.0430   -0.6011   -0.9451)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7538   -0.5155   -0.3634) (    0.0057    0.0063    0.0065)
 a2 = (   -0.1609    0.4406   -0.2913) (    0.0045    0.0090    0.0039)
 a3 = (    0.0412   -0.6056   -0.9388) (    0.0126    0.0110    0.0138)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -144.9743  139.8968   62.5645    0.5754    0.4682    0.6841
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0083   -0.0004   -0.0161      0.0024    0.0023    0.0145

# Number of computed bands
            173            203
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.2147
# Chi-squares at the beginning and the end of the refinement
    1.2538    0.8859
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2   -1    5   -2    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    0   -4    1   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4   -2    2   -2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    4   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -2   -6    2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    0    2   -2    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8    1    3   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -2   -2    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    2    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2    2   -4    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12   -3   -1    1   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    3    1   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    3    1   -3    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15   -4    0    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    4    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    4    0   -4    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    2    0   -3    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    5   -1   -2    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    3   -1   -2    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21   -2    2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    2   -2   -1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    2   -6    0    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    0   -0.7306   -0.0588   -0.7310   -0.0567    0.0022    1          0.0867          0.0702
    2   -1    5   -2   -0.0014   -0.2023   -0.0130   -0.1762    0.0286    1          0.1064          0.0995
    3    0   -4    1   -0.0342    0.0899   -0.0262    0.0895    0.0080    1          0.0636          0.0967
    4   -2    2   -2   -0.2148   -0.5844   -0.1957   -0.5833    0.0191    1          0.1360          0.1078
    5    0    4   -2    0.0479   -0.2295    0.0560   -0.2234    0.0101    1          0.0845          0.0654
    6   -1   -3    1   -0.1151    0.1184   -0.1085    0.1216    0.0073    1          0.0503          0.0778
    7    0    2   -2    0.1089   -0.6060    0.1201   -0.5973    0.0142    1          0.0871          0.1302
    8    1    3   -2    0.1395   -0.2257    0.1454   -0.2240    0.0061    1          0.0681          0.1017
    9   -2   -2    1   -0.1982    0.0466   -0.1952    0.0486    0.0036    1          0.0518          0.0726
   10    1    1   -1    0.2227   -0.1279    0.2251   -0.1274    0.0024    1          0.0307          0.0467
   11    1    1   -2    0.5340   -0.6176    0.5303   -0.6130    0.0059    1          0.0820          0.1248
   12   -3   -1    1   -0.1836   -0.0352   -0.1829   -0.0381    0.0029    1          0.0671          0.0984
   13    3    1   -2    0.1927   -0.0081    0.1990   -0.0092    0.0063    1          0.0677          0.0927
   14    3    1   -3    0.5232   -0.1480    0.5293   -0.1451    0.0068    1          0.0993          0.1473
   15   -2    0    0   -0.3420   -0.2279   -0.3362   -0.2357    0.0097    1          0.0580          0.0881
   16    4    0   -2    0.1211    0.0359    0.1275    0.0362    0.0064    1          0.0841          0.0679
   17    4    0   -4    0.7180   -0.0819    0.7293   -0.0807    0.0114    1          0.1528          0.1198
   18    2    0   -3    1.0485   -0.5087    1.0696   -0.4972    0.0241    1          0.1647          0.2483
   19    5   -1   -2    0.0699    0.0387    0.0442    0.0295    0.0273    1          0.1060          0.0994
   20    3   -1   -2    0.4376    0.1589    0.4423    0.1634    0.0065    1          0.0793          0.1178
   21   -2    2    0   -0.0426   -0.0550   -0.0341   -0.0579    0.0089    1          0.0577          0.0568
   22    2   -2   -1    0.3001    0.3288    0.3053    0.3413    0.0136    1          0.0598          0.0899
   23    1   -3    0    0.0325    0.2766    0.0347    0.2716    0.0055    1          0.0528          0.0816

###            No.358                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3984    2.2029    0.6887   89.5213  109.4715   90.5041      0.5710
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3768    2.2474    0.6866   90.0000  109.7177   90.0000      0.2824         2.0053    3.2732    4.8759    7.9589    2.4316
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0079    0.0424    0.0104    0.0000    0.9167    0.0000      0.0188         0.0299    0.0559    0.3255    0.5503    0.1658
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6032   -0.0581   -0.4561)
 a2 = (   -0.1394    0.3623   -0.2354)
 a3 = (    1.1666    0.8179    0.5850)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6197   -0.0672   -0.4546) (    0.0037    0.0063    0.0048)
 a2 = (   -0.1320    0.3556   -0.2326) (    0.0043    0.0078    0.0031)
 a3 = (    1.1715    0.8206    0.5897) (    0.0202    0.0162    0.0125)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -131.5728   51.9674  139.0231    0.4960    0.4993    0.5278
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0014    0.0007   -0.0017      0.0026    0.0024    0.0148

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.5277         3.2129
# Chi-squares at the beginning and the end of the refinement
    3.0039    0.1558
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    1   -0.7274   -0.0469   -0.7310   -0.0567    0.0104    1    0.1349    0.0702
    2   -1    3    1   -0.0126   -0.1698   -0.0130   -0.1762    0.0064    1    0.1009    0.0995
    3    1   -5   -1   -0.0025    0.0504   -0.0262    0.0895    0.0457    0    0.1328    0.0967
    4   -1    1    1   -0.1994   -0.5824   -0.1957   -0.5833    0.0038    1    0.1041    0.1078
    5   -2    4    1    0.0550   -0.2194    0.0560   -0.2234    0.0041    1    0.1301    0.0654
    6    1   -3    0   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0783    0.0778
    7   -2    2    1    0.1146   -0.5968    0.1201   -0.5973    0.0055    1    0.1330    0.1302
    8   -3    5    1    0.1078   -0.2255    0.1454   -0.2240    0.0377    1    0.1675    0.1017
    9    2   -4    1   -0.1968    0.0502   -0.1952    0.0486    0.0023    1    0.1581    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0461    0.0467
   11   -4    2    1    0.5399   -0.6284    0.5303   -0.6130    0.0181    1    0.2530    0.1248
   12    1   -1    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1008    0.0984
   13   -3    1   -1    0.1744    0.0157    0.1990   -0.0092    0.0349    1    0.1610    0.0927
   14   -3    1    0    0.5403   -0.1488    0.5293   -0.1451    0.0116    1    0.1497    0.1473
   15    0    0    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0884    0.0881
   16   -2    0   -1    0.1268    0.0375    0.1275    0.0362    0.0015    1    0.1248    0.0679
   17   -2    0    0    0.7492   -0.0722    0.7293   -0.0807    0.0216    1    0.1167    0.1198
   18   -5    1    1    0.8549   -0.6322    1.0696   -0.4972    0.2536    0    0.3822    0.2483
   19   -1   -1   -1    0.0443    0.0305    0.0442    0.0295    0.0009    1    0.0976    0.0994
   20   -4   -2   -1    0.4476    0.1776    0.4423    0.1634    0.0152    1    0.2398    0.1178
   21    0    2    1   -0.0320   -0.0557   -0.0341   -0.0579    0.0031    1    0.0879    0.0568
   22   -2   -4   -1    0.2907    0.3444    0.3053    0.3413    0.0149    1    0.1829    0.0899
   23    0   -6   -1    0.0301    0.2732    0.0347    0.2716    0.0048    1    0.1652    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    1   -0.7304   -0.0564   -0.7310   -0.0567    0.0007    1          0.0664          0.0702
    2   -2    6    2   -0.0126   -0.1772   -0.0130   -0.1762    0.0011    1          0.0996          0.0995
    3    3   -7    0   -0.0477    0.0468   -0.0262    0.0895    0.0477    0          0.0945          0.0967
    4   -2    2    2   -0.1968   -0.5878   -0.1957   -0.5833    0.0045    1          0.1034          0.1078
    5   -2    4    1    0.0579   -0.2261    0.0560   -0.2234    0.0034    1          0.0642          0.0654
    6    2   -6    0   -0.1053    0.1185   -0.1085    0.1216    0.0045    1          0.0766          0.0778
    7   -4    4    2    0.1205   -0.5985    0.1201   -0.5973    0.0012    1          0.1322          0.1302
    8   -4    6    1    0.1454   -0.2217    0.1454   -0.2240    0.0023    1          0.1031          0.1017
    9    2   -4    1   -0.1944    0.0484   -0.1952    0.0486    0.0008    1          0.0779          0.0726
   10   -2    2    0    0.2262   -0.1271    0.2251   -0.1274    0.0012    1          0.0460          0.0467
   11   -4    2    1    0.5369   -0.6143    0.5303   -0.6130    0.0067    1          0.1241          0.1248
   12    2   -2    2   -0.1822   -0.0386   -0.1829   -0.0381    0.0008    1          0.1003          0.0984
   13   -4    2   -1    0.1965   -0.0086    0.1990   -0.0092    0.0025    1          0.1004          0.0927
   14   -7    3    0    0.4770   -0.1551    0.5293   -0.1451    0.0532    1          0.1688          0.1473
   15    0    0    2   -0.3369   -0.2376   -0.3362   -0.2357    0.0020    1          0.0877          0.0881
   16   -2    0   -1    0.1242    0.0343    0.1275    0.0362    0.0037    1          0.0622          0.0679
   17   -4    0    0    0.7278   -0.0795    0.7293   -0.0807    0.0020    1          0.1146          0.1198
   18   -6    0    1    1.0615   -0.5101    1.0696   -0.4972    0.0153    1          0.2523          0.2483
   19    0   -6   -2    0.0216    0.0484    0.0442    0.0295    0.0294    1          0.0993          0.0994
   20   -4   -2   -1    0.4413    0.1634    0.4423    0.1634    0.0010    1          0.1181          0.1178
   21    0    2    1   -0.0343   -0.0610   -0.0341   -0.0579    0.0031    1          0.0434          0.0568
   22   -2   -4   -1    0.2964    0.3297    0.3053    0.3413    0.0146    1          0.0895          0.0899
   23    0   -6   -1    0.0359    0.2681    0.0347    0.2716    0.0038    1          0.0802          0.0816

###            No.359                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3628    2.2568    0.6882   89.8685  109.0762   91.1133      0.5657
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3675    2.2662    0.6798   90.0000  108.3164   90.0000      0.2845         2.0117    3.3336    4.8061    7.9643    2.3891
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0069    0.0441    0.0120    0.0000    0.8712    0.0000      0.0187         0.0368    0.0793    0.3165    0.5455    0.1625
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3947    0.4562    0.4890)
 a2 = (    0.3522    0.0334    0.2670)
 a3 = (    0.1873    1.4672   -0.4197)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3949    0.4489    0.4857) (    0.0046    0.0055    0.0039)
 a2 = (    0.3530    0.0254    0.2635) (    0.0084    0.0033    0.0036)
 a3 = (    0.2089    1.4762   -0.4222) (    0.0159    0.0282    0.0105)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   46.5544  119.7186  158.9651    0.4392    0.5220    0.5438
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0091    0.0038      0.0023    0.0026    0.0127

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.4498         3.1974
# Chi-squares at the beginning and the end of the refinement
    3.2702    0.5356
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7514   -0.0713   -0.7310   -0.0567    0.0251    1    0.0676    0.0702
    2    1    1    1   -0.0126   -0.1709   -0.0130   -0.1762    0.0053    1    0.0997    0.0995
    3   -1    1   -1   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.0973    0.0967
    4    2    4    1   -0.1883   -0.5867   -0.1957   -0.5833    0.0082    1    0.2089    0.1078
    5    2    0    1    0.0558   -0.2205    0.0560   -0.2234    0.0029    1    0.1289    0.0654
    6   -2    4   -1   -0.1128    0.1260   -0.1085    0.1216    0.0061    1    0.1532    0.0778
    7    4    2    1    0.1210   -0.5916    0.1201   -0.5973    0.0058    1    0.2677    0.1302
    8    3   -1    1    0.1088   -0.2261    0.1454   -0.2240    0.0367    1    0.1662    0.1017
    9   -1    3    0   -0.2028    0.0497   -0.1952    0.0486    0.0077    1    0.0775    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0460    0.0467
   11    2    0    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1252    0.1248
   12   -1    5    1   -0.1452   -0.0730   -0.1829   -0.0381    0.0514    0    0.1328    0.0984
   13    3   -5   -1    0.1749    0.0148    0.1990   -0.0092    0.0340    1    0.1603    0.0927
   14    5   -3   -1    0.6113   -0.1356    0.5293   -0.1451    0.0826    1    0.2651    0.1473
   15    0    6    1   -0.3369   -0.2443   -0.3362   -0.2357    0.0086    1    0.1761    0.0881
   16    2   -4   -1    0.1276    0.0368    0.1275    0.0362    0.0007    1    0.1241    0.0679
   17    4   -2   -1    0.7353   -0.0866    0.7293   -0.0807    0.0083    1    0.2342    0.1198
   18    6    0   -1    1.0523   -0.5230    1.0696   -0.4972    0.0311    1    0.5207    0.2483
   19    1   -3   -1    0.0450    0.0305    0.0442    0.0295    0.0013    1    0.0967    0.0994
   20    2   -2   -1    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1193    0.1178
   21    0    2    1   -0.0324   -0.0557   -0.0341   -0.0579    0.0028    1    0.0868    0.0568
   22    1   -1   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0907    0.0899
   23    0    0   -1    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0808    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7394   -0.0623   -0.7310   -0.0567    0.0101    1          0.0673          0.0702
    2    3    1    2    0.0196   -0.2091   -0.0130   -0.1762    0.0464    1          0.1133          0.0995
    3   -1   -1   -3    0.0129    0.0946   -0.0262    0.0895    0.0394    1          0.1234          0.0967
    4    2    4    1   -0.1942   -0.5889   -0.1957   -0.5833    0.0058    1          0.1036          0.1078
    5    2    0    1    0.0537   -0.2265    0.0560   -0.2234    0.0039    1          0.0646          0.0654
    6   -2    4   -1   -0.1093    0.1161   -0.1085    0.1216    0.0056    1          0.0773          0.0778
    7    4    2    1    0.1186   -0.5994    0.1201   -0.5973    0.0026    1          0.1328          0.1302
    8    4   -2    1    0.1404   -0.2261    0.1454   -0.2240    0.0054    1          0.1038          0.1017
    9   -2    6    0   -0.1956    0.0412   -0.1952    0.0486    0.0075    1          0.0783          0.0726
   10    2   -2    0    0.2246   -0.1360    0.2251   -0.1274    0.0085    1          0.0465          0.0467
   11    4    0    0    0.5350   -0.6167    0.5303   -0.6130    0.0060    1          0.1257          0.1248
   12   -1    5    1   -0.1388   -0.0769   -0.1829   -0.0381    0.0588    0          0.0670          0.0984
   13    4   -6   -1    0.2000   -0.0176    0.1990   -0.0092    0.0085    1          0.1019          0.0927
   14    6   -4   -1    0.5290   -0.1568    0.5293   -0.1451    0.0117    1          0.1516          0.1473
   15    0    6    1   -0.3326   -0.2422   -0.3362   -0.2357    0.0074    1          0.0879          0.0881
   16    2   -4   -1    0.1304    0.0276    0.1275    0.0362    0.0091    1          0.0632          0.0679
   17    4   -2   -1    0.7261   -0.0872    0.7293   -0.0807    0.0072    1          0.1174          0.1198
   18    6    0   -1    1.0547   -0.5068    1.0696   -0.4972    0.0177    1          0.2564          0.2483
   19    0   -4   -3    0.0180    0.0298    0.0442    0.0295    0.0262    1          0.1224          0.0994
   20    4   -4   -2    0.4462    0.1554    0.4423    0.1634    0.0088    1          0.1214          0.1178
   21    0    2    1   -0.0297   -0.0594   -0.0341   -0.0579    0.0047    1          0.0439          0.0568
   22    2   -2   -2    0.3040    0.3248    0.3053    0.3413    0.0165    1          0.0924          0.0899
   23    0    0   -2    0.0400    0.2703    0.0347    0.2716    0.0055    1          0.0822          0.0816

###            No.361                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.4175    1.4163    0.9963   90.0091   90.2090   90.0350      0.3967
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.4324    1.4375    0.9717   90.0000   91.4714   90.0000      0.3373         1.4741    1.4794    4.2461    4.2613    2.8805
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0022    0.0207    0.0949    0.0000    3.4197    0.0000      0.0441         0.1461    0.1521    0.5556    0.5609    0.4703
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5941   -0.3369   -0.1767)
 a2 = (   -0.3577   -0.6069   -0.0474)
 a3 = (   -0.1809    0.1822   -0.9704)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5872   -0.3309   -0.1828) (    0.0047    0.0047    0.0197)
 a2 = (   -0.3519   -0.5982   -0.0479) (    0.0063    0.0089    0.0039)
 a3 = (   -0.1759    0.1833   -0.9977) (    0.0177    0.0123    0.1053)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -104.7249  164.2963 -134.6669    1.1725    1.6818    1.2414
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0452      0.0023    0.0023    0.1067

# Number of computed bands
            147            400
# Figure of merit at the beginning and the end of the refinement
         6.6485         3.1790
# Chi-squares at the beginning and the end of the refinement
    0.1005    0.0321
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7380   -0.0572   -0.7310   -0.0567    0.0070    1    0.0746    0.0702
    2   -2   -4    0   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1110    0.0995
    3    3    3   -1   -0.0269    0.0910   -0.0262    0.0895    0.0017    1    0.1087    0.0967
    4   -1   -3   -1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1    0.1156    0.1078
    5   -2   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0717    0.0654
    6    3    1   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0856    0.0778
    7   -3   -3   -1    0.1189   -0.5963    0.1201   -0.5973    0.0016    1    0.1479    0.1302
    8   -4   -2    0    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1151    0.1017
    9    3   -1   -1   -0.1975    0.0499   -0.1952    0.0486    0.0026    1    0.0868    0.0726
   10   -2    0    0    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0513    0.0467
   11   -3   -1   -1    0.5336   -0.6159    0.5303   -0.6130    0.0044    1    0.1392    0.1248
   12    3   -3   -1   -0.1839   -0.0380   -0.1829   -0.0381    0.0011    1    0.1115    0.0984
   13   -4    2    0    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1119    0.0927
   14   -5    1   -1    0.5309   -0.1511    0.5293   -0.1451    0.0062    1    0.1667    0.1473
   15    1   -3   -1   -0.3385   -0.2384   -0.3362   -0.2357    0.0035    1    0.0978    0.0881
   16   -2    2    0    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0692    0.0679
   17   -3    1   -1    0.7323   -0.0828    0.7293   -0.0807    0.0036    1    0.1290    0.1198
   18   -4    0   -2    1.0613   -0.5180    1.0696   -0.4972    0.0224    1    0.2849    0.2483
   19   -2    4    0    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1080    0.0994
   20   -3    3   -1    0.4464    0.1656    0.4423    0.1634    0.0046    1    0.1323    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0483    0.0568
   22   -1    3   -1    0.2997    0.3359    0.3053    0.3413    0.0079    1    0.1004    0.0899
   23    1    3   -1    0.0349    0.2740    0.0347    0.2716    0.0024    1    0.0898    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7344   -0.0558   -0.7310   -0.0567    0.0035    1          0.0683          0.0702
    2   -2   -4    0   -0.0131   -0.1735   -0.0130   -0.1762    0.0027    1          0.0975          0.0995
    3    3    3   -1   -0.0267    0.0899   -0.0262    0.0895    0.0007    1          0.0953          0.0967
    4   -1   -3   -1   -0.1945   -0.5868   -0.1957   -0.5833    0.0037    1          0.1048          0.1078
    5   -2   -2    0    0.0565   -0.2232    0.0560   -0.2234    0.0006    1          0.0632          0.0654
    6    3    1   -1   -0.1072    0.1197   -0.1085    0.1216    0.0023    1          0.0752          0.0778
    7   -3   -3   -1    0.1212   -0.5953    0.1201   -0.5973    0.0023    1          0.1342          0.1302
    8   -4   -2    0    0.1435   -0.2201    0.1454   -0.2240    0.0043    1          0.1018          0.1017
    9    3   -1   -1   -0.1948    0.0488   -0.1952    0.0486    0.0005    1          0.0764          0.0726
   10   -2    0    0    0.2257   -0.1275    0.2251   -0.1274    0.0006    1          0.0454          0.0467
   11   -3   -1   -1    0.5361   -0.6118    0.5303   -0.6130    0.0059    1          0.1286          0.1248
   12    3   -3   -1   -0.1812   -0.0379   -0.1829   -0.0381    0.0016    1          0.0979          0.0984
   13   -4    2    0    0.1985   -0.0087    0.1990   -0.0092    0.0006    1          0.0987          0.0927
   14   -5    1   -1    0.5302   -0.1491    0.5293   -0.1451    0.0041    1          0.1509          0.1473
   15    1   -3   -1   -0.3363   -0.2372   -0.3362   -0.2357    0.0015    1          0.0870          0.0881
   16   -2    2    0    0.1270    0.0357    0.1275    0.0362    0.0007    1          0.0609          0.0679
   17   -3    1   -1    0.7297   -0.0799    0.7293   -0.0807    0.0009    1          0.1186          0.1198
   18   -5    1   -2    0.8819   -0.2075    1.0696   -0.4972    0.3452    0          0.2404          0.2483
   19   -2    4    0    0.0445    0.0294    0.0442    0.0295    0.0004    1          0.0947          0.0994
   20   -3    3   -1    0.4451    0.1656    0.4423    0.1634    0.0035    1          0.1191          0.1178
   21    0   -2    0   -0.0333   -0.0572   -0.0341   -0.0579    0.0012    1          0.0423          0.0568
   22   -1    3   -1    0.2987    0.3347    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    1    3   -1    0.0347    0.2728    0.0347    0.2716    0.0012    1          0.0795          0.0816

###            No.363                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.5809    1.6012    0.7902   90.2393   90.3332   89.0763      0.3924
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.5594    1.6169    0.7934   90.0000   88.7787   90.0000      0.3574         1.9655    2.0379    4.3638    4.5245    2.2202
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0005    0.0676    0.0110    0.0000    0.7930    0.0000      0.0290         0.0274    0.0807    0.3543    0.4132    0.1829
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6033    0.1711   -0.0831)
 a2 = (    0.1057   -0.1162    0.6045)
 a3 = (    0.3084   -1.1954   -0.2783)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6096    0.1837   -0.0778) (    0.0016    0.0052    0.0035)
 a2 = (    0.1098   -0.1108    0.5985) (    0.0079    0.0075    0.0241)
 a3 = (    0.2965   -1.1940   -0.2754) (    0.0121    0.0168    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.1432  102.7714   15.1858    0.3263    0.3889    0.4870
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003   -0.0085   -0.0278      0.0023    0.0023    0.0417

# Number of computed bands
            179            187
# Figure of merit at the beginning and the end of the refinement
         3.1450         3.1431
# Chi-squares at the beginning and the end of the refinement
    2.1771    1.4799
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0915    0.0702
    2    2    0   -3   -0.0121   -0.1693   -0.0130   -0.1762    0.0069    1    0.1389    0.0995
    3    0    2    3   -0.0268    0.0900   -0.0262    0.0895    0.0008    1    0.1364    0.0967
    4    2    2   -2   -0.1859   -0.5800   -0.1957   -0.5833    0.0104    1    0.1424    0.1078
    5    0    0   -1    0.0563   -0.2183    0.0560   -0.2234    0.0051    1    0.0448    0.0654
    6    1    1    1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0535    0.0778
    7    0    2   -3    0.1241   -0.5830    0.1201   -0.5973    0.0148    1    0.1831    0.1302
    8   -2    0   -2    0.1752   -0.1969    0.1454   -0.2240    0.0403    1    0.1024    0.1017
    9    4    2    1   -0.1917    0.0486   -0.1952    0.0486    0.0035    1    0.1082    0.0726
   10   -2    0   -1    0.2228   -0.1254    0.2251   -0.1274    0.0031    1    0.0645    0.0467
   11   -1    1   -1    0.5281   -0.5950    0.5303   -0.6130    0.0182    1    0.0855    0.1248
   12    3    1    0   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0693    0.0984
   13   -4    0   -1    0.2168   -0.0407    0.1990   -0.0092    0.0362    1    0.1003    0.0927
   14   -3    1   -1    0.5213   -0.1466    0.5293   -0.1451    0.0081    1    0.1038    0.1473
   15    4    2   -1   -0.3311   -0.2355   -0.3362   -0.2357    0.0051    1    0.1207    0.0881
   16   -4    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0869    0.0679
   17   -4    2   -1    0.7161   -0.0795    0.7293   -0.0807    0.0133    1    0.1598    0.1198
   18   -2    2   -1    1.0339   -0.4924    1.0696   -0.4972    0.0360    1    0.1714    0.2483
   19   -4    0    1    0.0143    0.0128    0.0442    0.0295    0.0343    1    0.0953    0.0994
   20   -3    1    0    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0827    0.1178
   21    2    0   -1   -0.0317   -0.0543   -0.0341   -0.0579    0.0043    1    0.0604    0.0568
   22   -4    2    1    0.2972    0.3316    0.3053    0.3413    0.0127    1    0.1257    0.0899
   23   -1    1    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0562    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7361   -0.0662   -0.7310   -0.0567    0.0108    1          0.0808          0.0702
    2    2    0   -3   -0.0142   -0.1648   -0.0130   -0.1762    0.0115    1          0.1236          0.0995
    3    0    2    3   -0.0267    0.1009   -0.0262    0.0895    0.0115    1          0.1200          0.0967
    4    2    2   -2   -0.1937   -0.5725   -0.1957   -0.5833    0.0110    1          0.1260          0.1078
    5    0    0   -2    0.0557   -0.2147    0.0560   -0.2234    0.0086    1          0.0791          0.0654
    6    2    2    2   -0.1117    0.1320   -0.1085    0.1216    0.0110    1          0.0940          0.0778
    7    0    2   -3    0.1189   -0.5866    0.1201   -0.5973    0.0108    1          0.1606          0.1302
    8   -2    0   -3    0.1442   -0.2109    0.1454   -0.2240    0.0131    1          0.1264          0.1017
    9    4    2    1   -0.2014    0.0550   -0.1952    0.0486    0.0089    1          0.0961          0.0726
   10   -2    0   -1    0.2255   -0.1143    0.2251   -0.1274    0.0131    1          0.0564          0.0467
   11   -2    2   -2    0.5399   -0.6011    0.5303   -0.6130    0.0153    1          0.1492          0.1248
   12    3    1    0   -0.1838   -0.0333   -0.1829   -0.0381    0.0049    1          0.0624          0.0984
   13   -4    0   -1    0.2146   -0.0275    0.1990   -0.0092    0.0241    1          0.0885          0.0927
   14   -6    2   -2    0.5281   -0.1308    0.5293   -0.1451    0.0144    1          0.1813          0.1473
   15    4    2   -1   -0.3316   -0.2314   -0.3362   -0.2357    0.0063    1          0.1086          0.0881
   16   -4    0    0    0.1205    0.0448    0.1275    0.0362    0.0111    1          0.0778          0.0679
   17   -4    2   -1    0.7226   -0.0597    0.7293   -0.0807    0.0221    1          0.1386          0.1198
   18   -4    4   -2    1.0602   -0.4862    1.0696   -0.4972    0.0144    1          0.2992          0.2483
   19   -6    0    1    0.0401    0.0358    0.0442    0.0295    0.0074    1          0.1221          0.0994
   20   -6    2    0    0.4334    0.1753    0.4423    0.1634    0.0149    1          0.1456          0.1178
   21    2    0   -1   -0.0343   -0.0499   -0.0341   -0.0579    0.0080    1          0.0545          0.0568
   22   -4    2    1    0.2930    0.3360    0.3053    0.3413    0.0134    1          0.1109          0.0899
   23   -2    2    2    0.0374    0.2803    0.0347    0.2716    0.0090    1          0.0995          0.0816

###            No.364                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2613    1.7844    1.0885   90.2976  125.2768   89.8675      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2412    1.7870    1.0807   90.0000  123.4475   90.0000      0.2989         1.1484    1.6535    4.1527    5.9789    3.6160
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0104    0.0337    0.0214    0.0000    0.7301    0.0000      0.0207         0.0198    0.0301    0.2891    0.4283    0.2599
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9228   -0.2341    0.1919)
 a2 = (   -0.0215    0.3005    0.4725)
 a3 = (    0.3333   -0.8971    0.5920)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9200   -0.2265    0.1865) (    0.0027    0.0089    0.0052)
 a2 = (   -0.0211    0.3018    0.4708) (    0.0028    0.0071    0.0087)
 a3 = (    0.3033   -0.8918    0.5853) (    0.0124    0.0203    0.0097)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   12.9309   59.6734  -20.4468    0.3535    0.4408    0.5781
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0074    0.0002   -0.0089      0.0021    0.0024    0.0152

# Number of computed bands
            173            205
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.1363
# Chi-squares at the beginning and the end of the refinement
    1.2608    0.8449
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2    1    5   -3    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    0   -2    2   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4    2    6   -2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5    0    4   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2   -2    2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7    0    4   -1    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8   -1    3   -1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    2    0    0   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10   -2    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -2    6    0    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    3    1   -1   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13   -3    1    1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -3    3    1    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15    4    4   -2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16   -4    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17   -4    4    2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18   -2    4    1    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19   -5   -1    3    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -3    1    2    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21    2    2   -2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -2    0    2    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23   -2   -2    4    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7400   -0.0616   -0.7310   -0.0567    0.0103    1          0.0870          0.0702
    2    1    5   -3   -0.0026   -0.2001   -0.0130   -0.1762    0.0261    1          0.1069          0.0995
    3    0   -2    2   -0.0319    0.0899   -0.0262    0.0895    0.0057    1          0.0638          0.0967
    4    2    6   -2   -0.2114   -0.5795   -0.1957   -0.5833    0.0162    1          0.1362          0.1078
    5    0    4   -2    0.0454   -0.2284    0.0560   -0.2234    0.0117    1          0.0846          0.0654
    6    2   -2    2   -0.1134    0.1207   -0.1085    0.1216    0.0050    1          0.0999          0.0778
    7    0    4   -1    0.1041   -0.6035    0.1201   -0.5973    0.0172    1          0.0871          0.1302
    8   -2    4   -1    0.1737   -0.2077    0.1454   -0.2240    0.0327    1          0.0961          0.1017
    9    2    0    0   -0.2002    0.0473   -0.1952    0.0486    0.0052    1          0.0511          0.0726
   10   -2    2    0    0.2243   -0.1303    0.2251   -0.1274    0.0030    1          0.0608          0.0467
   11   -1    3    0    0.5336   -0.6229    0.5303   -0.6130    0.0104    1          0.0823          0.1248
   12    3    1   -1   -0.1839   -0.0375   -0.1829   -0.0381    0.0012    1          0.0664          0.0984
   13   -3    1    1    0.1945   -0.0075    0.1990   -0.0092    0.0047    1          0.0669          0.0927
   14   -3    3    1    0.5279   -0.1475    0.5293   -0.1451    0.0028    1          0.0990          0.1473
   15    2    2   -1   -0.3386   -0.2313   -0.3362   -0.2357    0.0051    1          0.0580          0.0881
   16   -4    0    2    0.1215    0.0366    0.1275    0.0362    0.0060    1          0.0835          0.0679
   17   -4    4    2    0.7219   -0.0764    0.7293   -0.0807    0.0086    1          0.1530          0.1198
   18   -2    4    1    1.0574   -0.5050    1.0696   -0.4972    0.0145    1          0.1663          0.2483
   19   -5   -1    3    0.0700    0.0387    0.0442    0.0295    0.0274    1          0.1058          0.0994
   20   -3    1    2    0.4344    0.1628    0.4423    0.1634    0.0079    1          0.0793          0.1178
   21    2    2   -2   -0.0409   -0.0547   -0.0341   -0.0579    0.0075    1          0.0582          0.0568
   22   -2    0    2    0.2941    0.3250    0.3053    0.3413    0.0197    1          0.0602          0.0899
   23   -2   -2    4    0.0354    0.2716    0.0347    0.2716    0.0007    1          0.1068          0.0816

###            No.365                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2600    1.7766    1.0931   90.0847  125.1807   89.9880      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2412    1.7870    1.1090   90.0000  125.5951   90.0000      0.2989         1.1192    1.6114    4.1527    5.9789    3.7104
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0148    0.0292    0.0178    0.0000    0.9549    0.0000      0.0202         0.0141    0.0302    0.2851    0.4158    0.2578
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5899    0.6594   -0.4001)
 a2 = (    0.0213   -0.3051   -0.4725)
 a3 = (   -0.3341    0.8895   -0.5916)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6166    0.6652   -0.3988) (    0.0088    0.0075    0.0046)
 a2 = (    0.0211   -0.3018   -0.4708) (    0.0027    0.0072    0.0068)
 a3 = (   -0.3033    0.8918   -0.5853) (    0.0166    0.0132    0.0065)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -154.4349  111.1602 -123.0329    0.3180    0.4894    0.5897
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0074    0.0002   -0.0089      0.0021    0.0024    0.0152

# Number of computed bands
            179            207
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.1262
# Chi-squares at the beginning and the end of the refinement
    1.2714    0.8449
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2   -2   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2    1   -5    2    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    0    2   -2   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4    2   -6    0   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    0   -4    2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2    2   -4   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    0   -4    1    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8   -1   -3    2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    2    0   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10   -2   -2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -2   -6    2    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12    3   -1   -2   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13   -3   -1    2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -3   -3    2    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15    4   -4   -2   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16   -4    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -4   -4    2    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18   -2   -4    1    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19   -5    1    2    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -3   -1    1    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21    2   -2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -2    0    0    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23   -2    2   -2    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2   -2   -2   -0.7400   -0.0616   -0.7310   -0.0567    0.0103    1          0.0870          0.0702
    2    1   -5    2   -0.0026   -0.2001   -0.0130   -0.1762    0.0261    1          0.1069          0.0995
    3    0    2   -2   -0.0319    0.0899   -0.0262    0.0895    0.0057    1          0.0638          0.0967
    4    2   -6    0   -0.2114   -0.5795   -0.1957   -0.5833    0.0162    1          0.1362          0.1078
    5    0   -4    2    0.0454   -0.2284    0.0560   -0.2234    0.0117    1          0.0846          0.0654
    6    2    2   -4   -0.1134    0.1207   -0.1085    0.1216    0.0050    1          0.0999          0.0778
    7    0   -4    1    0.1041   -0.6035    0.1201   -0.5973    0.0172    1          0.0871          0.1302
    8   -2   -4    3    0.1737   -0.2077    0.1454   -0.2240    0.0327    1          0.0961          0.1017
    9    2    0   -2   -0.2002    0.0473   -0.1952    0.0486    0.0052    1          0.0511          0.0726
   10   -2   -2    2    0.2243   -0.1303    0.2251   -0.1274    0.0030    1          0.0608          0.0467
   11   -1   -3    1    0.5336   -0.6229    0.5303   -0.6130    0.0104    1          0.0823          0.1248
   12    3   -1   -2   -0.1839   -0.0375   -0.1829   -0.0381    0.0012    1          0.0664          0.0984
   13   -3   -1    2    0.1945   -0.0075    0.1990   -0.0092    0.0047    1          0.0669          0.0927
   14   -3   -3    2    0.5279   -0.1475    0.5293   -0.1451    0.0028    1          0.0990          0.1473
   15    2   -2   -1   -0.3386   -0.2313   -0.3362   -0.2357    0.0051    1          0.0580          0.0881
   16   -4    0    2    0.1215    0.0366    0.1275    0.0362    0.0060    1          0.0835          0.0679
   17   -4   -4    2    0.7219   -0.0764    0.7293   -0.0807    0.0086    1          0.1530          0.1198
   18   -2   -4    1    1.0574   -0.5050    1.0696   -0.4972    0.0145    1          0.1663          0.2483
   19   -5    1    2    0.0700    0.0387    0.0442    0.0295    0.0274    1          0.1058          0.0994
   20   -3   -1    1    0.4344    0.1628    0.4423    0.1634    0.0079    1          0.0793          0.1178
   21    2   -2    0   -0.0409   -0.0547   -0.0341   -0.0579    0.0075    1          0.0582          0.0568
   22   -2    0    0    0.2941    0.3250    0.3053    0.3413    0.0197    1          0.0602          0.0899
   23   -2    2   -2    0.0354    0.2716    0.0347    0.2716    0.0007    1          0.1068          0.0816

###            No.366                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3511    2.2455    0.6962   90.0860  108.7612   90.0746      0.7388
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3942    2.2102    0.6787   90.0000  106.9926   90.0000      0.3151         2.0543    3.2567    4.4243    7.0139    2.1537
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0955    0.5026    0.1367    0.0000   12.8390    0.0000      0.0395         0.2766    0.1053    0.6317    1.8210    0.5109
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2793   -0.1100   -0.7217)
 a2 = (   -0.2256   -0.3828   -0.0299)
 a3 = (   -0.9532    0.6358   -0.9941)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2608   -0.1028   -0.6957) (    0.0513    0.0417    0.0254)
 a2 = (   -0.2292   -0.3891   -0.0284) (    0.0523    0.0888    0.0025)
 a3 = (   -1.0060    0.6627   -0.9605) (    0.2567    0.1353    0.0370)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -93.8718  111.6205 -121.9261    0.6760    5.3658    0.5238
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0006    0.0001   -0.0605      0.0035    0.0027    0.2844

# Number of computed bands
            266            400
# Figure of merit at the beginning and the end of the refinement
         1.0116         3.0760
# Chi-squares at the beginning and the end of the refinement
    7.6418    0.1242
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2   -1   -0.7441   -0.0687   -0.7310   -0.0567    0.0178    1    0.1747    0.0702
    2   -2   -4    1    0.0571   -0.2237   -0.0130   -0.1762    0.0847    0    0.1696    0.0995
    3    1    3   -1   -0.0261    0.0888   -0.0262    0.0895    0.0006    1    0.1271    0.0967
    4   -1   -3    0   -0.1852   -0.5863   -0.1957   -0.5833    0.0109    1    0.1357    0.1078
    5   -2   -4    1    0.0571   -0.2237    0.0560   -0.2234    0.0012    1    0.1696    0.0654
    6    1    1   -1   -0.1067    0.1197   -0.1085    0.1216    0.0026    1    0.0998    0.0778
    7   -3   -5    1    0.1002   -0.4355    0.1201   -0.5973    0.1631    1    0.2482    0.1302
    8   -2   -2    1    0.1438   -0.2199    0.1454   -0.2240    0.0044    1    0.1362    0.1017
    9    1   -1   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1013    0.0726
   10   -2    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.1217    0.0467
   11   -4   -2    1    0.5258   -0.5980    0.5303   -0.6130    0.0156    1    0.3287    0.1248
   12    1   -3   -1   -0.1815   -0.0383   -0.1829   -0.0381    0.0013    1    0.1305    0.0984
   13   -2    2    1    0.1981   -0.0091    0.1990   -0.0092    0.0009    1    0.1324    0.0927
   14   -3    1    1    0.5222   -0.1510    0.5293   -0.1451    0.0092    1    0.1973    0.1473
   15    0   -6   -1   -0.3350   -0.2412   -0.3362   -0.2357    0.0056    1    0.2298    0.0881
   16   -2    4    1    0.1267    0.0354    0.1275    0.0362    0.0011    1    0.1638    0.0679
   17   -4    2    1    0.7161   -0.0881    0.7293   -0.0807    0.0152    1    0.3054    0.1198
   18   -5    1    1    0.9147   -0.2853    1.0696   -0.4972    0.2624    0    0.4640    0.2483
   19    1    5   -1   -0.0018    0.0462    0.0442    0.0295    0.0489    0    0.1700    0.0994
   20   -3    3    1    0.4358    0.0322    0.4423    0.1634    0.1313    1    0.2051    0.1178
   21    0   -2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1    3    0    0.3034    0.3294    0.3053    0.3413    0.0120    1    0.1180    0.0899
   23    0    6   -1    0.0373    0.2728    0.0347    0.2716    0.0028    1    0.2107    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2   -1   -0.7317   -0.0579   -0.7310   -0.0567    0.0014    1          0.0673          0.0702
    2   -2   -6    1    0.0100   -0.1987   -0.0130   -0.1762    0.0322    0          0.0860          0.0995
    3    2    6   -2   -0.0265    0.0904   -0.0262    0.0895    0.0010    1          0.1040          0.0967
    4   -2   -6    0   -0.1963   -0.5860   -0.1957   -0.5833    0.0027    1          0.1058          0.1078
    5   -2   -4    1    0.0570   -0.2240    0.0560   -0.2234    0.0012    1          0.0682          0.0654
    6    2    2   -2   -0.1074    0.1201   -0.1085    0.1216    0.0018    1          0.0818          0.0778
    7   -4   -6    1    0.1186   -0.5967    0.1201   -0.5973    0.0017    1          0.1357          0.1302
    8   -4   -4    2    0.1440   -0.2210    0.1454   -0.2240    0.0033    1          0.1094          0.1017
    9    2   -2   -2   -0.1950    0.0491   -0.1952    0.0486    0.0005    1          0.0828          0.0726
   10   -2    0    1    0.2266   -0.1286    0.2251   -0.1274    0.0019    1          0.0488          0.0467
   11   -4   -2    1    0.5323   -0.6192    0.5303   -0.6130    0.0065    1          0.1250          0.1248
   12    2   -6   -2   -0.1817   -0.0376   -0.1829   -0.0381    0.0012    1          0.1064          0.0984
   13   -4    4    2    0.1999   -0.0092    0.1990   -0.0092    0.0009    1          0.1067          0.0927
   14   -6    2    2    0.5334   -0.1538    0.5293   -0.1451    0.0096    1          0.1539          0.1473
   15    0   -6   -1   -0.3368   -0.2370   -0.3362   -0.2357    0.0014    1          0.0915          0.0881
   16   -2    4    1    0.1281    0.0358    0.1275    0.0362    0.0007    1          0.0661          0.0679
   17   -4    2    1    0.7369   -0.0870    0.7293   -0.0807    0.0098    1          0.1168          0.1198
   18   -6    0    1    1.0630   -0.5289    1.0696   -0.4972    0.0324    1          0.2483          0.2483
   19   -2    6    1    0.0764    0.0382    0.0442    0.0295    0.0333    0          0.0836          0.0994
   20   -4    6    1    0.4511    0.1657    0.4423    0.1634    0.0090    1          0.1230          0.1178
   21    0   -4    0   -0.0333   -0.0576   -0.0341   -0.0579    0.0009    1          0.0462          0.0568
   22   -2    6    0    0.3027    0.3390    0.3053    0.3413    0.0035    1          0.0934          0.0899
   23    0    6   -1    0.0345    0.2753    0.0347    0.2716    0.0037    1          0.0849          0.0816

###            No.367                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3769    2.2502    0.6830   90.0369  109.0651   90.0307      0.5562
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3646    2.2532    0.6880   90.0000  109.0146   90.0000      0.2800         1.9835    3.2751    4.8729    8.0461    2.4567
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0477    0.1092    0.0241    0.0000    5.8103    0.0000      0.0334         0.1285    0.2394    0.6050    1.0348    0.3051
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4875    0.3268   -0.4960)
 a2 = (    0.2252    0.3820    0.0298)
 a3 = (    0.5337   -0.2006   -1.4405)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4972    0.3289   -0.4954) (    0.0304    0.0111    0.0373)
 a2 = (    0.2229    0.3826    0.0303) (    0.0105    0.0190    0.0022)
 a3 = (    0.5217   -0.1904   -1.4336) (    0.0302    0.0268    0.1110)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -83.9020  139.9989   64.4547    0.4081    3.6118    0.6096
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0028   -0.0000   -0.0093      0.0032    0.0024    0.1232

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         1.6385         3.0614
# Chi-squares at the beginning and the end of the refinement
    3.7856    0.3990
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0654    0.0702
    2    2    6   -1    0.0100   -0.1989   -0.0130   -0.1762    0.0323    0    0.1600    0.0995
    3   -4   -4    1   -0.0573    0.1099   -0.0262    0.0895    0.0373    1    0.1679    0.0967
    4    0    6   -1   -0.1924   -0.5866   -0.1957   -0.5833    0.0047    1    0.2043    0.1078
    5    2    4   -1    0.0571   -0.2237    0.0560   -0.2234    0.0012    1    0.1272    0.0654
    6   -4   -2    1   -0.1059    0.1183   -0.1085    0.1216    0.0042    1    0.1516    0.0778
    7    1    3   -1    0.1224   -0.5926    0.1201   -0.5973    0.0052    1    0.1306    0.1302
    8    2    2   -1    0.1438   -0.2199    0.1454   -0.2240    0.0044    1    0.1022    0.1017
    9   -4    2    1   -0.1932    0.0490   -0.1952    0.0486    0.0020    1    0.1537    0.0726
   10    2    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0914    0.0467
   11    1    1   -1    0.5310   -0.6066    0.5303   -0.6130    0.0064    1    0.1225    0.1248
   12   -4    4    1   -0.1959   -0.0012   -0.1829   -0.0381    0.0391    1    0.1717    0.0984
   13    2   -2   -1    0.1981   -0.0091    0.1990   -0.0092    0.0009    1    0.0994    0.0927
   14    3   -1   -2    0.4372   -0.1586    0.5293   -0.1451    0.0931    1    0.1886    0.1473
   15   -1    3    0   -0.3365   -0.2370   -0.3362   -0.2357    0.0013    1    0.0860    0.0881
   16    2   -4   -1    0.1267    0.0354    0.1275    0.0362    0.0011    1    0.1228    0.0679
   17    1   -1   -1    0.7240   -0.0844    0.7293   -0.0807    0.0065    1    0.1137    0.1198
   18    2    0   -3    1.0445   -0.5090    1.0696   -0.4972    0.0277    1    0.5034    0.2483
   19   -3   -1    1   -0.0056    0.0050    0.0442    0.0295    0.0555    0    0.1130    0.0994
   20    1   -3   -1    0.4448    0.1622    0.4423    0.1634    0.0027    1    0.1170    0.1178
   21    0    2    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0427    0.0568
   22    0   -6   -1    0.3000    0.3329    0.3053    0.3413    0.0100    1    0.1776    0.0899
   23   -1   -3    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0791    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    2    0   -0.7300   -0.0546   -0.7310   -0.0567    0.0023    1          0.0652          0.0702
    2    2    6   -1    0.0141   -0.1998   -0.0130   -0.1762    0.0360    0          0.0796          0.0995
    3   -4   -6    1   -0.0246    0.0888   -0.0262    0.0895    0.0017    1          0.0961          0.0967
    4    0    6   -1   -0.1915   -0.5921   -0.1957   -0.5833    0.0097    1          0.1013          0.1078
    5    2    4   -1    0.0615   -0.2239    0.0560   -0.2234    0.0056    1          0.0633          0.0654
    6   -4   -2    1   -0.1051    0.1186   -0.1085    0.1216    0.0045    1          0.0760          0.0778
    7    2    6   -2    0.1281   -0.5967    0.1201   -0.5973    0.0080    1          0.1297          0.1302
    8    4    6   -2    0.0998   -0.2286    0.1454   -0.2240    0.0458    1          0.1130          0.1017
    9   -4    2    1   -0.1928    0.0490   -0.1952    0.0486    0.0025    1          0.0771          0.0726
   10    2    0   -1    0.2273   -0.1256    0.2251   -0.1274    0.0029    1          0.0455          0.0467
   11    2    2   -2    0.5405   -0.6092    0.5303   -0.6130    0.0108    1          0.1215          0.1248
   12   -4    6    1   -0.1810   -0.0377   -0.1829   -0.0381    0.0019    1          0.0986          0.0984
   13    4   -4   -2    0.1990   -0.0083    0.1990   -0.0092    0.0009    1          0.0991          0.0927
   14    4   -2   -3    0.5311   -0.1481    0.5293   -0.1451    0.0035    1          0.1463          0.1473
   15   -2    6    0   -0.3371   -0.2387   -0.3362   -0.2357    0.0031    1          0.0859          0.0881
   16    2   -4   -1    0.1275    0.0354    0.1275    0.0362    0.0008    1          0.0611          0.0679
   17    2   -2   -2    0.7318   -0.0802    0.7293   -0.0807    0.0025    1          0.1126          0.1198
   18    2    0   -3    1.0635   -0.5092    1.0696   -0.4972    0.0135    1          0.2464          0.2483
   19    5   -5   -2    0.0546   -0.0012    0.0442    0.0295    0.0325    0          0.1113          0.0994
   20    2   -6   -2    0.4478    0.1658    0.4423    0.1634    0.0059    1          0.1160          0.1178
   21    0    6    0   -0.0320   -0.0597   -0.0341   -0.0579    0.0028    1          0.0638          0.0568
   22    0   -6   -1    0.3005    0.3372    0.3053    0.3413    0.0063    1          0.0879          0.0899
   23   -2   -6    0    0.0344    0.2728    0.0347    0.2716    0.0012    1          0.0789          0.0816

###            No.368                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.3733    2.2499    0.6870   90.0350  109.5790   90.2021      0.4569
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.3646    2.2532    0.6880   90.0000  109.0146   90.0000      0.2800         1.9835    3.2751    4.8729    8.0461    2.4567
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0477    0.1092    0.0241    0.0000    5.8103    0.0000      0.0334         0.1285    0.2394    0.6050    1.0348    0.3051
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4938   -0.3263    0.4970)
 a2 = (    0.2252    0.3820    0.0298)
 a3 = (   -0.5145    0.1940    1.4437)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4972   -0.3289    0.4954) (    0.0304    0.0111    0.0373)
 a2 = (    0.2229    0.3826    0.0303) (    0.0105    0.0190    0.0022)
 a3 = (   -0.5217    0.1904    1.4336) (    0.0302    0.0268    0.1110)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   83.9020   40.0011 -115.5453    0.4081    3.6118    0.6096
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0028   -0.0000   -0.0093      0.0032    0.0024    0.1232

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         2.0190         3.0614
# Chi-squares at the beginning and the end of the refinement
    2.8496    0.3990
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0538    0.0702
    2   -2    6    1    0.0096   -0.1998   -0.0130   -0.1762    0.0327    0    0.1311    0.0995
    3    4   -4   -1   -0.0578    0.1100   -0.0262    0.0895    0.0377    1    0.1376    0.0967
    4    0    6    1   -0.1973   -0.5863   -0.1957   -0.5833    0.0033    1    0.1679    0.1078
    5   -2    4    1    0.0570   -0.2252    0.0560   -0.2234    0.0021    1    0.1042    0.0654
    6    4   -2   -1   -0.1065    0.1181   -0.1085    0.1216    0.0040    1    0.1244    0.0778
    7   -1    3    1    0.1194   -0.5980    0.1201   -0.5973    0.0010    1    0.1073    0.1302
    8   -2    2    1    0.1448   -0.2217    0.1454   -0.2240    0.0023    1    0.0836    0.1017
    9    4    2   -1   -0.1933    0.0483   -0.1952    0.0486    0.0020    1    0.1263    0.0726
   10   -2    0    1    0.2272   -0.1281    0.2251   -0.1274    0.0022    1    0.0747    0.0467
   11   -1    1    1    0.5357   -0.6173    0.5303   -0.6130    0.0069    1    0.1011    0.1248
   12    4    4   -1   -0.1957   -0.0017   -0.1829   -0.0381    0.0386    1    0.1411    0.0984
   13   -2   -2    1    0.1995   -0.0084    0.1990   -0.0092    0.0009    1    0.0814    0.0927
   14   -3   -1    2    0.4423   -0.1592    0.5293   -0.1451    0.0882    1    0.1544    0.1473
   15    1    3    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0708    0.0881
   16   -2   -4    1    0.1273    0.0361    0.1275    0.0362    0.0002    1    0.1007    0.0679
   17   -1   -1    1    0.7341   -0.0823    0.7293   -0.0807    0.0050    1    0.0937    0.1198
   18   -2    0    3    1.0651   -0.5195    1.0696   -0.4972    0.0228    1    0.4178    0.2483
   19   -2   -6    1    0.0755    0.0383    0.0442    0.0295    0.0326    0    0.1271    0.0994
   20   -1   -3    1    0.4473    0.1663    0.4423    0.1634    0.0057    1    0.0960    0.1178
   21    0    4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0701    0.0568
   22    0   -6    1    0.2993    0.3367    0.3053    0.3413    0.0076    1    0.1457    0.0899
   23    1   -3    0    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.0650    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    2    0   -0.7300   -0.0546   -0.7310   -0.0567    0.0023    1          0.0652          0.0702
    2   -2    6    1    0.0141   -0.1998   -0.0130   -0.1762    0.0360    0          0.0796          0.0995
    3    4   -6   -1   -0.0246    0.0888   -0.0262    0.0895    0.0017    1          0.0961          0.0967
    4    0    6    1   -0.1915   -0.5921   -0.1957   -0.5833    0.0097    1          0.1013          0.1078
    5   -2    4    1    0.0615   -0.2239    0.0560   -0.2234    0.0056    1          0.0633          0.0654
    6    4   -2   -1   -0.1051    0.1186   -0.1085    0.1216    0.0045    1          0.0760          0.0778
    7   -2    6    2    0.1281   -0.5967    0.1201   -0.5973    0.0080    1          0.1297          0.1302
    8   -4    6    2    0.0998   -0.2286    0.1454   -0.2240    0.0458    1          0.1130          0.1017
    9    4    2   -1   -0.1928    0.0490   -0.1952    0.0486    0.0025    1          0.0771          0.0726
   10   -2    0    1    0.2273   -0.1256    0.2251   -0.1274    0.0029    1          0.0455          0.0467
   11   -2    2    2    0.5405   -0.6092    0.5303   -0.6130    0.0108    1          0.1215          0.1248
   12    4    6   -1   -0.1810   -0.0377   -0.1829   -0.0381    0.0019    1          0.0986          0.0984
   13   -4   -4    2    0.1990   -0.0083    0.1990   -0.0092    0.0009    1          0.0991          0.0927
   14   -4   -2    3    0.5311   -0.1481    0.5293   -0.1451    0.0035    1          0.1463          0.1473
   15    2    6    0   -0.3371   -0.2387   -0.3362   -0.2357    0.0031    1          0.0859          0.0881
   16   -2   -4    1    0.1275    0.0354    0.1275    0.0362    0.0008    1          0.0611          0.0679
   17   -2   -2    2    0.7318   -0.0802    0.7293   -0.0807    0.0025    1          0.1126          0.1198
   18   -2    0    3    1.0635   -0.5092    1.0696   -0.4972    0.0135    1          0.2464          0.2483
   19   -5   -5    2    0.0546   -0.0012    0.0442    0.0295    0.0325    0          0.1113          0.0994
   20   -2   -6    2    0.4478    0.1658    0.4423    0.1634    0.0059    1          0.1160          0.1178
   21    0    6    0   -0.0320   -0.0597   -0.0341   -0.0579    0.0028    1          0.0638          0.0568
   22    0   -6    1    0.3005    0.3372    0.3053    0.3413    0.0063    1          0.0879          0.0899
   23    2   -6    0    0.0344    0.2728    0.0347    0.2716    0.0012    1          0.0789          0.0816

###            No.370                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2622    1.7831    1.0885   90.2818  125.2757   89.8378      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2724    1.8074    1.0751   90.0000  126.0132   90.0000      0.2934         1.1835    1.6810    4.3365    6.1595    3.6641
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0146    0.0339    0.0176    0.0000    0.9070    0.0000      0.0195         0.0133    0.0375    0.2926    0.4255    0.2509
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4937   -0.5678   -0.6129)
 a2 = (   -0.4506   -0.0332   -0.3322)
 a3 = (    0.6110    0.3625   -0.8727)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4976   -0.5591   -0.6195) (    0.0057    0.0070    0.0049)
 a2 = (   -0.4428   -0.0276   -0.3307) (    0.0103    0.0040    0.0043)
 a3 = (    0.6365    0.3702   -0.8832) (    0.0118    0.0155    0.0086)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -133.1440  119.0798  159.0796    0.4278    0.5170    0.5303
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0086    0.0014    0.0086      0.0024    0.0022    0.0121

# Number of computed bands
            173            193
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.0611
# Chi-squares at the beginning and the end of the refinement
    1.2143    0.8685
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -4    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2   -5   -1    3    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    3   -1   -2   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4   -4   -4    2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5   -4    0    2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    4   -4   -2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7   -3   -1    1    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8   -3    1    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1   -3    0   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10   -2    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -4    0    0    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12    0   -4    1   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13   -1    3   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14   -2    2   -1    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15   -2   -6    2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    0    4   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17   -2    2   -2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18   -2    0   -1    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    1    5   -3    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    0    2   -2    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21   -2   -2    2   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    1    1   -2    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    4    0   -4    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -4    0   -0.7461   -0.0474   -0.7310   -0.0567    0.0177    1          0.0876          0.0702
    2   -5   -1    3   -0.0018   -0.1975   -0.0130   -0.1762    0.0241    1          0.1061          0.0995
    3    6   -2   -4   -0.0340    0.0904   -0.0262    0.0895    0.0079    1          0.1281          0.0967
    4   -4   -4    2   -0.2083   -0.5866   -0.1957   -0.5833    0.0130    1          0.1360          0.1078
    5   -4    0    2    0.0454   -0.2255    0.0560   -0.2234    0.0108    1          0.0843          0.0654
    6    4   -4   -2   -0.1132    0.1190   -0.1085    0.1216    0.0054    1          0.1004          0.0778
    7   -6   -2    2    0.1110   -0.6016    0.1201   -0.5973    0.0101    1          0.1752          0.1302
    8   -4    2    1    0.1713   -0.2064    0.1454   -0.2240    0.0313    1          0.0964          0.1017
    9    1   -3    0   -0.1979    0.0480   -0.1952    0.0486    0.0028    1          0.0508          0.0726
   10   -2    2    0    0.2222   -0.1319    0.2251   -0.1274    0.0053    1          0.0609          0.0467
   11   -4    0    0    0.5370   -0.6145    0.5303   -0.6130    0.0068    1          0.1669          0.1248
   12    0   -8    2   -0.1826   -0.0362   -0.1829   -0.0381    0.0019    1          0.1311          0.0984
   13   -1    3   -1    0.1966   -0.0103    0.1990   -0.0092    0.0026    1          0.0668          0.0927
   14   -4    4   -2    0.5263   -0.1486    0.5293   -0.1451    0.0046    1          0.2006          0.1473
   15   -2   -6    2   -0.3420   -0.2315   -0.3362   -0.2357    0.0072    1          0.1144          0.0881
   16    0    4   -2    0.1254    0.0360    0.1275    0.0362    0.0021    1          0.0828          0.0679
   17   -2    2   -2    0.7207   -0.0760    0.7293   -0.0807    0.0099    1          0.1554          0.1198
   18   -2    0   -1    1.0570   -0.4899    1.0696   -0.4972    0.0145    1          0.1698          0.2483
   19    1    5   -3    0.0739    0.0397    0.0442    0.0295    0.0314    1          0.1045          0.0994
   20    0    4   -4    0.4382    0.1633    0.4423    0.1634    0.0041    1          0.1602          0.1178
   21   -2   -2    2   -0.0394   -0.0521   -0.0341   -0.0579    0.0078    1          0.0573          0.0568
   22    2    2   -4    0.2951    0.3294    0.3053    0.3413    0.0156    1          0.1214          0.0899
   23    4    0   -4    0.0325    0.2737    0.0347    0.2716    0.0029    1          0.1072          0.0816

###            No.371                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2609    1.7808    1.0892   89.8228  125.1370   90.2298      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2724    1.8073    1.0799   90.0000  126.3618   90.0000      0.2934         1.1782    1.6736    4.3365    6.1595    3.6805
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0111    0.0405    0.0207    0.0000    0.6787    0.0000      0.0199         0.0180    0.0334    0.2972    0.4409    0.2600
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1172    0.9270   -0.2596)
 a2 = (    0.4513    0.0375    0.3320)
 a3 = (    0.6112    0.3544   -0.8726)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1389    0.9293   -0.2636) (    0.0091    0.0025    0.0067)
 a2 = (    0.4428    0.0276    0.3307) (    0.0116    0.0042    0.0059)
 a3 = (    0.6365    0.3702   -0.8832) (    0.0152    0.0099    0.0162)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -24.3237  139.0159   62.6573    0.6059    0.4552    0.6779
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0086    0.0014    0.0086      0.0024    0.0022    0.0121

# Number of computed bands
            179            193
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.0611
# Chi-squares at the beginning and the end of the refinement
    1.2694    0.8685
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2    5    1   -2    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3   -3    1    1   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4    4    4   -2   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    4    0   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6   -4    4    2   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    3    1   -2    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    3   -1   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9   -1    3    1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    2   -2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    4    0   -4    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12    0    4    1   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13    1   -3   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    2   -2   -3    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15    2    6    0   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16    0   -4   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    2   -2   -4    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18    2    0   -3    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19   -1   -5   -2    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    0   -2   -2    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21    2    2    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -1   -1   -1    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23   -4    0    0    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    4    0   -0.7461   -0.0474   -0.7310   -0.0567    0.0177    1          0.0876          0.0702
    2    5    1   -2   -0.0018   -0.1975   -0.0130   -0.1762    0.0241    1          0.1061          0.0995
    3   -6    2    2   -0.0340    0.0904   -0.0262    0.0895    0.0079    1          0.1281          0.0967
    4    4    4   -2   -0.2083   -0.5866   -0.1957   -0.5833    0.0130    1          0.1360          0.1078
    5    4    0   -2    0.0454   -0.2255    0.0560   -0.2234    0.0108    1          0.0843          0.0654
    6   -4    4    2   -0.1132    0.1190   -0.1085    0.1216    0.0054    1          0.1004          0.0778
    7    6    2   -4    0.1110   -0.6016    0.1201   -0.5973    0.0101    1          0.1752          0.1302
    8    4   -2   -3    0.1713   -0.2064    0.1454   -0.2240    0.0313    1          0.0964          0.1017
    9   -1    3    1   -0.1979    0.0480   -0.1952    0.0486    0.0028    1          0.0508          0.0726
   10    2   -2   -2    0.2222   -0.1319    0.2251   -0.1274    0.0053    1          0.0609          0.0467
   11    4    0   -4    0.5370   -0.6145    0.5303   -0.6130    0.0068    1          0.1669          0.1248
   12    0    8    2   -0.1826   -0.0362   -0.1829   -0.0381    0.0019    1          0.1311          0.0984
   13    1   -3   -2    0.1966   -0.0103    0.1990   -0.0092    0.0026    1          0.0668          0.0927
   14    4   -4   -6    0.5263   -0.1486    0.5293   -0.1451    0.0046    1          0.2006          0.1473
   15    2    6    0   -0.3420   -0.2315   -0.3362   -0.2357    0.0072    1          0.1144          0.0881
   16    0   -4   -2    0.1254    0.0360    0.1275    0.0362    0.0021    1          0.0828          0.0679
   17    2   -2   -4    0.7207   -0.0760    0.7293   -0.0807    0.0099    1          0.1554          0.1198
   18    2    0   -3    1.0570   -0.4899    1.0696   -0.4972    0.0145    1          0.1698          0.2483
   19   -1   -5   -2    0.0739    0.0397    0.0442    0.0295    0.0314    1          0.1045          0.0994
   20    0   -4   -4    0.4382    0.1633    0.4423    0.1634    0.0041    1          0.1602          0.1178
   21    2    2    0   -0.0394   -0.0521   -0.0341   -0.0579    0.0078    1          0.0573          0.0568
   22   -2   -2   -2    0.2951    0.3294    0.3053    0.3413    0.0156    1          0.1214          0.0899
   23   -4    0    0    0.0325    0.2737    0.0347    0.2716    0.0029    1          0.1072          0.0816

###            No.378                ###
# Bravais type
   Monoclinic(C)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.2587    1.7848    1.0897   90.0916  125.2176   89.9845      0.3212
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.2084    1.8244    1.0718   90.0000  122.1738   90.0000      0.3920         1.1274    1.7021    3.0828    4.6543    2.7344
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0652    0.0893    0.0245    0.0000    4.9155    0.0000      0.0363         0.0488    0.1027    0.3305    0.4875    0.2609
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6198    0.4132   -0.6251)
 a2 = (   -0.2839   -0.4816   -0.0376)
 a3 = (   -0.9468    0.5336    0.2838)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6001    0.4064   -0.6562) (    0.0359    0.0141    0.0410)
 a2 = (   -0.2774   -0.4712   -0.0381) (    0.0133    0.0236    0.0026)
 a3 = (   -0.9255    0.5211    0.2946) (    0.0463    0.0281    0.0205)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -95.9127   42.4386 -116.1187    0.3820    3.2631    0.5490
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0000    0.0006    0.0659      0.0023    0.0023    0.1024

# Number of computed bands
             93            400
# Figure of merit at the beginning and the end of the refinement
         4.7664         3.0376
# Chi-squares at the beginning and the end of the refinement
    0.3661    0.1072
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7292   -0.0552   -0.7310   -0.0567    0.0024    1    0.0475    0.0702
    2    0   -4    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0713    0.0995
    3   -1    3   -1   -0.0262    0.0877   -0.0262    0.0895    0.0017    1    0.0698    0.0967
    4   -1   -3    1   -0.1967   -0.5868   -0.1957   -0.5833    0.0036    1    0.0741    0.1078
    5    0   -2    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0461    0.0654
    6   -1    1   -1   -0.1057    0.1177   -0.1085    0.1216    0.0047    1    0.0550    0.0778
    7   -1   -3    2    0.1202   -0.5978    0.1201   -0.5973    0.0005    1    0.0950    0.1302
    8    0   -2    2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0741    0.1017
    9   -1   -1   -1   -0.1926    0.0484   -0.1952    0.0486    0.0026    1    0.0558    0.0726
   10    0    0    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0331    0.0467
   11   -1   -1    2    0.5366   -0.6156    0.5303   -0.6130    0.0068    1    0.0895    0.1248
   12   -1   -3   -1   -0.1801   -0.0371   -0.1829   -0.0381    0.0029    1    0.0716    0.0984
   13    0    2    2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0721    0.0927
   14   -1    1    3    0.5323   -0.1500    0.5293   -0.1451    0.0057    1    0.1073    0.1473
   15   -1   -3    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0627    0.0881
   16    0    4    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0893    0.0679
   17   -1    1    2    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.0830    0.1198
   18   -2    0    3    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1825    0.2483
   19    0    4    1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0694    0.0994
   20   -1    3    2    0.4463    0.1661    0.4423    0.1634    0.0048    1    0.0851    0.1178
   21    0   -4    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0621    0.0568
   22   -1    3    1    0.2985    0.3355    0.3053    0.3413    0.0089    1    0.0645    0.0899
   23   -1    3    0    0.0339    0.2715    0.0347    0.2716    0.0008    1    0.0576    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7351   -0.0549   -0.7310   -0.0567    0.0045    1          0.0653          0.0702
    2    0   -4    1   -0.0132   -0.1732   -0.0130   -0.1762    0.0030    1          0.0912          0.0995
    3   -1    3   -1   -0.0269    0.0901   -0.0262    0.0895    0.0010    1          0.0890          0.0967
    4   -1   -3    1   -0.1945   -0.5871   -0.1957   -0.5833    0.0040    1          0.0997          0.1078
    5    0   -2    1    0.0563   -0.2230    0.0560   -0.2234    0.0005    1          0.0592          0.0654
    6   -1    1   -1   -0.1073    0.1197   -0.1085    0.1216    0.0022    1          0.0703          0.0778
    7   -1   -3    2    0.1215   -0.5955    0.1201   -0.5973    0.0023    1          0.1276          0.1302
    8    0   -2    2    0.1434   -0.2201    0.1454   -0.2240    0.0043    1          0.0954          0.1017
    9   -1   -1   -1   -0.1946    0.0486   -0.1952    0.0486    0.0006    1          0.0715          0.0726
   10    0    0    1    0.2258   -0.1277    0.2251   -0.1274    0.0007    1          0.0426          0.0467
   11   -1   -1    2    0.5371   -0.6113    0.5303   -0.6130    0.0069    1          0.1235          0.1248
   12   -1   -3   -1   -0.1809   -0.0379   -0.1829   -0.0381    0.0020    1          0.0916          0.0984
   13    0    2    2    0.1988   -0.0089    0.1990   -0.0092    0.0003    1          0.0924          0.0927
   14   -1    1    3    0.5303   -0.1488    0.5293   -0.1451    0.0038    1          0.1433          0.1473
   15   -1   -3    0   -0.3362   -0.2371   -0.3362   -0.2357    0.0013    1          0.0820          0.0881
   16    0    2    1    0.1275    0.0357    0.1275    0.0362    0.0005    1          0.0569          0.0679
   17   -1    1    2    0.7294   -0.0792    0.7293   -0.0807    0.0015    1          0.1135          0.1198
   18   -3    1    5    0.9421   -0.2783    1.0696   -0.4972    0.2532    0          0.3585          0.2483
   19    0    4    1    0.0450    0.0296    0.0442    0.0295    0.0009    1          0.0884          0.0994
   20   -1    3    2    0.4451    0.1656    0.4423    0.1634    0.0035    1          0.1128          0.1178
   21    0   -4    0   -0.0330   -0.0567   -0.0341   -0.0579    0.0017    1          0.0791          0.0568
   22   -1    3    1    0.2988    0.3346    0.3053    0.3413    0.0093    1          0.0854          0.0899
   23   -1    3    0    0.0349    0.2731    0.0347    0.2716    0.0015    1          0.0747          0.0816

###                                ###
### Candidates for   Monoclinic(P) ###
###                                ###

###            No.1                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8546    1.4185    0.8700   90.5554  108.5147   90.1547      0.3559
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8632    1.4204    0.8659   90.0000  109.6340   90.0000      0.3569         0.9969    1.6403    2.4188    3.9798    2.4263
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0055    0.0237    0.0149    0.0000    1.0143    0.0000      0.0236         0.0181    0.0312    0.1608    0.2716    0.1659
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7352    0.8600   -0.4928)
 a2 = (   -0.0295    0.3736    0.5972)
 a3 = (    1.1505   -0.2867    0.2521)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7478    0.8391   -0.4996) (    0.0117    0.0098    0.0061)
 a2 = (   -0.0280    0.3781    0.5932) (    0.0034    0.0093    0.0088)
 a3 = (    1.1662   -0.2919    0.2411) (    0.0227    0.0113    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -25.7368   69.2869   57.9681    0.3378    0.5088    0.6142
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0006   -0.0034      0.0021    0.0024    0.0164

# Number of computed bands
            400            147
# Figure of merit at the beginning and the end of the refinement
         5.9925        12.8025
# Chi-squares at the beginning and the end of the refinement
    0.1785    0.0225
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0677    0.0702
    2    2    3   -1   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1005    0.0995
    3   -2   -2    2   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0982    0.0967
    4    1    3    0   -0.1935   -0.5926   -0.1957   -0.5833    0.0095    1    0.1044    0.1078
    5    1    2   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0645    0.0654
    6   -1   -1    2   -0.1098    0.1243   -0.1085    0.1216    0.0030    1    0.0768    0.0778
    7    1    4   -1    0.1208   -0.5981    0.1201   -0.5973    0.0010    1    0.1327    0.1302
    8    1    3   -2    0.1420   -0.2192    0.1454   -0.2240    0.0059    1    0.1028    0.1017
    9    0    0    2   -0.2063    0.0514   -0.1952    0.0486    0.0114    1    0.0775    0.0726
   10    0    1   -1    0.2227   -0.1246    0.2251   -0.1274    0.0037    1    0.0455    0.0467
   11    0    3   -1    0.5425   -0.6163    0.5303   -0.6130    0.0126    1    0.1244    0.1248
   12    1    1    2   -0.1931   -0.0424   -0.1829   -0.0381    0.0111    1    0.0998    0.0984
   13   -1    1   -2    0.1909   -0.0054    0.1990   -0.0092    0.0088    1    0.0991    0.0927
   14   -1    3   -2    0.5318   -0.1420    0.5293   -0.1451    0.0040    1    0.1474    0.1473
   15    1    2    1   -0.3429   -0.2479   -0.3362   -0.2357    0.0139    1    0.0883    0.0881
   16   -1    0   -1    0.1168    0.0355    0.1275    0.0362    0.0107    1    0.0616    0.0679
   17   -1    2   -1    0.7321   -0.0655    0.7293   -0.0807    0.0155    1    0.1143    0.1198
   18   -1    4   -1    1.0834   -0.4980    1.0696   -0.4972    0.0139    1    0.2554    0.2483
   19   -2   -1   -1    0.0354    0.0247    0.0442    0.0295    0.0101    1    0.0970    0.0994
   20   -2    1   -1    0.4329    0.1731    0.4423    0.1634    0.0135    1    0.1174    0.1178
   21    1    1    0   -0.0365   -0.0638   -0.0341   -0.0579    0.0063    1    0.0438    0.0568
   22   -2    0    0    0.2830    0.3311    0.3053    0.3413    0.0245    0    0.0898    0.0899
   23   -2   -1    1    0.0323    0.2651    0.0347    0.2716    0.0069    1    0.0813    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7310   -0.0561   -0.7310   -0.0567    0.0006    1          0.0663          0.0702
    2    2    3   -1   -0.0133   -0.1739   -0.0130   -0.1762    0.0023    1          0.0996          0.0995
    3   -2   -2    2   -0.0263    0.0895   -0.0262    0.0895    0.0002    1          0.0975          0.0967
    4    1    3    0   -0.1963   -0.5853   -0.1957   -0.5833    0.0021    1          0.1030          0.1078
    5    1    2   -1    0.0564   -0.2235    0.0560   -0.2234    0.0005    1          0.0642          0.0654
    6   -1   -1    2   -0.1072    0.1195   -0.1085    0.1216    0.0024    1          0.0768          0.0778
    7    1    4   -1    0.1199   -0.5962    0.1201   -0.5973    0.0012    1          0.1318          0.1302
    8    1    3   -2    0.1436   -0.2202    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    0    0    2   -0.1949    0.0482   -0.1952    0.0486    0.0005    1          0.0780          0.0726
   10    0    1   -1    0.2254   -0.1269    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    0    3   -1    0.5369   -0.6127    0.5303   -0.6130    0.0065    1          0.1239          0.1248
   12    1    1    2   -0.1811   -0.0383   -0.1829   -0.0381    0.0017    1          0.1003          0.0984
   13   -1    1   -2    0.1971   -0.0084    0.1990   -0.0092    0.0020    1          0.1007          0.0927
   14   -1    3   -2    0.5294   -0.1476    0.5293   -0.1451    0.0025    1          0.1490          0.1473
   15    1    2    1   -0.3355   -0.2363   -0.3362   -0.2357    0.0009    1          0.0875          0.0881
   16   -1    0   -1    0.1256    0.0352    0.1275    0.0362    0.0021    1          0.0624          0.0679
   17   -1    2   -1    0.7281   -0.0779    0.7293   -0.0807    0.0031    1          0.1149          0.1198
   18   -1    4   -1    1.0624   -0.5067    1.0696   -0.4972    0.0119    1          0.2522          0.2483
   19   -2   -1   -1    0.0437    0.0284    0.0442    0.0295    0.0012    1          0.0973          0.0994
   20   -2    1   -1    0.4423    0.1650    0.4423    0.1634    0.0016    1          0.1186          0.1178
   21    1    1    0   -0.0335   -0.0578   -0.0341   -0.0579    0.0007    1          0.0435          0.0568
   22   -2    0    0    0.2971    0.3323    0.3053    0.3413    0.0122    1          0.0901          0.0899
   23   -2   -1    1    0.0353    0.2714    0.0347    0.2716    0.0006    1          0.0806          0.0816

###            No.2                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8623    1.4206    0.8647   90.6427  109.2208   90.6109      0.3749
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8649    1.4209    0.8645   90.0000  109.7358   90.0000      0.3584         1.0004    1.6436    2.4134    3.9649    2.4123
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0052    0.0236    0.0143    0.0000    0.9583    0.0000      0.0233         0.0173    0.0308    0.1573    0.2657    0.1616
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7389    0.8457   -0.4974)
 a2 = (   -0.0170    0.3792    0.5930)
 a3 = (    1.1653   -0.2902    0.2416)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7475    0.8367   -0.5002) (    0.0109    0.0090    0.0057)
 a2 = (   -0.0277    0.3789    0.5924) (    0.0034    0.0091    0.0088)
 a3 = (    1.1693   -0.2914    0.2410) (    0.0215    0.0113    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -25.8126   69.2433   57.9485    0.3174    0.4854    0.5786
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0073      0.0021    0.0024    0.0151

# Number of computed bands
            133            157
# Figure of merit at the beginning and the end of the refinement
         9.4119        12.3074
# Chi-squares at the beginning and the end of the refinement
    0.1912    0.0286
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0699    0.0702
    2    2    3   -1   -0.0145   -0.1728   -0.0130   -0.1762    0.0037    1    0.1055    0.0995
    3   -2   -2    2   -0.0260    0.0888   -0.0262    0.0895    0.0007    1    0.1031    0.0967
    4    1    3    0   -0.2001   -0.5768   -0.1957   -0.5833    0.0079    1    0.1089    0.1078
    5    1    2   -1    0.0542   -0.2228    0.0560   -0.2234    0.0019    1    0.0678    0.0654
    6   -1   -1    2   -0.1066    0.1197   -0.1085    0.1216    0.0026    1    0.0809    0.0778
    7    1    4   -1    0.1109   -0.5950    0.1201   -0.5973    0.0096    1    0.1391    0.1302
    8    1    3   -2    0.1415   -0.2208    0.1454   -0.2240    0.0050    1    0.1085    0.1017
    9    0    0    2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0821    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0482    0.0467
   11    0    3   -1    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1308    0.1248
   12    1    1    2   -0.1815   -0.0383   -0.1829   -0.0381    0.0014    1    0.1058    0.0984
   13   -1    1   -2    0.1965   -0.0072    0.1990   -0.0092    0.0031    1    0.1054    0.0927
   14   -1    3   -2    0.5330   -0.1490    0.5293   -0.1451    0.0054    1    0.1562    0.1473
   15    1    2    1   -0.3330   -0.2339   -0.3362   -0.2357    0.0037    1    0.0927    0.0881
   16   -1    0   -1    0.1238    0.0361    0.1275    0.0362    0.0037    1    0.0655    0.0679
   17   -1    2   -1    0.7358   -0.0770    0.7293   -0.0807    0.0075    1    0.1210    0.1198
   18   -1    4   -1    1.0767   -0.5248    1.0696   -0.4972    0.0285    1    0.2700    0.2483
   19   -2   -1   -1    0.0418    0.0283    0.0442    0.0295    0.0027    1    0.1027    0.0994
   20   -2    1   -1    0.4410    0.1694    0.4423    0.1634    0.0062    1    0.1244    0.1178
   21    1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0461    0.0568
   22   -2    0    0    0.2914    0.3335    0.3053    0.3413    0.0159    1    0.0947    0.0899
   23   -2   -1    1    0.0336    0.2683    0.0347    0.2716    0.0035    1    0.0852    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7307   -0.0566   -0.7310   -0.0567    0.0003    1          0.0662          0.0702
    2    2    3   -1   -0.0132   -0.1736   -0.0130   -0.1762    0.0026    1          0.0994          0.0995
    3   -2   -2    2   -0.0269    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4    1    3    0   -0.1968   -0.5861   -0.1957   -0.5833    0.0029    1          0.1028          0.1078
    5    1    2   -1    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6   -1   -1    2   -0.1082    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    1    4   -1    0.1205   -0.5969    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    1    3   -2    0.1440   -0.2198    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    0    0    2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0782          0.0726
   10    0    1   -1    0.2255   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0    3   -1    0.5376   -0.6131    0.5303   -0.6130    0.0073    1          0.1237          0.1248
   12    1    1    2   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13   -1    1   -2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14   -1    3   -2    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15    1    2    1   -0.3358   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16   -1    0   -1    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17   -1    2   -1    0.7295   -0.0791    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18   -1    4   -1    1.0631   -0.5091    1.0696   -0.4972    0.0136    1          0.2516          0.2483
   19   -2   -1   -1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20   -2    1   -1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21    1    1    0   -0.0332   -0.0571   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22   -2    0    0    0.2995    0.3344    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -2   -1    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.3                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8643    1.4189    0.8653   89.0448  109.5147   90.3377      0.3624
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8649    1.4209    0.8645   90.0000  109.7359   90.0000      0.3584         1.0004    1.6436    2.4134    3.9648    2.4123
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0052    0.0236    0.0143    0.0000    0.9583    0.0000      0.0233         0.0173    0.0308    0.1573    0.2657    0.1616
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7441   -0.8319    0.5111)
 a2 = (   -0.0170    0.3796    0.5937)
 a3 = (   -1.1666    0.2905   -0.2418)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7475   -0.8367    0.5002) (    0.0109    0.0090    0.0057)
 a2 = (   -0.0277    0.3789    0.5924) (    0.0034    0.0091    0.0088)
 a3 = (   -1.1693    0.2914   -0.2410) (    0.0215    0.0113    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   25.8127  110.7568 -122.0515    0.3174    0.4854    0.5786
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0073      0.0021    0.0024    0.0151

# Number of computed bands
            135            157
# Figure of merit at the beginning and the end of the refinement
         8.5872        12.3071
# Chi-squares at the beginning and the end of the refinement
    0.2899    0.0286
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0676    0.0702
    2   -2    3    1   -0.0145   -0.1659   -0.0130   -0.1762    0.0104    1    0.1008    0.0995
    3    2   -2   -2   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0990    0.0967
    4   -1    3    0   -0.2017   -0.5735   -0.1957   -0.5833    0.0115    1    0.1043    0.1078
    5   -1    2    1    0.0529   -0.2180    0.0560   -0.2234    0.0062    1    0.0649    0.0654
    6    1   -1   -2   -0.1112    0.1241   -0.1085    0.1216    0.0038    1    0.0781    0.0778
    7   -1    4    1    0.1103   -0.5936    0.1201   -0.5973    0.0105    1    0.1335    0.1302
    8   -1    3    2    0.1401   -0.2180    0.1454   -0.2240    0.0079    1    0.1042    0.1017
    9    0    0   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0795    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    0    3    1    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1265    0.1248
   12   -1    1   -2   -0.1775   -0.0366   -0.1829   -0.0381    0.0056    1    0.1022    0.0984
   13    1    1    2    0.2004   -0.0083    0.1990   -0.0092    0.0016    1    0.1024    0.0927
   14    1    3    2    0.5350   -0.1518    0.5293   -0.1451    0.0088    1    0.1520    0.1473
   15   -1    2   -1   -0.3305   -0.2290   -0.3362   -0.2357    0.0088    1    0.0891    0.0881
   16    1    0    1    0.1304    0.0370    0.1275    0.0362    0.0031    1    0.0635    0.0679
   17    1    2    1    0.7397   -0.0828    0.7293   -0.0807    0.0106    1    0.1182    0.1198
   18    1    4    1    1.0743   -0.5304    1.0696   -0.4972    0.0336    1    0.2625    0.2483
   19    2   -1    1    0.0491    0.0326    0.0442    0.0295    0.0058    1    0.0992    0.0994
   20    2    1    1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1216    0.1178
   21   -1    1    0   -0.0301   -0.0501   -0.0341   -0.0579    0.0088    1    0.0442    0.0568
   22    2    0    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0925    0.0899
   23    2   -1   -1    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.0824    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7307   -0.0566   -0.7310   -0.0567    0.0003    1          0.0662          0.0702
    2   -2    3    1   -0.0132   -0.1736   -0.0130   -0.1762    0.0026    1          0.0994          0.0995
    3    2   -2   -2   -0.0269    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4   -1    3    0   -0.1968   -0.5861   -0.1957   -0.5833    0.0029    1          0.1028          0.1078
    5   -1    2    1    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6    1   -1   -2   -0.1082    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7   -1    4    1    0.1205   -0.5969    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8   -1    3    2    0.1440   -0.2198    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9    0    0   -2   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0782          0.0726
   10    0    1    1    0.2255   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0    3    1    0.5376   -0.6131    0.5303   -0.6130    0.0073    1          0.1237          0.1248
   12   -1    1   -2   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    1    1    2    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    1    3    2    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -1    2   -1   -0.3358   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16    1    0    1    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    1    2    1    0.7295   -0.0791    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    1    4    1    1.0631   -0.5091    1.0696   -0.4972    0.0136    1          0.2516          0.2483
   19    2   -1    1    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    2    1    1    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21   -1    1    0   -0.0332   -0.0571   -0.0341   -0.0579    0.0013    1          0.0435          0.0568
   22    2    0    0    0.2995    0.3344    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    2   -1   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.5                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8635    1.4161    0.8678   89.6623  109.5147   90.9552      0.3616
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8645    1.4209    0.8649   90.0000  109.7358   90.0000      0.3584         0.9996    1.6429    2.4123    3.9649    2.4134
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0052    0.0268    0.0171    0.0000    0.9583    0.0000      0.0238         0.0172    0.0298    0.1606    0.2733    0.1670
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.1690    0.2911   -0.2423)
 a2 = (    0.0170   -0.3804   -0.5949)
 a3 = (   -0.7411   -0.8285    0.5090)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.1693    0.2914   -0.2410) (    0.0035    0.0111    0.0065)
 a2 = (    0.0277   -0.3789   -0.5924) (    0.0036    0.0089    0.0109)
 a3 = (   -0.7475   -0.8367    0.5002) (    0.0153    0.0193    0.0088)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.8873   59.8062  -20.6736    0.3474    0.4356    0.5648
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0004    0.0005   -0.0073      0.0021    0.0024    0.0151

# Number of computed bands
            135            158
# Figure of merit at the beginning and the end of the refinement
         9.0473        12.2813
# Chi-squares at the beginning and the end of the refinement
    0.0587    0.0286
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0676    0.0702
    2    1   -3   -2   -0.0143   -0.1685   -0.0130   -0.1762    0.0078    1    0.1006    0.0995
    3   -2    2    2   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.0988    0.0967
    4    0   -3   -1   -0.2021   -0.5768   -0.1957   -0.5833    0.0091    1    0.1045    0.1078
    5    1   -2   -1    0.0540   -0.2199    0.0560   -0.2234    0.0040    1    0.0649    0.0654
    6   -2    1    1   -0.1107    0.1229   -0.1085    0.1216    0.0026    1    0.0780    0.0778
    7    1   -4   -1    0.1118   -0.5955    0.1201   -0.5973    0.0085    1    0.1337    0.1302
    8    2   -3   -1    0.1412   -0.2187    0.1454   -0.2240    0.0067    1    0.1042    0.1017
    9   -2    0    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0795    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1   -3    0    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1265    0.1248
   12   -2   -1   -1   -0.1788   -0.0366   -0.1829   -0.0381    0.0043    1    0.1021    0.0984
   13    2   -1    1    0.1996   -0.0086    0.1990   -0.0092    0.0009    1    0.1022    0.0927
   14    2   -3    1    0.5343   -0.1527    0.5293   -0.1451    0.0091    1    0.1518    0.1473
   15   -1   -2   -1   -0.3327   -0.2302   -0.3362   -0.2357    0.0065    1    0.0890    0.0881
   16    1    0    1    0.1294    0.0364    0.1275    0.0362    0.0019    1    0.0633    0.0679
   17    1   -2    1    0.7394   -0.0849    0.7293   -0.0807    0.0109    1    0.1179    0.1198
   18    1   -4    1    1.0723   -0.5334    1.0696   -0.4972    0.0364    1    0.2621    0.2483
   19    1    1    2    0.0477    0.0316    0.0442    0.0295    0.0041    1    0.0988    0.0994
   20    1   -1    2    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1210    0.1178
   21    0   -1   -1   -0.0313   -0.0522   -0.0341   -0.0579    0.0064    1    0.0440    0.0568
   22    0    0    2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0920    0.0899
   23   -1    1    2    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.0819    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7307   -0.0566   -0.7310   -0.0567    0.0003    1          0.0662          0.0702
    2    1   -3   -2   -0.0132   -0.1736   -0.0130   -0.1762    0.0026    1          0.0994          0.0995
    3   -2    2    2   -0.0269    0.0908   -0.0262    0.0895    0.0015    1          0.0975          0.0967
    4    0   -3   -1   -0.1968   -0.5861   -0.1957   -0.5833    0.0029    1          0.1028          0.1078
    5    1   -2   -1    0.0567   -0.2233    0.0560   -0.2234    0.0008    1          0.0642          0.0654
    6   -2    1    1   -0.1082    0.1201   -0.1085    0.1216    0.0015    1          0.0769          0.0778
    7    1   -4   -1    0.1205   -0.5969    0.1201   -0.5973    0.0006    1          0.1316          0.1302
    8    2   -3   -1    0.1440   -0.2198    0.1454   -0.2240    0.0044    1          0.1031          0.1017
    9   -2    0    0   -0.1951    0.0482   -0.1952    0.0486    0.0004    1          0.0782          0.0726
   10    1   -1    0    0.2255   -0.1266    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -3    0    0.5376   -0.6131    0.5303   -0.6130    0.0073    1          0.1237          0.1248
   12   -2   -1   -1   -0.1810   -0.0380   -0.1829   -0.0381    0.0019    1          0.1004          0.0984
   13    2   -1    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1009          0.0927
   14    2   -3    1    0.5300   -0.1480    0.5293   -0.1451    0.0030    1          0.1490          0.1473
   15   -1   -2   -1   -0.3358   -0.2359   -0.3362   -0.2357    0.0004    1          0.0875          0.0881
   16    1    0    1    0.1264    0.0353    0.1275    0.0362    0.0014    1          0.0625          0.0679
   17    1   -2    1    0.7295   -0.0791    0.7293   -0.0807    0.0017    1          0.1149          0.1198
   18    1   -4    1    1.0631   -0.5091    1.0696   -0.4972    0.0136    1          0.2516          0.2483
   19    1    1    2    0.0445    0.0289    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20    1   -1    2    0.4445    0.1650    0.4423    0.1634    0.0027    1          0.1187          0.1178
   21    0   -1   -1   -0.0332   -0.0571   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    0    0    2    0.2995    0.3344    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -1    1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.7                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8646    1.4084    0.8734   91.0020  109.8348   90.9707      0.3938
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8625    1.4119    0.8697   90.0000  109.2356   90.0000      0.3581         0.9918    1.6234    2.4087    3.9429    2.4287
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0126    0.0363    0.0158    0.0000    2.3937    0.0000      0.0245         0.0196    0.0333    0.1684    0.2881    0.1718
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2012    0.7842   -0.9258)
 a2 = (    0.5980   -0.3386   -0.1798)
 a3 = (   -0.5113   -0.4246   -1.0202)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1792    0.7972   -0.9166) (    0.0232    0.0162    0.0183)
 a2 = (    0.5973   -0.3372   -0.1765) (    0.0160    0.0102    0.0039)
 a3 = (   -0.5361   -0.4216   -1.0089) (    0.0134    0.0231    0.0226)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -108.4575  128.0968  -41.0839    0.3690    1.4735    0.5854
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            161            153
# Figure of merit at the beginning and the end of the refinement
         6.6338        11.7506
# Chi-squares at the beginning and the end of the refinement
    0.4976    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0741    0.0702
    2    2   -2   -2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1101    0.0995
    3   -2    3    1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.1076    0.0967
    4    1   -1   -2   -0.1892   -0.5963   -0.1957   -0.5833    0.0145    1    0.1150    0.1078
    5    1   -2   -1    0.0579   -0.2258    0.0560   -0.2234    0.0031    1    0.0713    0.0654
    6   -1    3    0   -0.1066    0.1204   -0.1085    0.1216    0.0022    1    0.0845    0.0778
    7    1   -3   -2    0.1285   -0.5967    0.1201   -0.5973    0.0083    1    0.1477    0.1302
    8    1   -4   -1    0.1455   -0.2220    0.1454   -0.2240    0.0020    1    0.1150    0.1017
    9    0    3   -1   -0.1957    0.0502   -0.1952    0.0486    0.0017    1    0.0855    0.0726
   10    0   -2    0    0.2276   -0.1289    0.2251   -0.1274    0.0029    1    0.0514    0.0467
   11    0   -3   -1    0.5378   -0.6038    0.5303   -0.6130    0.0118    1    0.1390    0.1248
   12    1    3   -2   -0.1829   -0.0374   -0.1829   -0.0381    0.0006    1    0.1098    0.0984
   13   -1   -4    1    0.2008   -0.0094    0.1990   -0.0092    0.0018    1    0.1117    0.0927
   14   -1   -5    0    0.5289   -0.1506    0.5293   -0.1451    0.0055    1    0.1673    0.1473
   15    1    1   -2   -0.3409   -0.2423   -0.3362   -0.2357    0.0081    1    0.0964    0.0881
   16   -1   -2    1    0.1289    0.0359    0.1275    0.0362    0.0015    1    0.0689    0.0679
   17   -1   -3    0    0.7245   -0.0841    0.7293   -0.0807    0.0059    1    0.1290    0.1198
   18   -1   -4   -1    1.0422   -0.4979    1.0696   -0.4972    0.0274    1    0.2801    0.2483
   19   -2   -2    2    0.0452    0.0300    0.0442    0.0295    0.0012    1    0.1070    0.0994
   20   -2   -3    1    0.4479    0.1616    0.4423    0.1634    0.0058    1    0.1326    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0478    0.0568
   22   -2   -1    1    0.3044    0.3331    0.3053    0.3413    0.0083    1    0.1002    0.0899
   23   -2    1    1    0.0372    0.2745    0.0347    0.2716    0.0038    1    0.0890    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    2   -3   -2    0.0217   -0.2066   -0.0130   -0.1762    0.0461    1          0.1129          0.0995
    3   -2    3    1   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4    1   -1   -2   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    1   -2   -1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -1    3    0   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    1   -3   -2    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    1   -4   -1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    0    3   -1   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0   -2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    0   -3   -1    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12    1    3   -2   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13   -1   -4    1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14   -1   -5    0    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15    1    1   -2   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16   -1   -2    1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17   -1   -3    0    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18   -1   -4   -1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19   -2   -3    2    0.0902    0.0394    0.0442    0.0295    0.0470    1          0.1094          0.0994
   20   -2   -3    1    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    1    0   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -2   -1    1    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23   -2    1    1    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.8                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8653    1.4121    0.8728   90.1009  110.3296   90.1101      0.3821
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8697    1.4119    0.8625   90.0000  109.2356   90.0000      0.3581         1.0083    1.6369    2.4287    3.9428    2.4087
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0127    0.0458    0.0255    0.0000    2.3937    0.0000      0.0234         0.0199    0.0285    0.1626    0.2877    0.1728
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5440    0.4260    1.0206)
 a2 = (   -0.5962    0.3375    0.1792)
 a3 = (   -0.1663   -0.7790    0.9265)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5361    0.4216    1.0089) (    0.0058    0.0222    0.0109)
 a2 = (   -0.5973    0.3372    0.1765) (    0.0199    0.0127    0.0037)
 a3 = (   -0.1792   -0.7972    0.9166) (    0.0257    0.0299    0.0131)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   73.2620   59.8979  -20.8700    0.3877    1.1504    0.4268
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            155            153
# Figure of merit at the beginning and the end of the refinement
         7.9512        11.7505
# Chi-squares at the beginning and the end of the refinement
    0.0892    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0718    0.0702
    2    2    2   -2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1065    0.0995
    3   -1   -3    2   -0.0274    0.0900   -0.0262    0.0895    0.0014    1    0.1043    0.0967
    4    2    1   -1   -0.1976   -0.5912   -0.1957   -0.5833    0.0081    1    0.1116    0.1078
    5    1    2   -1    0.0579   -0.2258    0.0560   -0.2234    0.0031    1    0.0690    0.0654
    6    0   -3    1   -0.1080    0.1193   -0.1085    0.1216    0.0024    1    0.0825    0.0778
    7    2    3   -1    0.1214   -0.6005    0.1201   -0.5973    0.0034    1    0.1431    0.1302
    8    1    4   -1    0.1455   -0.2220    0.1454   -0.2240    0.0020    1    0.1112    0.1017
    9    1   -3    0   -0.1947    0.0490   -0.1952    0.0486    0.0006    1    0.0838    0.0726
   10    0    2    0    0.2276   -0.1289    0.2251   -0.1274    0.0029    1    0.0497    0.0467
   11    1    3    0    0.5359   -0.6195    0.5303   -0.6130    0.0086    1    0.1351    0.1248
   12    2   -3   -1   -0.1821   -0.0370   -0.1829   -0.0381    0.0013    1    0.1074    0.0984
   13   -1    4    1    0.2008   -0.0094    0.1990   -0.0092    0.0018    1    0.1081    0.0927
   14    0    5    1    0.5345   -0.1543    0.5293   -0.1451    0.0106    1    0.1616    0.1473
   15    2   -1   -1   -0.3396   -0.2374   -0.3362   -0.2357    0.0037    1    0.0941    0.0881
   16   -1    2    1    0.1289    0.0359    0.1275    0.0362    0.0015    1    0.0666    0.0679
   17    0    3    1    0.7384   -0.0882    0.7293   -0.0807    0.0118    1    0.1253    0.1198
   18    1    4    1    1.0645   -0.5288    1.0696   -0.4972    0.0321    1    0.2774    0.2483
   19   -2    2    2    0.0452    0.0300    0.0442    0.0295    0.0012    1    0.1035    0.0994
   20   -1    3    2    0.4538    0.1654    0.4423    0.1634    0.0116    1    0.1277    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0462    0.0568
   22   -1    1    2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0966    0.0899
   23   -1   -1    2    0.0335    0.2773    0.0347    0.2716    0.0058    1    0.0860    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0662          0.0702
    2    2    3   -2    0.0217   -0.2066   -0.0130   -0.1762    0.0461    1          0.1129          0.0995
    3   -1   -3    2   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4    2    1   -1   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1029          0.1078
    5    1    2   -1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    0   -3    1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7    2    3   -1    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8    1    4   -1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9    1   -3    0   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    1    3    0    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12    2   -3   -1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13   -1    4    1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    0    5    1    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1492          0.1473
   15    2   -1   -1   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16   -1    2    1    0.1271    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    0    3    1    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18    1    4    1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2515          0.2483
   19   -2    3    2    0.0902    0.0394    0.0442    0.0295    0.0470    1          0.1094          0.0994
   20   -1    3    2    0.4452    0.1660    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21    1    0   -1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22   -1    1    2    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23   -1   -1    2    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.10                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8610    1.4177    0.8717   90.4724  109.9463   90.4672      0.3957
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8697    1.4119    0.8625   90.0000  109.2346   90.0000      0.3581         1.0083    1.6369    2.4288    3.9429    2.4087
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0127    0.0458    0.0255    0.0000    2.3938    0.0000      0.0234         0.0199    0.0285    0.1627    0.2877    0.1728
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5602   -0.4260   -1.0157)
 a2 = (   -0.5943    0.3365    0.1767)
 a3 = (    0.1541    0.7858   -0.9212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5361   -0.4216   -1.0089) (    0.0058    0.0222    0.0109)
 a2 = (   -0.5973    0.3372    0.1765) (    0.0199    0.0127    0.0037)
 a3 = (    0.1792    0.7972   -0.9166) (    0.0257    0.0299    0.0131)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -73.2622  120.1026  159.1300    0.3877    1.1504    0.4268
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004   -0.0068      0.0023    0.0024    0.0430

# Number of computed bands
            137            155
# Figure of merit at the beginning and the end of the refinement
         7.0851        11.6992
# Chi-squares at the beginning and the end of the refinement
    0.3193    0.0307
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0742    0.0702
    2   -2    2    2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1106    0.0995
    3    1   -3   -2   -0.0275    0.0903   -0.0262    0.0895    0.0015    1    0.1084    0.0967
    4   -2    1    1   -0.2008   -0.5827   -0.1957   -0.5833    0.0051    1    0.1152    0.1078
    5   -1    2    1    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0714    0.0654
    6    0   -3   -1   -0.1084    0.1195   -0.1085    0.1216    0.0021    1    0.0857    0.0778
    7   -2    3    1    0.1148   -0.5976    0.1201   -0.5973    0.0053    1    0.1473    0.1302
    8   -1    4    1    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1148    0.1017
    9   -1   -3    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0872    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0512    0.0467
   11   -1    3    0    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1388    0.1248
   12   -2   -3    1   -0.1821   -0.0374   -0.1829   -0.0381    0.0010    1    0.1118    0.0984
   13    1    4   -1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1116    0.0927
   14    0    5   -1    0.5334   -0.1530    0.5293   -0.1451    0.0089    1    0.1658    0.1473
   15   -2   -1    1   -0.3365   -0.2343   -0.3362   -0.2357    0.0014    1    0.0978    0.0881
   16    1    2   -1    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0690    0.0679
   17    0    3   -1    0.7393   -0.0854    0.7293   -0.0807    0.0110    1    0.1286    0.1198
   18   -1    4   -1    1.0727   -0.5366    1.0696   -0.4972    0.0396    1    0.2872    0.2483
   19    2    2   -2    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1076    0.0994
   20    1    3   -2    0.4493    0.1674    0.4423    0.1634    0.0080    1    0.1314    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0481    0.0568
   22    1    1   -2    0.2996    0.3402    0.3053    0.3413    0.0058    1    0.0997    0.0899
   23    1   -1   -2    0.0322    0.2747    0.0347    0.2716    0.0039    1    0.0893    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7353   -0.0552   -0.7310   -0.0567    0.0045    1          0.0661          0.0702
    2   -2    3    2    0.0217   -0.2066   -0.0130   -0.1762    0.0461    1          0.1129          0.0995
    3    1   -3   -2   -0.0266    0.0897   -0.0262    0.0895    0.0005    1          0.0978          0.0967
    4   -2    1    1   -0.1939   -0.5868   -0.1957   -0.5833    0.0039    1          0.1028          0.1078
    5   -1    2    1    0.0564   -0.2230    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6    0   -3   -1   -0.1070    0.1196   -0.1085    0.1216    0.0024    1          0.0769          0.0778
    7   -2    3    1    0.1212   -0.5948    0.1201   -0.5973    0.0027    1          0.1318          0.1302
    8   -1    4    1    0.1433   -0.2201    0.1454   -0.2240    0.0045    1          0.1034          0.1017
    9   -1   -3    0   -0.1948    0.0489   -0.1952    0.0486    0.0005    1          0.0778          0.0726
   10    0    2    0    0.2256   -0.1278    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11   -1    3    0    0.5357   -0.6117    0.5303   -0.6130    0.0055    1          0.1238          0.1248
   12   -2   -3    1   -0.1813   -0.0379   -0.1829   -0.0381    0.0015    1          0.0999          0.0984
   13    1    4   -1    0.1987   -0.0088    0.1990   -0.0092    0.0005    1          0.1006          0.0927
   14    0    5   -1    0.5304   -0.1494    0.5293   -0.1451    0.0044    1          0.1491          0.1473
   15   -2   -1    1   -0.3364   -0.2376   -0.3362   -0.2357    0.0019    1          0.0872          0.0881
   16    1    2   -1    0.1272    0.0358    0.1275    0.0362    0.0005    1          0.0623          0.0679
   17    0    3   -1    0.7300   -0.0799    0.7293   -0.0807    0.0011    1          0.1150          0.1198
   18   -1    4   -1    1.0604   -0.5082    1.0696   -0.4972    0.0144    1          0.2514          0.2483
   19    2    3   -2    0.0902    0.0394    0.0442    0.0295    0.0470    1          0.1094          0.0994
   20    1    3   -2    0.4452    0.1659    0.4423    0.1634    0.0038    1          0.1187          0.1178
   21   -1    0    1   -0.0332   -0.0572   -0.0341   -0.0579    0.0012    1          0.0435          0.0568
   22    1    1   -2    0.2981    0.3349    0.3053    0.3413    0.0096    1          0.0901          0.0899
   23    1   -1   -2    0.0345    0.2724    0.0347    0.2716    0.0008    1          0.0808          0.0816

###            No.11                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8500    1.4305    0.8751   90.5786  109.9037   91.5424      0.4522
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8670    1.4120    0.8655   90.0000  109.3084   90.0000      0.3580         1.0018    1.6314    2.4220    3.9443    2.4178
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0170    0.0589    0.0334    0.0000    3.2060    0.0000      0.0252         0.0278    0.0343    0.1770    0.3229    0.1941
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5256    0.4700    1.0344)
 a2 = (   -0.5893    0.3336    0.1752)
 a3 = (   -0.1790   -0.7552    0.9355)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5394    0.4258    1.0106) (    0.0073    0.0342    0.0165)
 a2 = (   -0.5971    0.3375    0.1765) (    0.0261    0.0159    0.0043)
 a3 = (   -0.1764   -0.7915    0.9172) (    0.0332    0.0397    0.0186)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   73.2316   59.7291  -20.8442    0.5175    1.7243    0.5727
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002   -0.0063      0.0025    0.0024    0.0577

# Number of computed bands
            400            163
# Figure of merit at the beginning and the end of the refinement
         2.6895        11.4177
# Chi-squares at the beginning and the end of the refinement
    1.3985    0.0268
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7593   -0.0929   -0.7310   -0.0567    0.0460    0    0.0871    0.0702
    2    2    2   -2   -0.0129   -0.1749   -0.0130   -0.1762    0.0013    1    0.1273    0.0995
    3   -1   -3    2   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.1228    0.0967
    4    2    1   -1   -0.1853   -0.5864   -0.1957   -0.5833    0.0109    1    0.1340    0.1078
    5    1    2   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0819    0.0654
    6    0   -3    1   -0.1162    0.1284   -0.1085    0.1216    0.0103    1    0.0962    0.0778
    7    2    3   -1    0.1180   -0.5917    0.1201   -0.5973    0.0060    1    0.1707    0.1302
    8    1    4   -1    0.1423   -0.2205    0.1454   -0.2240    0.0047    1    0.1310    0.1017
    9    1   -3    0   -0.2106    0.0488   -0.1952    0.0486    0.0154    1    0.0980    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0580    0.0467
   11    1    3    0    0.5228   -0.6190    0.5303   -0.6130    0.0096    1    0.1598    0.1248
   12    2   -3   -1   -0.1924   -0.0446   -0.1829   -0.0381    0.0116    1    0.1268    0.0984
   13   -1    4    1    0.1963   -0.0070    0.1990   -0.0092    0.0034    1    0.1262    0.0927
   14    0    5    1    0.5340   -0.1560    0.5293   -0.1451    0.0118    1    0.1903    0.1473
   15    2   -1   -1   -0.3376   -0.2526   -0.3362   -0.2357    0.0169    1    0.1130    0.0881
   16   -1    2    1    0.1227    0.0364    0.1275    0.0362    0.0048    1    0.0782    0.0679
   17    0    3    1    0.7386   -0.0932    0.7293   -0.0807    0.0156    1    0.1480    0.1198
   18    1    4    1    1.0439   -0.5448    1.0696   -0.4972    0.0541    0    0.3276    0.2483
   19   -2    2    2    0.0400    0.0275    0.0442    0.0295    0.0047    1    0.1227    0.0994
   20   -1    3    2    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1506    0.1178
   21    1    0   -1   -0.0349   -0.0607   -0.0341   -0.0579    0.0028    1    0.0553    0.0568
   22   -1    1    2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1143    0.0899
   23   -1   -1    2    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.1019    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7340   -0.0572   -0.7310   -0.0567    0.0030    1          0.0663          0.0702
    2    2    3   -2    0.0218   -0.2070   -0.0130   -0.1762    0.0465    1          0.1129          0.0995
    3   -1   -3    2   -0.0266    0.0899   -0.0262    0.0895    0.0006    1          0.0977          0.0967
    4    2    1   -1   -0.1945   -0.5861   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    1    2   -1    0.0566   -0.2233    0.0560   -0.2234    0.0007    1          0.0644          0.0654
    6    0   -3    1   -0.1073    0.1199   -0.1085    0.1216    0.0020    1          0.0769          0.0778
    7    2    3   -1    0.1202   -0.5949    0.1201   -0.5973    0.0025    1          0.1321          0.1302
    8    1    4   -1    0.1435   -0.2201    0.1454   -0.2240    0.0043    1          0.1035          0.1017
    9    1   -3    0   -0.1952    0.0490   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    2    0    0.2256   -0.1276    0.2251   -0.1274    0.0005    1          0.0462          0.0467
   11    1    3    0    0.5337   -0.6132    0.5303   -0.6130    0.0034    1          0.1239          0.1248
   12    2   -3   -1   -0.1818   -0.0378   -0.1829   -0.0381    0.0011    1          0.1001          0.0984
   13   -1    4    1    0.1984   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    0    5    1    0.5303   -0.1504    0.5293   -0.1451    0.0054    1          0.1492          0.1473
   15    2   -1   -1   -0.3365   -0.2375   -0.3362   -0.2357    0.0018    1          0.0874          0.0881
   16   -1    2    1    0.1267    0.0358    0.1275    0.0362    0.0009    1          0.0622          0.0679
   17    0    3    1    0.7308   -0.0823    0.7293   -0.0807    0.0021    1          0.1151          0.1198
   18    1    4    1    1.0587   -0.5147    1.0696   -0.4972    0.0206    1          0.2520          0.2483
   19   -2    3    2    0.0897    0.0393    0.0442    0.0295    0.0466    1          0.1093          0.0994
   20   -1    3    2    0.4462    0.1654    0.4423    0.1634    0.0043    1          0.1185          0.1178
   21    1    0   -1   -0.0335   -0.0575   -0.0341   -0.0579    0.0007    1          0.0434          0.0568
   22   -1    1    2    0.2993    0.3355    0.3053    0.3413    0.0083    1          0.0899          0.0899
   23   -1   -1    2    0.0346    0.2731    0.0347    0.2716    0.0015    1          0.0806          0.0816

###            No.13                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8622    1.4233    0.8656   90.2612  109.7062   90.3122      0.4015
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8608    1.4244    0.8660   90.0000  109.6526   90.0000      0.3479         0.9940    1.6449    2.4741    4.0940    2.4889
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0292    0.1415    0.0775    0.0000    5.4396    0.0000      0.0243         0.0568    0.0312    0.1923    0.4974    0.2828
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4191    0.1494    1.1489)
 a2 = (   -0.3560   -0.6040   -0.0457)
 a3 = (    0.7736   -0.5258    0.7944)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4172    0.1516    1.1509) (    0.0363    0.0273    0.0167)
 a2 = (   -0.3536   -0.6045   -0.0485) (    0.0342    0.0610    0.0036)
 a3 = (    0.7785   -0.5190    0.7926) (    0.0889    0.0454    0.0143)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   94.2388   69.3186   58.1777    0.3301    2.2337    0.3877
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0012   -0.0003    0.0055      0.0023    0.0023    0.1130

# Number of computed bands
            157            157
# Figure of merit at the beginning and the end of the refinement
         6.8940        10.6843
# Chi-squares at the beginning and the end of the refinement
    0.1443    0.3685
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7402   -0.0512   -0.7310   -0.0567    0.0107    1    0.0754    0.0702
    2    1   -4   -1   -0.0129   -0.1729   -0.0130   -0.1762    0.0033    1    0.1119    0.0995
    3   -1    3    2   -0.0275    0.0922   -0.0262    0.0895    0.0031    1    0.1101    0.0967
    4    1   -3    0   -0.1955   -0.5910   -0.1957   -0.5833    0.0077    1    0.1166    0.1078
    5    1   -2   -1    0.0568   -0.2224    0.0560   -0.2234    0.0013    1    0.0724    0.0654
    6   -1    1    2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0868    0.0778
    7    2   -3   -1    0.1231   -0.5969    0.1201   -0.5973    0.0030    1    0.1495    0.1302
    8    2   -2   -2    0.1433   -0.2192    0.1454   -0.2240    0.0053    1    0.1166    0.1017
    9   -1   -1    2   -0.1961    0.0504   -0.1952    0.0486    0.0020    1    0.0879    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0521    0.0467
   11    2   -1   -1    0.5377   -0.6117    0.5303   -0.6130    0.0075    1    0.1410    0.1248
   12   -1   -3    2   -0.1828   -0.0368   -0.1829   -0.0381    0.0013    1    0.1125    0.0984
   13    2    2   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1135    0.0927
   14    3    1   -2    0.5307   -0.1504    0.5293   -0.1451    0.0055    1    0.1693    0.1473
   15    0   -3    1   -0.3400   -0.2375   -0.3362   -0.2357    0.0042    1    0.0984    0.0881
   16    1    2   -1    0.1281    0.0358    0.1275    0.0362    0.0007    1    0.0701    0.0679
   17    2    1   -1    0.7316   -0.0820    0.7293   -0.0807    0.0026    1    0.1310    0.1198
   18    3    0   -1    1.0618   -0.5092    1.0696   -0.4972    0.0144    1    0.2883    0.2483
   19    1    4   -1    0.0454    0.0302    0.0442    0.0295    0.0014    1    0.1090    0.0994
   20    2    3   -1    0.4489    0.1654    0.4423    0.1634    0.0068    1    0.1344    0.1178
   21    0   -2    0   -0.0331   -0.0562   -0.0341   -0.0579    0.0020    1    0.0487    0.0568
   22    1    3    0    0.3023    0.3380    0.3053    0.3413    0.0044    1    0.1020    0.0899
   23    0    3    1    0.0349    0.2767    0.0347    0.2716    0.0050    1    0.0910    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7335   -0.0552   -0.7310   -0.0567    0.0029    1          0.0658          0.0702
    2    1   -4   -1   -0.0113   -0.1767   -0.0130   -0.1762    0.0018    1          0.0976          0.0995
    3   -1    3    2   -0.0254    0.0878   -0.0262    0.0895    0.0018    1          0.0956          0.0967
    4    1   -3    0   -0.1928   -0.5923   -0.1957   -0.5833    0.0094    1          0.1023          0.1078
    5    1   -2   -1    0.0599   -0.2254    0.0560   -0.2234    0.0044    1          0.0633          0.0654
    6   -1    1    2   -0.1052    0.1180   -0.1085    0.1216    0.0048    1          0.0755          0.0778
    7    2   -3   -1    0.1265   -0.5978    0.1201   -0.5973    0.0064    1          0.1311          0.1302
    8    2   -3   -2    0.0985   -0.2305    0.1454   -0.2240    0.0473    1          0.1130          0.1017
    9   -1   -1    2   -0.1928    0.0491   -0.1952    0.0486    0.0024    1          0.0766          0.0726
   10    1    0   -1    0.2279   -0.1269    0.2251   -0.1274    0.0029    1          0.0455          0.0467
   11    2   -1   -1    0.5399   -0.6100    0.5303   -0.6130    0.0100    1          0.1236          0.1248
   12   -1   -3    2   -0.1811   -0.0372   -0.1829   -0.0381    0.0019    1          0.0981          0.0984
   13    2    2   -2    0.1997   -0.0082    0.1990   -0.0092    0.0012    1          0.0989          0.0927
   14    3    1   -2    0.5314   -0.1486    0.5293   -0.1451    0.0041    1          0.1478          0.1473
   15    0   -3    1   -0.3380   -0.2385   -0.3362   -0.2357    0.0033    1          0.0860          0.0881
   16    1    2   -1    0.1276    0.0361    0.1275    0.0362    0.0001    1          0.0610          0.0679
   17    2    1   -1    0.7309   -0.0805    0.7293   -0.0807    0.0016    1          0.1143          0.1198
   18    3    0   -1    1.0605   -0.5078    1.0696   -0.4972    0.0140    1          0.2522          0.2483
   19    1    4   -1    0.0444    0.0292    0.0442    0.0295    0.0004    1          0.0949          0.0994
   20    2    3   -1    0.4471    0.1656    0.4423    0.1634    0.0052    1          0.1169          0.1178
   21    0   -3    0   -0.0336   -0.0592   -0.0341   -0.0579    0.0014    1          0.0636          0.0568
   22    1    3    0    0.2999    0.3362    0.3053    0.3413    0.0075    1          0.0884          0.0899
   23    0    3    1    0.0341    0.2721    0.0347    0.2716    0.0008    1          0.0788          0.0816

###            No.14                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8651    1.4171    0.8665   89.7413  109.6996   90.3972      0.5416
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8656    1.4150    0.8686   90.0000  109.9387   90.0000      0.3580         0.9965    1.6291    2.4176    3.9522    2.4261
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0050    0.0264    0.0127    0.0000    0.9060    0.0000      0.0231         0.0144    0.0276    0.1566    0.2655    0.1605
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9839    0.1089    0.7264)
 a2 = (   -0.2122    0.5653   -0.3653)
 a3 = (   -0.9295   -0.6516   -0.4628)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9878    0.1072    0.7234) (    0.0058    0.0100    0.0074)
 a2 = (   -0.2102    0.5638   -0.3706) (    0.0067    0.0122    0.0049)
 a3 = (   -0.9290   -0.6504   -0.4625) (    0.0157    0.0127    0.0094)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  131.7026  127.9705  -40.8191    0.4841    0.4946    0.5068
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0067      0.0023    0.0023    0.0144

# Number of computed bands
            161            159
# Figure of merit at the beginning and the end of the refinement
         2.3953         9.7805
# Chi-squares at the beginning and the end of the refinement
    1.1448    0.0276
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7213   -0.0546   -0.7310   -0.0567    0.0100    1    0.1002    0.0702
    2    1    3   -2   -0.0136   -0.1779   -0.0130   -0.1762    0.0018    1    0.1524    0.0995
    3   -1   -4    1   -0.0247    0.0826   -0.0262    0.0895    0.0070    1    0.1488    0.0967
    4    1    1   -2   -0.1961   -0.5850   -0.1957   -0.5833    0.0017    1    0.1578    0.1078
    5    1    2   -1    0.0577   -0.2279    0.0560   -0.2234    0.0049    1    0.0985    0.0654
    6   -1   -3    0   -0.1018    0.1134   -0.1085    0.1216    0.0106    1    0.1170    0.0778
    7    1    1   -1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1011    0.1302
    8    2    3   -1    0.1463   -0.2240    0.1454   -0.2240    0.0009    1    0.1586    0.1017
    9   -1   -2   -1   -0.1879    0.0472   -0.1952    0.0486    0.0074    1    0.1187    0.0726
   10    1    1    0    0.2291   -0.1291    0.2251   -0.1274    0.0044    1    0.0707    0.0467
   11    2    1   -1    0.5353   -0.6141    0.5303   -0.6130    0.0050    1    0.1907    0.1248
   12   -1   -1   -2   -0.1773   -0.0365   -0.1829   -0.0381    0.0058    1    0.1527    0.0984
   13    2    1    1    0.2005   -0.0085    0.1990   -0.0092    0.0017    1    0.1541    0.0927
   14    3    1    0    0.5311   -0.1497    0.5293   -0.1451    0.0049    1    0.2292    0.1473
   15    0    0   -1   -0.3339   -0.2341   -0.3362   -0.2357    0.0029    1    0.0665    0.0881
   16    1    0    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0951    0.0679
   17    1    0    0    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.0879    0.1198
   18    3    0   -1    1.0587   -0.5122    1.0696   -0.4972    0.0185    1    0.3893    0.2483
   19    1   -1    2    0.0436    0.0292    0.0442    0.0295    0.0007    1    0.1482    0.0994
   20    2   -1    1    0.4434    0.1650    0.4423    0.1634    0.0019    1    0.1811    0.1178
   21    0    1   -1   -0.0351   -0.0595   -0.0341   -0.0579    0.0018    1    0.0662    0.0568
   22    1   -2    1    0.2951    0.3316    0.3053    0.3413    0.0141    1    0.1368    0.0899
   23    0   -3    1    0.0331    0.2656    0.0347    0.2716    0.0063    1    0.1223    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7319   -0.0561   -0.7310   -0.0567    0.0010    1          0.0662          0.0702
    2    1    3   -2   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0994          0.0995
    3   -1   -4    1   -0.0271    0.0905   -0.0262    0.0895    0.0014    1          0.0974          0.0967
    4    1    1   -2   -0.1962   -0.5871   -0.1957   -0.5833    0.0038    1          0.1028          0.1078
    5    1    2   -1    0.0568   -0.2235    0.0560   -0.2234    0.0009    1          0.0642          0.0654
    6   -1   -3    0   -0.1080    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    2    2   -2    0.1215   -0.5968    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8    2    3   -1    0.1441   -0.2200    0.1454   -0.2240    0.0042    1          0.1032          0.1017
    9   -1   -2   -1   -0.1946    0.0482   -0.1952    0.0486    0.0007    1          0.0781          0.0726
   10    1    1    0    0.2257   -0.1268    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    2    1   -1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1238          0.1248
   12   -1   -1   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0021    1          0.1003          0.0984
   13    2    1    1    0.1981   -0.0086    0.1990   -0.0092    0.0010    1          0.1009          0.0927
   14    3    1    0    0.5297   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    0    0   -2   -0.3362   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16    1    0    1    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17    2    0    0    0.7287   -0.0796    0.7293   -0.0807    0.0013    1          0.1150          0.1198
   18    3    0   -1    1.0607   -0.5072    1.0696   -0.4972    0.0134    1          0.2515          0.2483
   19    1   -1    2    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    2   -1    1    0.4450    0.1646    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    0    1   -1   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    1   -2    1    0.3002    0.3346    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23    0   -3    1    0.0351    0.2742    0.0347    0.2716    0.0026    1          0.0805          0.0816

###            No.15                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8764    1.3857    0.8767   90.2856  110.0568   90.5860      0.3911
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8670    1.4070    0.8688   90.0000  109.3332   90.0000      0.3551         0.9980    1.6195    2.4416    3.9623    2.4466
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0054    0.0261    0.0126    0.0000    1.0249    0.0000      0.0231         0.0139    0.0289    0.1594    0.2678    0.1629
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7983    0.8948   -0.1939)
 a2 = (   -0.4046   -0.2288    0.5522)
 a3 = (    0.3083    0.9806    0.6466)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.8056    0.8983   -0.1953) (    0.0105    0.0099    0.0069)
 a2 = (   -0.3882   -0.2287    0.5497) (    0.0113    0.0047    0.0086)
 a3 = (    0.3289    0.9839    0.6417) (    0.0131    0.0150    0.0098)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -11.6710   52.1560  139.1095    0.3988    0.4626    0.7120
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
            123            115
# Figure of merit at the beginning and the end of the refinement
         6.2262         9.5203
# Chi-squares at the beginning and the end of the refinement
    0.1723    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0736    0.0702
    2    1   -1    2   -0.0127   -0.1764   -0.0130   -0.1762    0.0004    1    0.1090    0.0995
    3   -2    1   -1   -0.0265    0.0900   -0.0262    0.0895    0.0007    1    0.1066    0.0967
    4    0    0    2   -0.1887   -0.6000   -0.1957   -0.5833    0.0181    1    0.1140    0.1078
    5    1    0    1    0.0590   -0.2259    0.0560   -0.2234    0.0040    1    0.0706    0.0654
    6   -2    0    0   -0.1076    0.1207   -0.1085    0.1216    0.0012    1    0.0838    0.0778
    7    1    1    2    0.1336   -0.5988    0.1201   -0.5973    0.0135    1    0.1464    0.1302
    8    2    1    1    0.1472   -0.2210    0.1454   -0.2240    0.0035    1    0.1138    0.1017
    9   -2   -1    1   -0.1964    0.0493   -0.1952    0.0486    0.0014    1    0.0850    0.0726
   10    1    1    0    0.2280   -0.1262    0.2251   -0.1274    0.0031    1    0.0510    0.0467
   11    1    2    1    0.5470   -0.5970    0.5303   -0.6130    0.0231    1    0.1379    0.1248
   12   -2   -2    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1093    0.0984
   13    2    3   -1    0.1992   -0.0078    0.1990   -0.0092    0.0013    1    0.1113    0.0927
   14    2    4    0    0.5274   -0.1435    0.5293   -0.1451    0.0025    1    0.1662    0.1473
   15   -1   -1    2   -0.3410   -0.2427   -0.3362   -0.2357    0.0085    1    0.0957    0.0881
   16    1    2   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0687    0.0679
   17    1    3    0    0.7193   -0.0745    0.7293   -0.0807    0.0118    1    0.1279    0.1198
   18    1    4    1    1.0455   -0.4762    1.0696   -0.4972    0.0319    1    0.2767    0.2483
   19    1    3   -2    0.0446    0.0298    0.0442    0.0295    0.0005    1    0.1067    0.0994
   20    1    4   -1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1320    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0475    0.0568
   22    0    3   -1    0.3017    0.3304    0.3053    0.3413    0.0115    1    0.0998    0.0899
   23   -1    2   -1    0.0375    0.2742    0.0347    0.2716    0.0038    1    0.0884    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    1   -1    2   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -2    1   -1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    0    0    2   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    1    0    1    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6   -2    0    0   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7    1    1    2    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8    2    1    1    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9   -2   -1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10    1    1    0    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    1    2    1    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12   -2   -2    2   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    2    3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2    4    0    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -1   -1    2   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    1    2   -1    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    1    3    0    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18    1    4    1    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19    1    3   -2    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    1    4   -1    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22    0    3   -1    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -1    2   -1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.16                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8746    1.3890    0.8786   90.4119  110.4521   90.1082      0.4271
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8688    1.4070    0.8670   90.0000  109.3333   90.0000      0.3551         1.0020    1.6228    2.4466    3.9623    2.4416
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0055    0.0221    0.0139    0.0000    1.0249    0.0000      0.0227         0.0139    0.0340    0.1574    0.2613    0.1612
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3128   -0.9871   -0.6457)
 a2 = (    0.4036    0.2282   -0.5508)
 a3 = (    0.7911   -0.9015    0.1927)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3289   -0.9839   -0.6417) (    0.0120    0.0058    0.0053)
 a2 = (    0.3882    0.2287   -0.5497) (    0.0098    0.0051    0.0071)
 a3 = (    0.8056   -0.8983    0.1953) (    0.0178    0.0133    0.0071)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -145.7769   69.2770   57.9862    0.3309    0.5821    0.5210
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
            123            115
# Figure of merit at the beginning and the end of the refinement
         4.9485         9.5203
# Chi-squares at the beginning and the end of the refinement
    0.3228    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0802    0.0702
    2   -2    1   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1197    0.0995
    3    1   -1    2   -0.0255    0.0890   -0.0262    0.0895    0.0008    1    0.1169    0.0967
    4   -2    0    0   -0.1884   -0.5944   -0.1957   -0.5833    0.0133    1    0.1246    0.1078
    5   -1    0   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0774    0.0654
    6    0    0    2   -0.1060    0.1208   -0.1085    0.1216    0.0026    1    0.0915    0.0778
    7   -2   -1   -1    0.1280   -0.5955    0.1201   -0.5973    0.0081    1    0.1599    0.1302
    8   -1   -1   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1245    0.1017
    9   -1    1    2   -0.1961    0.0502   -0.1952    0.0486    0.0018    1    0.0925    0.0726
   10    0   -1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0556    0.0467
   11   -1   -2   -1    0.5396   -0.6012    0.5303   -0.6130    0.0150    1    0.1503    0.1248
   12   -2    2    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1191    0.0984
   13    1   -3   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1211    0.0927
   14    0   -4   -2    0.5278   -0.1470    0.5293   -0.1451    0.0024    1    0.1811    0.1473
   15   -2    1    1   -0.3394   -0.2425   -0.3362   -0.2357    0.0075    1    0.1045    0.0881
   16    1   -2   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0748    0.0679
   17    0   -3   -1    0.7208   -0.0781    0.7293   -0.0807    0.0090    1    0.1395    0.1198
   18   -1   -4   -1    1.0427   -0.4862    1.0696   -0.4972    0.0290    1    0.3023    0.2483
   19    2   -3   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1166    0.0994
   20    1   -4   -1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1439    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0521    0.0568
   22    1   -3    0    0.2998    0.3290    0.3053    0.3413    0.0135    1    0.1090    0.0899
   23    1   -2    1    0.0380    0.2713    0.0347    0.2716    0.0034    1    0.0969    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -2    1   -1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -1    2   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2    0    0   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -1    0   -1    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6    0    0    2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7   -2   -1   -1    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8   -1   -1   -2    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9   -1    1    2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10    0   -1   -1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11   -1   -2   -1    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12   -2    2    2   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1   -3   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    0   -4   -2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15   -2    1    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    1   -2   -1    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    0   -3   -1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18   -1   -4   -1    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19    2   -3   -1    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    1   -4   -1    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22    1   -3    0    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    1   -2    1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.18                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0057    0.9875    1.0070   89.9780   90.0376   90.8496      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9976    1.0000    1.0023   90.0000   89.8800   90.0000      0.3574         0.9953    0.9977    2.7914    2.7982    2.8046
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0509    0.0160    0.0000    0.8145    0.0000      0.0316         0.0159    0.0459    0.2466    0.2853    0.2518
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9484   -0.2690    0.1306)
 a2 = (   -0.2012    0.1799   -0.9761)
 a3 = (    0.2352   -0.9391   -0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9563   -0.2706    0.1302) (    0.0026    0.0084    0.0060)
 a2 = (   -0.1830    0.1819   -0.9661) (    0.0153    0.0138    0.0475)
 a3 = (    0.2387   -0.9428   -0.2227) (    0.0103    0.0150    0.0086)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  172.3446  102.8814   14.0838    0.3605    0.4174    0.4939
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002   -0.0027      0.0031    0.0023    0.0476

# Number of computed bands
            133            167
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.4312
# Chi-squares at the beginning and the end of the refinement
    3.0744    0.0242
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2   -1    0   -2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3    0   -1    3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4   -1   -1   -2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0   -1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -1   -1    2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    0   -1   -3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    1    0   -2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -2   -1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    1   -1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -3   -1    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    2    0   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    3   -1   -2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15   -2   -1   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    2   -1   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    2    0    1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20    3   -1    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21   -1    0   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22    2   -1    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23    1   -1    2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7311   -0.0572   -0.7310   -0.0567    0.0005    1          0.0666          0.0702
    2   -1    0   -3   -0.0132   -0.1732   -0.0130   -0.1762    0.0029    1          0.0996          0.0995
    3    0   -1    3   -0.0271    0.0909   -0.0262    0.0895    0.0017    1          0.0976          0.0967
    4   -1   -1   -2   -0.1960   -0.5853   -0.1957   -0.5833    0.0019    1          0.1033          0.1078
    5    0    0   -2    0.0565   -0.2228    0.0560   -0.2234    0.0008    1          0.0643          0.0654
    6   -1   -1    2   -0.1082    0.1202   -0.1085    0.1216    0.0014    1          0.0770          0.0778
    7    0   -1   -3    0.1200   -0.5953    0.1201   -0.5973    0.0020    1          0.1323          0.1302
    8    1    0   -3    0.1435   -0.2195    0.1454   -0.2240    0.0049    1          0.1034          0.1017
    9   -2   -1    1   -0.1951    0.0486   -0.1952    0.0486    0.0001    1          0.0782          0.0726
   10    1    0   -1    0.2251   -0.1268    0.2251   -0.1274    0.0007    1          0.0462          0.0467
   11    1   -1   -2    0.5346   -0.6126    0.5303   -0.6130    0.0043    1          0.1244          0.1248
   12   -3   -1    0   -0.1812   -0.0377   -0.1829   -0.0381    0.0017    1          0.1004          0.0984
   13    3    0   -1    0.1977   -0.0086    0.1990   -0.0092    0.0014    1          0.1009          0.0927
   14    3   -1   -2    0.5293   -0.1494    0.5293   -0.1451    0.0043    1          0.1496          0.1473
   15   -2   -1   -1   -0.3359   -0.2359   -0.3362   -0.2357    0.0004    1          0.0877          0.0881
   16    2    0    0    0.1265    0.0355    0.1275    0.0362    0.0011    1          0.0624          0.0679
   17    2   -1   -1    0.7293   -0.0816    0.7293   -0.0807    0.0009    1          0.1155          0.1198
   18    2   -2   -2    1.0587   -0.5130    1.0696   -0.4972    0.0192    1          0.2534          0.2483
   19    3    0    1    0.0445    0.0293    0.0442    0.0295    0.0004    1          0.0973          0.0994
   20    3   -1    0    0.4456    0.1646    0.4423    0.1634    0.0035    1          0.1190          0.1178
   21   -1    0   -1   -0.0333   -0.0569   -0.0341   -0.0579    0.0013    1          0.0434          0.0568
   22    2   -1    1    0.3004    0.3352    0.3053    0.3413    0.0078    1          0.0902          0.0899
   23    1   -1    2    0.0350    0.2745    0.0347    0.2716    0.0029    1          0.0806          0.0816

###            No.19                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0042    0.9894    1.0073   90.3187   92.0664   90.8309      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9971    1.0016    1.0013   90.0000   90.0329   90.0000      0.3577         0.9958    1.0003    2.7877    2.8002    2.7995
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0149    0.0466    0.0000    1.5987    0.0000      0.0297         0.0463    0.0432    0.2316    0.2363    0.2665
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9505    0.2696   -0.1309)
 a2 = (    0.2542   -0.9516   -0.2272)
 a3 = (   -0.1476    0.1845   -0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9566    0.2717   -0.1300) (    0.0023    0.0059    0.0083)
 a2 = (    0.2378   -0.9437   -0.2230) (    0.0067    0.0138    0.0087)
 a3 = (   -0.1822    0.1821   -0.9649) (    0.0218    0.0171    0.0442)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -149.8765  165.0360 -134.8704    1.3087    0.5549    1.3953
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0048      0.0023    0.0024    0.0457

# Number of computed bands
            400            167
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.4302
# Chi-squares at the beginning and the end of the refinement
    0.1462    0.0242
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    1   -3    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3    0    3   -1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    1   -2   -1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    0   -2    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6    1    2   -1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    0   -3   -1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8   -1   -3    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    2    1   -1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10   -1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11   -1   -2   -1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    3    0   -1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13   -3   -1    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14   -3   -2   -1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    2   -1   -1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -2   -1   -1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18   -2   -2   -2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -3    1    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20   -3    0   -1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1   -1    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -2    1   -1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -1    2   -1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7318   -0.0579   -0.7310   -0.0567    0.0014    1          0.0664          0.0702
    2    1   -3    0   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0996          0.0995
    3    0    3   -1   -0.0266    0.0904   -0.0262    0.0895    0.0011    1          0.0975          0.0967
    4    1   -2   -1   -0.1960   -0.5854   -0.1957   -0.5833    0.0021    1          0.1032          0.1078
    5    0   -2    0    0.0566   -0.2235    0.0560   -0.2234    0.0006    1          0.0643          0.0654
    6    1    2   -1   -0.1077    0.1201   -0.1085    0.1216    0.0017    1          0.0768          0.0778
    7    0   -3   -1    0.1198   -0.5960    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -1   -3    0    0.1438   -0.2203    0.1454   -0.2240    0.0040    1          0.1033          0.1017
    9    2    1   -1   -0.1951    0.0485   -0.1952    0.0486    0.0002    1          0.0781          0.0726
   10   -1   -1    0    0.2258   -0.1272    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11   -1   -2   -1    0.5352   -0.6138    0.5303   -0.6130    0.0050    1          0.1242          0.1248
   12    3    0   -1   -0.1812   -0.0379   -0.1829   -0.0381    0.0017    1          0.1003          0.0984
   13   -3   -1    0    0.1981   -0.0085    0.1990   -0.0092    0.0011    1          0.1008          0.0927
   14   -3   -2   -1    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1494          0.1473
   15    2   -1   -1   -0.3357   -0.2364   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16   -2    0    0    0.1266    0.0356    0.1275    0.0362    0.0010    1          0.0624          0.0679
   17   -2   -1   -1    0.7302   -0.0812    0.7293   -0.0807    0.0010    1          0.1153          0.1198
   18   -2   -2   -2    1.0602   -0.5133    1.0696   -0.4972    0.0186    1          0.2528          0.2483
   19   -3    1    0    0.0444    0.0292    0.0442    0.0295    0.0004    1          0.0973          0.0994
   20   -3    0   -1    0.4455    0.1649    0.4423    0.1634    0.0035    1          0.1188          0.1178
   21    1   -1    0   -0.0334   -0.0572   -0.0341   -0.0579    0.0010    1          0.0435          0.0568
   22   -2    1   -1    0.3000    0.3347    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23   -1    2   -1    0.0353    0.2737    0.0347    0.2716    0.0022    1          0.0806          0.0816

###            No.20                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0008    0.9971    1.0022   90.0865   90.0369   90.2460      0.4757
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9961    1.0001    1.0037   90.0000   89.8315   90.0000      0.3566         0.9924    0.9964    2.7935    2.8047    2.8148
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0401    0.0141    0.0000    0.7793    0.0000      0.0274         0.0139    0.0378    0.2148    0.2433    0.2200
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9530    0.2703   -0.1313)
 a2 = (   -0.1813    0.1844   -0.9691)
 a3 = (   -0.2364    0.9436    0.2222)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9577    0.2713   -0.1301) (    0.0024    0.0081    0.0056)
 a2 = (   -0.1829    0.1825   -0.9659) (    0.0125    0.0118    0.0373)
 a3 = (   -0.2393    0.9410    0.2231) (    0.0094    0.0133    0.0077)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -172.3589   77.0810 -165.9016    0.3334    0.3795    0.4828
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            155            167
# Figure of merit at the beginning and the end of the refinement
         3.5160         9.4072
# Chi-squares at the beginning and the end of the refinement
    1.8743    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7344   -0.0556   -0.7310   -0.0567    0.0036    1    0.0891    0.0702
    2    1    0    3   -0.0135   -0.1716   -0.0130   -0.1762    0.0046    1    0.1331    0.0995
    3    0   -1   -3   -0.0272    0.0922   -0.0262    0.0895    0.0030    1    0.1305    0.0967
    4    1   -1    2   -0.1959   -0.5842   -0.1957   -0.5833    0.0009    1    0.1381    0.1078
    5    0    0    2    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0859    0.0654
    6    1   -1   -2   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.1027    0.0778
    7    0   -1    3    0.1186   -0.5945    0.1201   -0.5973    0.0033    1    0.1769    0.1302
    8   -1    0    3    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1380    0.1017
    9    2   -1   -1   -0.1959    0.0495   -0.1952    0.0486    0.0011    1    0.1041    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11   -1   -1    2    0.5339   -0.6146    0.5303   -0.6130    0.0039    1    0.1667    0.1248
   12    3   -1    0   -0.1815   -0.0374   -0.1829   -0.0381    0.0015    1    0.1337    0.0984
   13   -2    0    1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.0959    0.0927
   14   -3   -1    2    0.5311   -0.1504    0.5293   -0.1451    0.0056    1    0.2003    0.1473
   15    2   -1    1   -0.3361   -0.2360   -0.3362   -0.2357    0.0003    1    0.1169    0.0881
   16   -2    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17   -2   -1    1    0.7323   -0.0816    0.7293   -0.0807    0.0031    1    0.1549    0.1198
   18   -1   -1    1    1.0622   -0.5151    1.0696   -0.4972    0.0194    1    0.1699    0.2483
   19   -3    0   -1    0.0452    0.0302    0.0442    0.0295    0.0012    1    0.1298    0.0994
   20   -3   -1    0    0.4472    0.1662    0.4423    0.1634    0.0056    1    0.1592    0.1178
   21    1    0    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0580    0.0568
   22   -2   -1   -1    0.3005    0.3369    0.3053    0.3413    0.0066    1    0.1209    0.0899
   23   -1   -1   -2    0.0352    0.2755    0.0347    0.2716    0.0039    1    0.1080    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2    1    0    3   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    0   -1   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    1   -1    2   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    0    0    2    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    1   -1   -2   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    0   -1    3    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -1    0    3    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    2   -1   -1   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -1    0    1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -1   -1    2    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    3   -1    0   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13   -3    0    1    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -3   -1    2    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    2   -1    1   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16   -2    0    0    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -2   -1    1    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -2   -2    2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -3    0   -1    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20   -3   -1    0    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    1    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -2   -1   -1    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23   -1   -1   -2    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.21                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0016    0.9963    1.0022   89.8587   90.0476   90.1544      0.3967
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0037    1.0001    0.9961   90.0000   89.8315   90.0000      0.3566         1.0076    1.0040    2.8148    2.8047    2.7935
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0379    0.0139    0.0000    0.7793    0.0000      0.0269         0.0141    0.0403    0.2121    0.2366    0.2141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2364    0.9438    0.2241)
 a2 = (    0.1809   -0.1822    0.9704)
 a3 = (    0.9519    0.2700   -0.1293)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2393    0.9410    0.2231) (    0.0089    0.0028    0.0065)
 a2 = (    0.1829   -0.1825    0.9659) (    0.0121    0.0113    0.0352)
 a3 = (    0.9577    0.2713   -0.1301) (    0.0141    0.0081    0.0058)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   13.0522   97.4086  105.9820    0.3878    0.3094    0.5483
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            147            167
# Figure of merit at the beginning and the end of the refinement
         6.6485         9.4072
# Chi-squares at the beginning and the end of the refinement
    0.1064    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7380   -0.0572   -0.7310   -0.0567    0.0070    1    0.0746    0.0702
    2    3    0    1   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1110    0.0995
    3   -3    1    0   -0.0269    0.0910   -0.0262    0.0895    0.0017    1    0.1087    0.0967
    4    2    1    1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1    0.1156    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0717    0.0654
    6   -2    1    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0856    0.0778
    7    3    1    0    0.1189   -0.5963    0.1201   -0.5973    0.0016    1    0.1479    0.1302
    8    3    0   -1    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1151    0.1017
    9   -1    1    2   -0.1975    0.0499   -0.1952    0.0486    0.0026    1    0.0868    0.0726
   10    1    0   -1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0513    0.0467
   11    2    1   -1    0.5336   -0.6159    0.5303   -0.6130    0.0044    1    0.1392    0.1248
   12    0    1    3   -0.1839   -0.0380   -0.1829   -0.0381    0.0011    1    0.1115    0.0984
   13    1    0   -3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1119    0.0927
   14    2    1   -3    0.5309   -0.1511    0.5293   -0.1451    0.0062    1    0.1667    0.1473
   15    1    1    2   -0.3385   -0.2384   -0.3362   -0.2357    0.0035    1    0.0978    0.0881
   16    0    0   -2    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0692    0.0679
   17    1    1   -2    0.7323   -0.0828    0.7293   -0.0807    0.0036    1    0.1290    0.1198
   18    2    2   -2    1.0613   -0.5180    1.0696   -0.4972    0.0224    1    0.2849    0.2483
   19   -1    0   -3    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1080    0.0994
   20    0    1   -3    0.4464    0.1656    0.4423    0.1634    0.0046    1    0.1323    0.1178
   21    1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0483    0.0568
   22   -1    1   -2    0.2997    0.3359    0.3053    0.3413    0.0079    1    0.1004    0.0899
   23   -2    1   -1    0.0349    0.2740    0.0347    0.2716    0.0024    1    0.0898    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2    3    0    1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3   -3    1    0   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    2    1    1   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    2    0    0    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6   -2    1    1   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    3    1    0    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8    3    0   -1    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9   -1    1    2   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10    1    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11    2    1   -1    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    0    1    3   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13    1    0   -3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14    2    1   -3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15    1    1    2   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    0    0   -2    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17    1    1   -2    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18    2    2   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19   -1    0   -3    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    0    1   -3    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21    1    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22   -1    1   -2    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23   -2    1   -1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.23                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0073    1.0042   92.0664   90.8309   90.3187      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0037    1.0001    0.9961   90.0000   90.1685   90.0000      0.3566         1.0076    1.0040    2.8148    2.8047    2.7935
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0379    0.0139    0.0000    0.7793    0.0000      0.0269         0.0141    0.0403    0.2121    0.2366    0.2141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2542   -0.9516   -0.2272)
 a2 = (   -0.1476    0.1845   -0.9649)
 a3 = (    0.9505    0.2696   -0.1309)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2393   -0.9410   -0.2231) (    0.0089    0.0028    0.0065)
 a2 = (   -0.1829    0.1825   -0.9659) (    0.0121    0.0113    0.0352)
 a3 = (    0.9577    0.2713   -0.1301) (    0.0141    0.0081    0.0058)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -166.9478   97.4086  105.9820    0.3878    0.3094    0.5483
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0003   -0.0031      0.0023    0.0022    0.0391

# Number of computed bands
            400            167
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.4072
# Chi-squares at the beginning and the end of the refinement
    1.4547    0.0288
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2   -3    0    1   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3    3   -1    0   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4   -2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5   -2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6    2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7   -3   -1    0    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8   -3    0   -1    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9    1   -1    2   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11   -2   -1   -1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -1    3   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13   -1    0   -3    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14   -2   -1   -3    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15   -1   -1    2   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    0   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1   -1   -2    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18   -2   -2   -2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19    1    0   -3    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0   -1   -3    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21   -1    0    1   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22    1   -1   -2    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23    2   -1   -1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7304   -0.0572   -0.7310   -0.0567    0.0009    1          0.0664          0.0702
    2   -3    0    1   -0.0132   -0.1741   -0.0130   -0.1762    0.0021    1          0.0992          0.0995
    3    3   -1    0   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4   -2   -1    1   -0.1967   -0.5867   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5   -2    0    0    0.0571   -0.2237    0.0560   -0.2234    0.0012    1          0.0641          0.0654
    6    2   -1    1   -0.1081    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -3   -1    0    0.1212   -0.5970    0.1201   -0.5973    0.0011    1          0.1319          0.1302
    8   -3    0   -1    0.1444   -0.2199    0.1454   -0.2240    0.0042    1          0.1031          0.1017
    9    1   -1    2   -0.1948    0.0482   -0.1952    0.0486    0.0006    1          0.0781          0.0726
   10   -1    0   -1    0.2257   -0.1264    0.2251   -0.1274    0.0012    1          0.0461          0.0467
   11   -2   -1   -1    0.5373   -0.6122    0.5303   -0.6130    0.0070    1          0.1241          0.1248
   12    0   -1    3   -0.1809   -0.0377   -0.1829   -0.0381    0.0019    1          0.1003          0.0984
   13   -1    0   -3    0.1976   -0.0084    0.1990   -0.0092    0.0015    1          0.1008          0.0927
   14   -2   -1   -3    0.5295   -0.1482    0.5293   -0.1451    0.0031    1          0.1493          0.1473
   15   -1   -1    2   -0.3361   -0.2358   -0.3362   -0.2357    0.0001    1          0.0875          0.0881
   16    0    0   -2    0.1264    0.0354    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -1   -1   -2    0.7288   -0.0801    0.7293   -0.0807    0.0009    1          0.1152          0.1198
   18   -2   -2   -2    1.0604   -0.5096    1.0696   -0.4972    0.0155    1          0.2527          0.2483
   19    1    0   -3    0.0443    0.0291    0.0442    0.0295    0.0005    1          0.0971          0.0994
   20    0   -1   -3    0.4449    0.1644    0.4423    0.1634    0.0028    1          0.1187          0.1178
   21   -1    0    1   -0.0335   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    1   -1   -2    0.3004    0.3346    0.3053    0.3413    0.0084    1          0.0900          0.0899
   23    2   -1   -1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.27                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9963    1.0016    1.0022   89.9524   90.1413   90.1544      0.3967
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9977    1.0040    0.9983   90.0000   90.4097   90.0000      0.3547         0.9994    1.0057    2.8131    2.8307    2.8147
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.0395    0.0434    0.0000    1.3468    0.0000      0.0226         0.0434    0.0149    0.1789    0.2117    0.2168
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1809   -0.1822    0.9704)
 a2 = (   -0.2364    0.9438    0.2241)
 a3 = (   -0.9519   -0.2700    0.1293)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1783   -0.1851    0.9688) (    0.0175    0.0091    0.0025)
 a2 = (   -0.2374    0.9411    0.2235) (    0.0114    0.0381    0.0060)
 a3 = (   -0.9551   -0.2721    0.1312) (    0.0426    0.0117    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   76.9290   82.8755  -74.1920    0.3955    1.0237    0.4354
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0016      0.0023    0.0024    0.0424

# Number of computed bands
            147            165
# Figure of merit at the beginning and the end of the refinement
         6.6485         9.3654
# Chi-squares at the beginning and the end of the refinement
    0.1057    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7380   -0.0572   -0.7310   -0.0567    0.0070    1    0.0746    0.0702
    2    0    3   -1   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1110    0.0995
    3    1   -3    0   -0.0269    0.0910   -0.0262    0.0895    0.0017    1    0.1087    0.0967
    4    1    2   -1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1    0.1156    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0717    0.0654
    6    1   -2   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0856    0.0778
    7    1    3    0    0.1189   -0.5963    0.1201   -0.5973    0.0016    1    0.1479    0.1302
    8    0    3    1    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1151    0.1017
    9    1   -1   -2   -0.1975    0.0499   -0.1952    0.0486    0.0026    1    0.0868    0.0726
   10    0    1    1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0513    0.0467
   11    1    2    1    0.5336   -0.6159    0.5303   -0.6130    0.0044    1    0.1392    0.1248
   12    1    0   -3   -0.1839   -0.0380   -0.1829   -0.0381    0.0011    1    0.1115    0.0984
   13    0    1    3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1119    0.0927
   14    1    2    3    0.5309   -0.1511    0.5293   -0.1451    0.0062    1    0.1667    0.1473
   15    1    1   -2   -0.3385   -0.2384   -0.3362   -0.2357    0.0035    1    0.0978    0.0881
   16    0    0    2    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0692    0.0679
   17    1    1    2    0.7323   -0.0828    0.7293   -0.0807    0.0036    1    0.1290    0.1198
   18    2    2    2    1.0613   -0.5180    1.0696   -0.4972    0.0224    1    0.2849    0.2483
   19    0   -1    3    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1080    0.0994
   20    1    0    3    0.4464    0.1656    0.4423    0.1634    0.0046    1    0.1323    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0483    0.0568
   22    1   -1    2    0.2997    0.3359    0.3053    0.3413    0.0079    1    0.1004    0.0899
   23    1   -2    1    0.0349    0.2740    0.0347    0.2716    0.0024    1    0.0898    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7334   -0.0568   -0.7310   -0.0567    0.0023    1          0.0665          0.0702
    2    0    3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -3    0   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    1    2   -1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    2    0    0.0564   -0.2234    0.0560   -0.2234    0.0005    1          0.0640          0.0654
    6    1   -2   -1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    1    3    0    0.1208   -0.5964    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    0    3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9    1   -1   -2   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    0    1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    1    2    1    0.5375   -0.6123    0.5303   -0.6130    0.0072    1          0.1246          0.1248
   12    1    0   -3   -0.1808   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    0    1    3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1005          0.0927
   14    1    2    3    0.5303   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1    1   -2   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    0    2    0.1270    0.0356    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    1    1    2    0.7291   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2    2    2    1.0613   -0.5068    1.0696   -0.4972    0.0127    1          0.2542          0.2483
   19    0   -1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    1    0    3    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    0    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1   -1    2    0.2994    0.3339    0.3053    0.3413    0.0094    1          0.0902          0.0899
   23    1   -2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.29                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9996    1.0003    1.0001   89.9471   90.0164   90.0467      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9984    1.0041    0.9975   90.0000   90.4216   90.0000      0.3545         1.0009    1.0066    2.8163    2.8322    2.8138
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.0148    0.0432    0.0000    1.3464    0.0000      0.0282         0.0434    0.0396    0.2244    0.2295    0.2551
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9543   -0.2707    0.1297)
 a2 = (    0.2367   -0.9450   -0.2243)
 a3 = (    0.1828   -0.1826    0.9659)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9550   -0.2721    0.1312) (    0.0022    0.0057    0.0078)
 a2 = (    0.2374   -0.9410   -0.2236) (    0.0067    0.0134    0.0083)
 a3 = (    0.1782   -0.1852    0.9690) (    0.0182    0.0156    0.0414)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  149.7300   15.0640   45.3076    1.2725    0.5086    1.3489
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
            151            165
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.3536
# Chi-squares at the beginning and the end of the refinement
    0.2981    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2   -1   -3    0   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    0    3    1   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4   -1   -2    1   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6   -1    2    1   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    0   -3    1    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8    1   -3    0    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9   -2    1    1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -2    1    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12   -3    0    1   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13    3   -1    0    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    3   -2    1    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15   -2   -1    1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16    2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17    2   -1    1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18    2   -2    2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19    3    1    0    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20    3    0    1    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21   -1   -1    0   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    2    1    1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23    1    2    1    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1   -3    0   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    0    3    1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4   -1   -2    1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0   -2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6   -1    2    1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    0   -3    1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1   -3    0    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9   -2    1    1   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    1   -1    0    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    1   -2    1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -3    0    1   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3   -1    0    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14    3   -2    1    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15   -2   -1    1   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2    0    0    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    2   -1    1    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    2   -2    2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19    3    1    0    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    3    0    1    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1    0   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    2    1    1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23    1    2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.30                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0016    1.0009   90.0451   90.5950   90.1505      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9975    1.0041    0.9984   90.0000   89.5784   90.0000      0.3545         0.9991    1.0057    2.8138    2.8322    2.8163
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.0395    0.0434    0.0000    1.3464    0.0000      0.0225         0.0433    0.0149    0.1789    0.2118    0.2169
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1930    0.1785   -0.9674)
 a2 = (    0.2364   -0.9438   -0.2241)
 a3 = (   -0.9532   -0.2704    0.1295)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1782    0.1852   -0.9690) (    0.0175    0.0091    0.0025)
 a2 = (    0.2374   -0.9410   -0.2236) (    0.0114    0.0381    0.0060)
 a3 = (   -0.9550   -0.2721    0.1312) (    0.0426    0.0117    0.0060)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -103.0738   82.8828  -74.1940    0.3954    1.0232    0.4353
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
            139            165
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.3536
# Chi-squares at the beginning and the end of the refinement
    0.3262    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0   -3   -1   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1    3    0   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4   -1   -2   -1   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1    2   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7   -1   -3    0    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -3    1    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -1    1   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1   -2    1    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12   -1    0   -3   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -1    3    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -1   -2    3    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15   -1   -1   -2   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0    0    2    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17   -1   -1    2    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18   -2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0    1    3    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20   -1    0    3    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0   -1   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1    1    2    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23   -1    2    1    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2    0   -3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -1    3    0   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4   -1   -2   -1   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0   -2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6   -1    2   -1   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7   -1   -3    0    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    0   -3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9   -1    1   -2   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    0   -1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11   -1   -2    1    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -1    0   -3   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    0   -1    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14   -1   -2    3    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15   -1   -1   -2   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    0    0    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1   -1    2    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18   -2   -2    2    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19    0    1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20   -1    0    3    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    0   -1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    1    2    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23   -1    2    1    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.32                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8609    1.4244    0.8639   91.2477  109.2184   90.2204      0.5121
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8750    1.4061    0.8582   90.0000  108.7186   90.0000      0.3506         1.0196    1.6384    2.4955    4.0101    2.4476
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0125    0.0460    0.0254    0.0000    2.4248    0.0000      0.0231         0.0203    0.0287    0.1681    0.2948    0.1767
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5577   -0.4241   -1.0112)
 a2 = (   -0.5917    0.3350    0.1759)
 a3 = (    0.1497    0.8060   -0.9119)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5321   -0.4207   -0.9980) (    0.0058    0.0223    0.0110)
 a2 = (   -0.5996    0.3391    0.1767) (    0.0202    0.0129    0.0037)
 a3 = (    0.1845    0.8026   -0.9140) (    0.0260    0.0302    0.0131)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -73.2772  120.2774  159.1231    0.3910    1.1674    0.4264
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0003    0.0005   -0.0182      0.0023    0.0024    0.0441

# Number of computed bands
            127            243
# Figure of merit at the beginning and the end of the refinement
         2.9769         9.2430
# Chi-squares at the beginning and the end of the refinement
    1.9068    0.1832
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0956    0.0702
    2   -1    1    1   -0.0129   -0.1749   -0.0130   -0.1762    0.0013    1    0.0723    0.0995
    3    1   -3   -2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1417    0.0967
    4   -2    1    1   -0.1964   -0.5802   -0.1957   -0.5833    0.0032    1    0.1493    0.1078
    5   -1    2    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0932    0.0654
    6    0   -3   -1   -0.1055    0.1175   -0.1085    0.1216    0.0050    1    0.1112    0.0778
    7   -2    3    1    0.1139   -0.5942    0.1201   -0.5973    0.0069    1    0.1909    0.1302
    8   -1    3    1    0.1091   -0.2284    0.1454   -0.2240    0.0366    1    0.1198    0.1017
    9   -1   -3    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1124    0.0726
   10    0    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0330    0.0467
   11   -1    3    0    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1791    0.1248
   12   -2   -3    1   -0.1834   -0.0392   -0.1829   -0.0381    0.0012    1    0.1444    0.0984
   13    1    3   -1    0.1711    0.0155    0.1990   -0.0092    0.0372    1    0.1147    0.0927
   14    0    5   -1    0.5345   -0.1494    0.5293   -0.1451    0.0068    1    0.2135    0.1473
   15   -2   -1    1   -0.3345   -0.2377   -0.3362   -0.2357    0.0026    1    0.1268    0.0881
   16    1    2   -1    0.1227    0.0364    0.1275    0.0362    0.0048    1    0.0890    0.0679
   17    0    3   -1    0.7400   -0.0765    0.7293   -0.0807    0.0115    1    0.1653    0.1198
   18   -1    4   -1    1.0821   -0.5292    1.0696   -0.4972    0.0344    1    0.3721    0.2483
   19    1    1   -1    0.0400    0.0275    0.0442    0.0295    0.0047    1    0.0697    0.0994
   20    1    3   -2    0.4414    0.1729    0.4423    0.1634    0.0096    1    0.1691    0.1178
   21   -1    0    1   -0.0349   -0.0607   -0.0341   -0.0579    0.0028    1    0.0629    0.0568
   22    1    1   -2    0.2868    0.3368    0.3053    0.3413    0.0190    1    0.1287    0.0899
   23    1   -1   -2    0.0297    0.2652    0.0347    0.2716    0.0081    1    0.1165    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7354   -0.0535   -0.7310   -0.0567    0.0054    1          0.0631          0.0702
    2   -2    3    2    0.0212   -0.2035   -0.0130   -0.1762    0.0438    1          0.1094          0.0995
    3    1   -3   -2   -0.0275    0.0918   -0.0262    0.0895    0.0027    1          0.0952          0.0967
    4   -2    1    1   -0.1913   -0.5843   -0.1957   -0.5833    0.0045    1          0.0984          0.1078
    5   -1    2    1    0.0556   -0.2206    0.0560   -0.2234    0.0028    1          0.0624          0.0654
    6    0   -3   -1   -0.1069    0.1197   -0.1085    0.1216    0.0025    1          0.0747          0.0778
    7   -2    3    1    0.1221   -0.5920    0.1201   -0.5973    0.0056    1          0.1265          0.1302
    8   -1    4    1    0.1426   -0.2196    0.1454   -0.2240    0.0052    1          0.1003          0.1017
    9   -1   -3    0   -0.1920    0.0486   -0.1952    0.0486    0.0032    1          0.0753          0.0726
   10    0    2    0    0.2271   -0.1291    0.2251   -0.1274    0.0026    1          0.0448          0.0467
   11   -1    3    0    0.5364   -0.6098    0.5303   -0.6130    0.0069    1          0.1187          0.1248
   12   -2   -3    1   -0.1771   -0.0369   -0.1829   -0.0381    0.0058    1          0.0965          0.0984
   13    1    4   -1    0.2030   -0.0092    0.1990   -0.0092    0.0040    1          0.0979          0.0927
   14    0    5   -1    0.5329   -0.1501    0.5293   -0.1451    0.0062    1          0.1445          0.1473
   15   -2   -1    1   -0.3331   -0.2355   -0.3362   -0.2357    0.0032    1          0.0837          0.0881
   16    1    2   -1    0.1323    0.0372    0.1275    0.0362    0.0049    1          0.0605          0.0679
   17    0    3   -1    0.7326   -0.0799    0.7293   -0.0807    0.0033    1          0.1111          0.1198
   18   -1    4   -1    1.0604   -0.5045    1.0696   -0.4972    0.0118    1          0.2400          0.2483
   19    3    2   -3    0.0169    0.0148    0.0442    0.0295    0.0310    1          0.1332          0.0994
   20    1    3   -2    0.4499    0.1676    0.4423    0.1634    0.0087    1          0.1154          0.1178
   21   -1    0    1   -0.0307   -0.0526   -0.0341   -0.0579    0.0064    1          0.0421          0.0568
   22    1    1   -2    0.3016    0.3387    0.3053    0.3413    0.0045    1          0.0877          0.0899
   23    1   -1   -2    0.0350    0.2763    0.0347    0.2716    0.0046    1          0.0786          0.0816

###            No.33                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8587    1.4275    0.8655   89.4741  109.5107   90.5471      0.5002
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8582    1.4061    0.8750   90.0000  108.7186   90.0000      0.3506         0.9808    1.6069    2.4476    4.0101    2.4955
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0123    0.0363    0.0159    0.0000    2.4248    0.0000      0.0242         0.0195    0.0337    0.1725    0.2954    0.1781
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1768   -0.8068    0.9188)
 a2 = (    0.5907   -0.3344   -0.1735)
 a3 = (    0.5295    0.4212    1.0221)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1845   -0.8026    0.9140) (    0.0234    0.0162    0.0186)
 a2 = (    0.5996   -0.3391   -0.1767) (    0.0162    0.0103    0.0040)
 a3 = (    0.5321    0.4207    0.9980) (    0.0135    0.0231    0.0227)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  108.4936   51.5727  138.7658    0.3703    1.4880    0.5851
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0003    0.0005   -0.0182      0.0023    0.0024    0.0441

# Number of computed bands
            137            243
# Figure of merit at the beginning and the end of the refinement
         3.0554         9.2430
# Chi-squares at the beginning and the end of the refinement
    1.7380    0.1832
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0951    0.0702
    2   -1   -1    1   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.0705    0.0995
    3    2    3   -1   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.1381    0.0967
    4   -1   -1    2   -0.1926   -0.5922   -0.1957   -0.5833    0.0094    1    0.1469    0.1078
    5   -1   -2    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0909    0.0654
    6    1    3    0   -0.1092    0.1239   -0.1085    0.1216    0.0024    1    0.1081    0.0778
    7   -1   -3    2    0.1205   -0.5961    0.1201   -0.5973    0.0012    1    0.1872    0.1302
    8   -1   -3    1    0.1087   -0.2276    0.1454   -0.2240    0.0369    1    0.1167    0.1017
    9    0    3    1   -0.2048    0.0518   -0.1952    0.0486    0.0102    1    0.1090    0.0726
   10    0   -1    0    0.2224   -0.1259    0.2251   -0.1274    0.0031    1    0.0321    0.0467
   11    0   -3    1    0.5365   -0.6150    0.5303   -0.6130    0.0065    1    0.1752    0.1248
   12   -1    3    2   -0.1922   -0.0413   -0.1829   -0.0381    0.0099    1    0.1402    0.0984
   13    1   -3   -1    0.1670    0.0151    0.1990   -0.0092    0.0402    1    0.1116    0.0927
   14    1   -5    0    0.5302   -0.1466    0.5293   -0.1451    0.0017    1    0.2085    0.1473
   15   -1    1    2   -0.3433   -0.2471   -0.3362   -0.2357    0.0134    1    0.1240    0.0881
   16    1   -2   -1    0.1187    0.0352    0.1275    0.0362    0.0088    1    0.0866    0.0679
   17    1   -3    0    0.7311   -0.0737    0.7293   -0.0807    0.0073    1    0.1613    0.1198
   18    1   -4    1    1.0707   -0.5071    1.0696   -0.4972    0.0100    1    0.3598    0.2483
   19    1   -1   -1    0.0367    0.0253    0.0442    0.0295    0.0086    1    0.0679    0.0994
   20    2   -3   -1    0.4372    0.1699    0.4423    0.1634    0.0083    1    0.1654    0.1178
   21   -1    0    1   -0.0363   -0.0632   -0.0341   -0.0579    0.0057    1    0.0614    0.0568
   22    2   -1   -1    0.2879    0.3322    0.3053    0.3413    0.0197    1    0.1262    0.0899
   23    2    1   -1    0.0329    0.2669    0.0347    0.2716    0.0050    1    0.1141    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7354   -0.0535   -0.7310   -0.0567    0.0054    1          0.0631          0.0702
    2   -2   -3    2    0.0212   -0.2035   -0.0130   -0.1762    0.0438    1          0.1094          0.0995
    3    2    3   -1   -0.0275    0.0918   -0.0262    0.0895    0.0027    1          0.0952          0.0967
    4   -1   -1    2   -0.1913   -0.5843   -0.1957   -0.5833    0.0045    1          0.0984          0.1078
    5   -1   -2    1    0.0556   -0.2206    0.0560   -0.2234    0.0028    1          0.0624          0.0654
    6    1    3    0   -0.1069    0.1197   -0.1085    0.1216    0.0025    1          0.0747          0.0778
    7   -1   -3    2    0.1221   -0.5920    0.1201   -0.5973    0.0056    1          0.1265          0.1302
    8   -1   -4    1    0.1426   -0.2196    0.1454   -0.2240    0.0052    1          0.1003          0.1017
    9    0    3    1   -0.1920    0.0486   -0.1952    0.0486    0.0032    1          0.0753          0.0726
   10    0   -2    0    0.2271   -0.1291    0.2251   -0.1274    0.0026    1          0.0448          0.0467
   11    0   -3    1    0.5364   -0.6098    0.5303   -0.6130    0.0069    1          0.1187          0.1248
   12   -1    3    2   -0.1771   -0.0369   -0.1829   -0.0381    0.0058    1          0.0965          0.0984
   13    1   -4   -1    0.2030   -0.0092    0.1990   -0.0092    0.0040    1          0.0979          0.0927
   14    1   -5    0    0.5329   -0.1501    0.5293   -0.1451    0.0062    1          0.1445          0.1473
   15   -1    1    2   -0.3331   -0.2355   -0.3362   -0.2357    0.0032    1          0.0837          0.0881
   16    1   -2   -1    0.1323    0.0372    0.1275    0.0362    0.0049    1          0.0605          0.0679
   17    1   -3    0    0.7326   -0.0799    0.7293   -0.0807    0.0033    1          0.1111          0.1198
   18    1   -4    1    1.0604   -0.5045    1.0696   -0.4972    0.0118    1          0.2400          0.2483
   19    3   -2   -3    0.0169    0.0148    0.0442    0.0295    0.0310    1          0.1332          0.0994
   20    2   -3   -1    0.4499    0.1676    0.4423    0.1634    0.0087    1          0.1154          0.1178
   21   -1    0    1   -0.0307   -0.0526   -0.0341   -0.0579    0.0064    1          0.0421          0.0568
   22    2   -1   -1    0.3016    0.3387    0.3053    0.3413    0.0045    1          0.0877          0.0899
   23    2    1   -1    0.0350    0.2763    0.0347    0.2716    0.0046    1          0.0786          0.0816

###            No.34                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0042    1.0073   92.0664   90.3187   90.8309      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0000    0.9953    1.0047   90.0000   89.8433   90.0000      0.3598         0.9953    0.9906    2.7795    2.7666    2.7927
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.0146    0.0842    0.0000    2.3899    0.0000      0.0423         0.0833    0.0855    0.3264    0.3274    0.4029
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2542    0.9516    0.2272)
 a2 = (   -0.9505   -0.2696    0.1309)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2384    0.9455    0.2221) (    0.0065    0.0039    0.0192)
 a2 = (   -0.9584   -0.2721    0.1296) (    0.0147    0.0066    0.0085)
 a3 = (    0.1819   -0.1828    0.9613) (    0.0193    0.0160    0.0835)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.8442   14.8848   45.1638    1.2326    1.2023    1.3321
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0003    0.0003   -0.0104      0.0024    0.0024    0.0906

# Number of computed bands
            400            169
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.2103
# Chi-squares at the beginning and the end of the refinement
    0.2282    0.0242
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3   -1    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    0    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3    0    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    1    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -1   -2    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    2    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    3    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    2    3    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1   -2    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    2    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1    3    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1   -1    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -1    2    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    1    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7321   -0.0576   -0.7310   -0.0567    0.0014    1          0.0661          0.0702
    2    3   -1    0   -0.0133   -0.1737   -0.0130   -0.1762    0.0025    1          0.0997          0.0995
    3   -3    0    1   -0.0267    0.0904   -0.0262    0.0895    0.0011    1          0.0977          0.0967
    4    2   -1    1   -0.1959   -0.5856   -0.1957   -0.5833    0.0023    1          0.1029          0.1078
    5    2    0    0    0.0565   -0.2235    0.0560   -0.2234    0.0006    1          0.0644          0.0654
    6   -2   -1    1   -0.1077    0.1200   -0.1085    0.1216    0.0017    1          0.0769          0.0778
    7    3    0    1    0.1200   -0.5960    0.1201   -0.5973    0.0013    1          0.1318          0.1302
    8    3    1    0    0.1438   -0.2203    0.1454   -0.2240    0.0040    1          0.1034          0.1017
    9   -1   -2    1   -0.1950    0.0485   -0.1952    0.0486    0.0002    1          0.0782          0.0726
   10    1    1    0    0.2258   -0.1272    0.2251   -0.1274    0.0008    1          0.0462          0.0467
   11    2    1    1    0.5354   -0.6135    0.5303   -0.6130    0.0051    1          0.1236          0.1248
   12    0   -3    1   -0.1811   -0.0379   -0.1829   -0.0381    0.0018    1          0.1004          0.0984
   13    1    3    0    0.1982   -0.0085    0.1990   -0.0092    0.0010    1          0.1010          0.0927
   14    2    3    1    0.5303   -0.1494    0.5293   -0.1451    0.0044    1          0.1491          0.1473
   15    1   -2    1   -0.3358   -0.2364   -0.3362   -0.2357    0.0008    1          0.0875          0.0881
   16    0    2    0    0.1268    0.0356    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17    1    2    1    0.7301   -0.0811    0.7293   -0.0807    0.0008    1          0.1148          0.1198
   18    2    2    2    1.0600   -0.5125    1.0696   -0.4972    0.0181    1          0.2508          0.2483
   19   -1    3    0    0.0445    0.0292    0.0442    0.0295    0.0004    1          0.0975          0.0994
   20    0    3    1    0.4455    0.1649    0.4423    0.1634    0.0035    1          0.1187          0.1178
   21    1   -1    0   -0.0334   -0.0572   -0.0341   -0.0579    0.0011    1          0.0435          0.0568
   22   -1    2    1    0.3000    0.3347    0.3053    0.3413    0.0085    1          0.0901          0.0899
   23   -2    1    1    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0806          0.0816

###            No.35                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8626    1.4188    0.8657   89.8285  109.2913   90.1385      0.4655
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8633    1.4161    0.8648   90.0000  108.9419   90.0000      0.3547         0.9982    1.6375    2.4340    3.9929    2.4385
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0044    0.0266    0.0143    0.0000    0.8603    0.0000      0.0226         0.0171    0.0375    0.1559    0.2657    0.1608
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6277   -0.7171   -0.7748)
 a2 = (    0.5667    0.0439    0.4168)
 a3 = (   -0.1495   -1.1712    0.3219)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6268   -0.7129   -0.7739) (    0.0071    0.0087    0.0061)
 a2 = (    0.5669    0.0438    0.4188) (    0.0131    0.0053    0.0055)
 a3 = (   -0.1508   -1.1684    0.3263) (    0.0124    0.0208    0.0080)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -46.8164   60.0632  -20.6789    0.4272    0.5192    0.5350
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            159            157
# Figure of merit at the beginning and the end of the refinement
         3.6763         9.1472
# Chi-squares at the beginning and the end of the refinement
    0.4564    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0867    0.0702
    2   -1    1   -2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    1    1    2   -0.0259    0.0871   -0.0262    0.0895    0.0024    1    0.1276    0.0967
    4   -1    2   -1   -0.1945   -0.5865   -0.1957   -0.5833    0.0034    1    0.1355    0.1078
    5   -1    0   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6    1    2    1   -0.1051    0.1174   -0.1085    0.1216    0.0054    1    0.1003    0.0778
    7   -2    1   -1    0.1213   -0.5960    0.1201   -0.5973    0.0017    1    0.1739    0.1302
    8   -2   -1   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9    1    3    0   -0.1921    0.0483   -0.1952    0.0486    0.0031    1    0.1018    0.0726
   10   -1   -1    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11   -2    0    0    0.5355   -0.6117    0.5303   -0.6130    0.0053    1    0.1636    0.1248
   12    1    4   -1   -0.1797   -0.0372   -0.1829   -0.0381    0.0033    1    0.1309    0.0984
   13   -2   -3    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14   -3   -2    1    0.5304   -0.1495    0.5293   -0.1451    0.0045    1    0.1966    0.1473
   15    0    3   -1   -0.3355   -0.2363   -0.3362   -0.2357    0.0010    1    0.1144    0.0881
   16   -1   -2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17   -2   -1    1    0.7289   -0.0810    0.7293   -0.0807    0.0006    1    0.1516    0.1198
   18   -3    0    1    1.0563   -0.5094    1.0696   -0.4972    0.0180    1    0.3333    0.2483
   19   -1   -3    2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20   -2   -2    2    0.4449    0.1649    0.4423    0.1634    0.0029    1    0.1558    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22   -1   -1    2    0.2983    0.3334    0.3053    0.3413    0.0106    1    0.1179    0.0899
   23    0    0    2    0.0345    0.2705    0.0347    0.2716    0.0012    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -1    1   -2   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3    1    1    2   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4   -1    2   -1   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5   -1    0   -1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    1    2    1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7   -2    1   -1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -2   -1   -1    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    1    3    0   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10   -1   -1    0    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0    0    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    1    4   -1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13   -2   -3    1    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -3   -2    1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    0    3   -1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16   -1   -2    1    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -2   -1    1    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18   -3    0    1    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19   -1   -3    2    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20   -2   -2    2    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    0    1   -1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22   -1   -1    2    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    0    0    2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.36                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8645    1.4172    0.8661   90.1358  109.5421   89.9695      0.4649
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8633    1.4161    0.8648   90.0000  108.9419   90.0000      0.3547         0.9982    1.6375    2.4340    3.9929    2.4385
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0044    0.0266    0.0143    0.0000    0.8603    0.0000      0.0226         0.0171    0.0375    0.1559    0.2657    0.1608
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6239    0.7211    0.7729)
 a2 = (    0.5673    0.0440    0.4172)
 a3 = (    0.1497    1.1725   -0.3223)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6268    0.7129    0.7739) (    0.0071    0.0087    0.0061)
 a2 = (    0.5669    0.0438    0.4188) (    0.0131    0.0053    0.0055)
 a3 = (    0.1508    1.1684   -0.3263) (    0.0124    0.0208    0.0080)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   46.8164  119.9368  159.3211    0.4272    0.5192    0.5350
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            155            157
# Figure of merit at the beginning and the end of the refinement
         3.7205         9.1472
# Chi-squares at the beginning and the end of the refinement
    0.4595    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0867    0.0702
    2    1    1    2   -0.0136   -0.1744   -0.0130   -0.1762    0.0019    1    0.1306    0.0995
    3   -1    1   -2   -0.0260    0.0879   -0.0262    0.0895    0.0015    1    0.1277    0.0967
    4    1    2    1   -0.1945   -0.5837   -0.1957   -0.5833    0.0012    1    0.1353    0.1078
    5    1    0    1    0.0561   -0.2239    0.0560   -0.2234    0.0006    1    0.0843    0.0654
    6   -1    2   -1   -0.1056    0.1185   -0.1085    0.1216    0.0042    1    0.1004    0.0778
    7    2    1    1    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.1735    0.1302
    8    2   -1    1    0.1431   -0.2209    0.1454   -0.2240    0.0038    1    0.1356    0.1017
    9   -1    3    0   -0.1934    0.0490   -0.1952    0.0486    0.0018    1    0.1017    0.0726
   10    1   -1    0    0.2257   -0.1283    0.2251   -0.1274    0.0010    1    0.0604    0.0467
   11    2    0    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1629    0.1248
   12   -1    4    1   -0.1809   -0.0373   -0.1829   -0.0381    0.0021    1    0.1307    0.0984
   13    2   -3   -1    0.1985   -0.0088    0.1990   -0.0092    0.0006    1    0.1316    0.0927
   14    3   -2   -1    0.5291   -0.1514    0.5293   -0.1451    0.0063    1    0.1958    0.1473
   15    0    3    1   -0.3355   -0.2363   -0.3362   -0.2357    0.0010    1    0.1144    0.0881
   16    1   -2   -1    0.1265    0.0358    0.1275    0.0362    0.0010    1    0.0813    0.0679
   17    2   -1   -1    0.7288   -0.0838    0.7293   -0.0807    0.0031    1    0.1510    0.1198
   18    3    0   -1    1.0534   -0.5164    1.0696   -0.4972    0.0251    1    0.3323    0.2483
   19    1   -3   -2    0.0436    0.0292    0.0442    0.0295    0.0007    1    0.1269    0.0994
   20    2   -2   -2    0.4449    0.1643    0.4423    0.1634    0.0027    1    0.1552    0.1178
   21    0    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1   -1   -2    0.2980    0.3334    0.3053    0.3413    0.0108    1    0.1176    0.0899
   23    0    0   -2    0.0345    0.2705    0.0347    0.2716    0.0012    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    1    1    2   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3   -1    1   -2   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4    1    2    1   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5    1    0    1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6   -1    2   -1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7    2    1    1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    2   -1    1    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9   -1    3    0   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10    1   -1    0    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    2    0    0    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -1    4    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13    2   -3   -1    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    3   -2   -1    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    0    3    1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    1   -2   -1    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    2   -1   -1    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18    3    0   -1    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19    1   -3   -2    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    2   -2   -2    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    0    1    1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22    1   -1   -2    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    0    0   -2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.44                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8640    1.4137    0.8688   89.9695  109.5421   90.1358      0.5964
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8648    1.4161    0.8633   90.0000  108.9419   90.0000      0.3547         1.0018    1.6405    2.4385    3.9929    2.4340
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0045    0.0323    0.0165    0.0000    0.8603    0.0000      0.0232         0.0171    0.0329    0.1603    0.2770    0.1661
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1501   -1.1754    0.3231)
 a2 = (   -0.5688   -0.0441   -0.4183)
 a3 = (    0.6208   -0.7175   -0.7691)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1508   -1.1684    0.3263) (    0.0117    0.0030    0.0083)
 a2 = (   -0.5669   -0.0438   -0.4188) (    0.0150    0.0056    0.0076)
 a3 = (    0.6268   -0.7129   -0.7739) (    0.0149    0.0126    0.0149)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  155.7687  139.4337   63.7722    0.6038    0.4594    0.6888
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            133            157
# Figure of merit at the beginning and the end of the refinement
         2.1132         9.1471
# Chi-squares at the beginning and the end of the refinement
    2.0930    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0557    0.0702
    2   -2   -1   -1   -0.0138   -0.1728   -0.0130   -0.1762    0.0035    1    0.1678    0.0995
    3    2   -1    1   -0.0264    0.0899   -0.0262    0.0895    0.0005    1    0.1642    0.0967
    4   -1   -2   -1   -0.1957   -0.5815   -0.1957   -0.5833    0.0018    1    0.1735    0.1078
    5   -1    0   -1    0.0552   -0.2219    0.0560   -0.2234    0.0017    1    0.1080    0.0654
    6    1   -2    1   -0.1075    0.1206   -0.1085    0.1216    0.0013    1    0.1290    0.0778
    7   -1   -1   -2    0.1166   -0.5923    0.1201   -0.5973    0.0061    1    0.2222    0.1302
    8   -1    1   -2    0.1416   -0.2189    0.1454   -0.2240    0.0064    1    0.1734    0.1017
    9    0   -3    1   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1308    0.0726
   10    0    1   -1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0771    0.0467
   11    0    0   -1    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1038    0.1248
   12   -1   -4    1   -0.1828   -0.0381   -0.1829   -0.0381    0.0000    1    0.1684    0.0984
   13    1    3   -2    0.1954   -0.0080    0.1990   -0.0092    0.0037    1    0.1686    0.0927
   14    1    2   -3    0.5274   -0.1489    0.5293   -0.1451    0.0042    1    0.2504    0.1473
   15   -1   -3    0   -0.3355   -0.2363   -0.3362   -0.2357    0.0010    1    0.1473    0.0881
   16    1    2   -1    0.1238    0.0354    0.1275    0.0362    0.0038    1    0.1044    0.0679
   17    1    1   -2    0.7273   -0.0800    0.7293   -0.0807    0.0022    1    0.1930    0.1198
   18    1    0   -3    1.0577   -0.5136    1.0696   -0.4972    0.0203    1    0.4277    0.2483
   19   -1    1   -1    0.0064   -0.0114    0.0442    0.0295    0.0557    1    0.1088    0.0994
   20    1    1   -1    0.4411    0.1653    0.4423    0.1634    0.0023    1    0.0991    0.1178
   21   -1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0731    0.0568
   22    2    1   -1    0.2951    0.3323    0.3053    0.3413    0.0136    1    0.1510    0.0899
   23    1    0    0    0.0345    0.2705    0.0347    0.2716    0.0012    1    0.0676    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -2   -1   -1   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3    2   -1    1   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4   -1   -2   -1   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5   -1    0   -1    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    1   -2    1   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7   -1   -1   -2    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -1    1   -2    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    0   -3    1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10    0    1   -1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    0    0   -2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -1   -4    1   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13    1    3   -2    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    1    2   -3    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15   -1   -3    0   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    1    2   -1    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1    1   -2    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18    1    0   -3    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19    2    3   -1    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    2    2   -2    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1    0   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22    2    1   -1    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2    0    0    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.46                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9834    1.0088    1.0081   89.9488   90.3022   90.7443      0.3878
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0137    0.9898    0.9967   90.0000   89.3265   90.0000      0.3656         1.0171    0.9931    2.7723    2.7070    2.7258
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0004    0.0719    0.0715    0.0000    2.0692    0.0000      0.0241         0.0734    0.0138    0.1824    0.2653    0.2655
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1724    0.1850   -0.9850)
 a2 = (    0.9457    0.2682   -0.1285)
 a3 = (    0.2349   -0.9377   -0.2226)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1804    0.1868   -0.9518) (    0.0062    0.0213    0.0044)
 a2 = (    0.9639    0.2739   -0.1290) (    0.0713    0.0189    0.0055)
 a3 = (    0.2403   -0.9491   -0.2196) (    0.0204    0.0714    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.5367  103.3082   14.1189    0.4080    1.2254    0.3678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0253      0.0023    0.0023    0.0797

# Number of computed bands
            400            163
# Figure of merit at the beginning and the end of the refinement
         4.3518         8.2823
# Chi-squares at the beginning and the end of the refinement
    0.3317    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7618   -0.0567   -0.7310   -0.0567    0.0308    0    0.0745    0.0702
    2    0    1   -3   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1078    0.0995
    3   -1    0    3   -0.0285    0.0975   -0.0262    0.0895    0.0084    1    0.1058    0.0967
    4   -1    1   -2   -0.1983   -0.5990   -0.1957   -0.5833    0.0159    1    0.1138    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0696    0.0654
    6   -1    1    2   -0.1139    0.1286   -0.1085    0.1216    0.0089    1    0.0834    0.0778
    7   -1    0   -3    0.1223   -0.6041    0.1201   -0.5973    0.0072    1    0.1451    0.1302
    8    0   -1   -3    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1118    0.1017
    9   -1    2    1   -0.2065    0.0527   -0.1952    0.0486    0.0120    1    0.0845    0.0726
   10    0   -1   -1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0498    0.0467
   11   -1   -1   -2    0.5431   -0.6214    0.5303   -0.6130    0.0152    1    0.1374    0.1248
   12   -1    3    0   -0.1911   -0.0394   -0.1829   -0.0381    0.0084    1    0.1084    0.0984
   13    0   -3   -1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1086    0.0927
   14   -1   -3   -2    0.5364   -0.1516    0.5293   -0.1451    0.0096    1    0.1633    0.1473
   15   -1    2   -1   -0.3473   -0.2448   -0.3362   -0.2357    0.0143    1    0.0957    0.0881
   16    0   -2    0    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0672    0.0679
   17   -1   -2   -1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1272    0.1198
   18   -2   -2   -2    1.0767   -0.5174    1.0696   -0.4972    0.0215    1    0.2835    0.2483
   19    0   -3    1    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1049    0.0994
   20   -1   -3    0    0.4520    0.1679    0.4423    0.1634    0.0106    1    0.1298    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0469    0.0568
   22   -1   -2    1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0988    0.0899
   23   -1   -1    2    0.0368    0.2822    0.0347    0.2716    0.0108    1    0.0880    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2    0    1   -3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3   -1    0    3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4   -1    1   -2   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5    0    0   -2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6   -1    1    2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7   -1    0   -3    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8    0   -1   -3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9   -1    2    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10    0   -1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11   -1   -1   -2    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12   -1    3    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13    0   -3   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14   -1   -3   -2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15   -1    2   -1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17   -1   -2   -1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18   -2   -2   -2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19    0   -3    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20   -1   -3    0    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21    0    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22   -1   -2    1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23   -1   -1    2    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.48                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0009    1.0016   90.0451   90.1505   90.5950      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0137    0.9898    0.9967   90.0000   89.3262   90.0000      0.3657         1.0171    0.9931    2.7723    2.7070    2.7258
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0004    0.0719    0.0715    0.0000    2.0692    0.0000      0.0241         0.0734    0.0138    0.1824    0.2653    0.2655
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1930   -0.1785    0.9674)
 a2 = (    0.9532    0.2704   -0.1295)
 a3 = (   -0.2364    0.9438    0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1804   -0.1868    0.9518) (    0.0062    0.0213    0.0044)
 a2 = (    0.9639    0.2739   -0.1290) (    0.0713    0.0189    0.0055)
 a3 = (   -0.2403    0.9491    0.2196) (    0.0204    0.0714    0.0061)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.5366   76.6916 -165.8811    0.4080    1.2254    0.3678
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0254      0.0023    0.0023    0.0797

# Number of computed bands
            139            163
# Figure of merit at the beginning and the end of the refinement
         4.5109         8.2816
# Chi-squares at the beginning and the end of the refinement
    0.4270    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0    1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    1    0   -3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    1    1    2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    1    0    3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -1    2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    1    3    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1   -3    2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    1    2    1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -2    1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0   -3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    1   -3    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -2   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    1   -1   -2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7329   -0.0563   -0.7310   -0.0567    0.0019    1          0.0655          0.0702
    2    0    1    3   -0.0133   -0.1735   -0.0130   -0.1762    0.0027    1          0.1001          0.0995
    3    1    0   -3   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0983          0.0967
    4    1    1    2   -0.1958   -0.5868   -0.1957   -0.5833    0.0034    1          0.1021          0.1078
    5    0    0    2    0.0566   -0.2234    0.0560   -0.2234    0.0006    1          0.0645          0.0654
    6    1    1   -2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0773          0.0778
    7    1    0    3    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1309          0.1302
    8    0   -1    3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1037          0.1017
    9    1    2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0785          0.0726
   10    0   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0464          0.0467
   11    1   -1    2    0.5377   -0.6119    0.5303   -0.6130    0.0075    1          0.1222          0.1248
   12    1    3    0   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.1009          0.0984
   13    0   -3    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1015          0.0927
   14    1   -3    2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1486          0.1473
   15    1    2    1   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0874          0.0881
   16    0   -2    0    0.1270    0.0355    0.1275    0.0362    0.0008    1          0.0629          0.0679
   17    1   -2    1    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1138          0.1198
   18    2   -2    2    1.0609   -0.5066    1.0696   -0.4972    0.0128    1          0.2457          0.2483
   19    0   -3   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0981          0.0994
   20    1   -3    0    0.4448    0.1649    0.4423    0.1634    0.0029    1          0.1187          0.1178
   21    0    1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0438          0.0568
   22    1   -2   -1    0.2998    0.3342    0.3053    0.3413    0.0090    1          0.0901          0.0899
   23    1   -1   -2    0.0353    0.2738    0.0347    0.2716    0.0023    1          0.0810          0.0816

###            No.51                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8629    1.4167    0.8686   89.9705  109.6616   90.1232      0.4654
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8574    1.4148    0.8849   90.0000  111.2997   90.0000      0.3515         0.9689    1.5989    2.4394    4.0254    2.5177
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0133    0.0359    0.0160    0.0000    2.2799    0.0000      0.0237         0.0191    0.0324    0.1687    0.2898    0.1757
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1783    0.7942   -0.9230)
 a2 = (    0.5947   -0.3367   -0.1768)
 a3 = (   -0.5388   -0.4199   -1.0139)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1799    0.8061   -0.9408) (    0.0231    0.0161    0.0179)
 a2 = (    0.5937   -0.3399   -0.1777) (    0.0157    0.0101    0.0039)
 a3 = (   -0.5280   -0.3888   -1.0204) (    0.0134    0.0220    0.0222)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -108.4954  127.5866  -41.3245    0.3658    1.4275    0.5819
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0000    0.0090    0.0206      0.0023    0.0024    0.0407

# Number of computed bands
            151            223
# Figure of merit at the beginning and the end of the refinement
         3.7968         7.9390
# Chi-squares at the beginning and the end of the refinement
    1.1668    0.4542
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7346   -0.0540   -0.7310   -0.0567    0.0045    1    0.0871    0.0702
    2    2   -2   -2   -0.0135   -0.1715   -0.0130   -0.1762    0.0047    1    0.1302    0.0995
    3   -2    3    1   -0.0271    0.0920   -0.0262    0.0895    0.0027    1    0.1278    0.0967
    4    1   -1   -2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1350    0.1078
    5    1   -2   -1    0.0554   -0.2216    0.0560   -0.2234    0.0018    1    0.0840    0.0654
    6   -1    3    0   -0.1081    0.1214   -0.1085    0.1216    0.0004    1    0.1005    0.0778
    7    1   -3   -2    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.1730    0.1302
    8    1   -4   -1    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1350    0.1017
    9    0    3   -1   -0.1956    0.0497   -0.1952    0.0486    0.0011    1    0.1018    0.0726
   10    0   -2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0602    0.0467
   11    0   -3   -1    0.5348   -0.6141    0.5303   -0.6130    0.0046    1    0.1630    0.1248
   12    1    3   -2   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.1307    0.0984
   13   -1   -3    1    0.1745    0.0142    0.1990   -0.0092    0.0338    1    0.1051    0.0927
   14   -1   -5    0    0.5310   -0.1498    0.5293   -0.1451    0.0050    1    0.1959    0.1473
   15    1    1   -2   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1143    0.0881
   16   -1   -2    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0814    0.0679
   17   -1   -3    0    0.7317   -0.0805    0.7293   -0.0807    0.0024    1    0.1515    0.1198
   18   -1   -4   -1    1.0632   -0.5123    1.0696   -0.4972    0.0164    1    0.3345    0.2483
   19   -2   -2    2    0.0452    0.0302    0.0442    0.0295    0.0013    1    0.1270    0.0994
   20   -2   -3    1    0.4465    0.1663    0.4423    0.1634    0.0051    1    0.1558    0.1178
   21    1    0   -1   -0.0328   -0.0555   -0.0341   -0.0579    0.0028    1    0.0567    0.0568
   22   -2   -1    1    0.2998    0.3363    0.3053    0.3413    0.0075    1    0.1183    0.0899
   23   -2    1    1    0.0353    0.2749    0.0347    0.2716    0.0033    1    0.1057    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7345   -0.0410   -0.7310   -0.0567    0.0160    1          0.0676          0.0702
    2    2   -3   -2    0.0211   -0.2056   -0.0130   -0.1762    0.0450    1          0.1123          0.0995
    3   -2    3    1   -0.0289    0.0888   -0.0262    0.0895    0.0028    1          0.0987          0.0967
    4    1   -1   -2   -0.1954   -0.5943   -0.1957   -0.5833    0.0110    1          0.1033          0.1078
    5    1   -2   -1    0.0546   -0.2223    0.0560   -0.2234    0.0018    1          0.0642          0.0654
    6   -1    3    0   -0.1084    0.1147   -0.1085    0.1216    0.0069    1          0.0781          0.0778
    7    1   -3   -2    0.1232   -0.5976    0.1201   -0.5973    0.0031    1          0.1327          0.1302
    8    1   -4   -1    0.1387   -0.2215    0.1454   -0.2240    0.0072    1          0.1037          0.1017
    9    0    3   -1   -0.1924    0.0436   -0.1952    0.0486    0.0058    1          0.0784          0.0726
   10    0   -2    0    0.2208   -0.1354    0.2251   -0.1274    0.0090    1          0.0465          0.0467
   11    0   -3   -1    0.5364   -0.6120    0.5303   -0.6130    0.0062    1          0.1266          0.1248
   12    1    3   -2   -0.1779   -0.0422   -0.1829   -0.0381    0.0065    1          0.0996          0.0984
   13   -1   -4    1    0.1999   -0.0197    0.1990   -0.0092    0.0106    1          0.1013          0.0927
   14   -1   -5    0    0.5266   -0.1584    0.5293   -0.1451    0.0136    1          0.1520          0.1473
   15    1    1   -2   -0.3377   -0.2386   -0.3362   -0.2357    0.0032    1          0.0868          0.0881
   16   -1   -2    1    0.1327    0.0271    0.1275    0.0362    0.0105    1          0.0623          0.0679
   17   -1   -3    0    0.7275   -0.0882    0.7293   -0.0807    0.0078    1          0.1184          0.1198
   18   -1   -4   -1    1.0617   -0.5027    1.0696   -0.4972    0.0096    1          0.2621          0.2483
   19   -3   -2    3    0.0195    0.0081    0.0442    0.0295    0.0327    1          0.1361          0.0994
   20   -2   -3    1    0.4507    0.1567    0.4423    0.1634    0.0107    1          0.1212          0.1178
   21    1    0   -1   -0.0286   -0.0573   -0.0341   -0.0579    0.0055    1          0.0430          0.0568
   22   -2   -1    1    0.3043    0.3321    0.3053    0.3413    0.0092    1          0.0922          0.0899
   23   -2    1    1    0.0354    0.2725    0.0347    0.2716    0.0011    1          0.0821          0.0816

###            No.52                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1185    0.7964    1.1228   90.4131   90.5251   90.4455      0.5948
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1286    0.7898    1.1219   90.0000   90.0209   90.0000      0.2847         1.0060    0.7040    3.9644    2.7742    3.9407
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0417    0.0401    0.0000    4.0802    0.0000      0.0206         0.0359    0.0183    0.2874    0.2489    0.3185
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0257   -0.4819   -0.7527)
 a2 = (   -1.1976   -0.3397    0.1650)
 a3 = (   -0.2718    0.7056   -0.4708)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0354   -0.4776   -0.7455) (    0.0135    0.0253    0.0168)
 a2 = (   -1.2082   -0.3425    0.1621) (    0.0654    0.0175    0.0059)
 a3 = (   -0.2643    0.7108   -0.4684) (    0.0093    0.0426    0.0127)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -81.3490  121.6774 -159.6058    0.3435    2.1361    0.4153
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0000   -0.0099      0.0024    0.0023    0.0778

# Number of computed bands
            171            294
# Figure of merit at the beginning and the end of the refinement
         2.1182         3.9020
# Chi-squares at the beginning and the end of the refinement
    5.1813    0.1604
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7285   -0.0585   -0.7310   -0.0567    0.0032    1    0.1409    0.0702
    2   -2   -1    2   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1468    0.0995
    3    1    0   -2   -0.0275    0.0915   -0.0262    0.0895    0.0024    1    0.1025    0.0967
    4   -3   -1    1   -0.1988   -0.5835   -0.1957   -0.5833    0.0031    1    0.2191    0.1078
    5   -1    0    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0676    0.0654
    6    1   -1   -3   -0.1089    0.1207   -0.1085    0.1216    0.0010    1    0.1622    0.0778
    7   -2    0    1    0.1156   -0.5974    0.1201   -0.5973    0.0045    1    0.1396    0.1302
    8   -2    1    2    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1543    0.1017
    9    0   -1   -1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0822    0.0726
   10   -1    1    1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0970    0.0467
   11   -3    1    1    0.5321   -0.6234    0.5303   -0.6130    0.0106    1    0.2649    0.1248
   12   -1   -2    0   -0.1439   -0.0705   -0.1829   -0.0381    0.0507    1    0.1404    0.0984
   13   -1    2    1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1510    0.0927
   14   -2    2    1    0.4432   -0.1614    0.5293   -0.1451    0.0877    1    0.2007    0.1473
   15   -1   -1    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    0    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0653    0.0679
   17   -1    1    0    0.7402   -0.0861    0.7293   -0.0807    0.0120    1    0.1222    0.1198
   18   -2    1    0    1.0701   -0.5348    1.0696   -0.4972    0.0376    1    0.2720    0.2483
   19    1    2   -1    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1439    0.0994
   20   -1    3   -1    0.4512    0.1676    0.4423    0.1634    0.0098    1    0.2512    0.1178
   21   -1   -1    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0912    0.0568
   22    0    1   -1    0.3019    0.3408    0.3053    0.3413    0.0035    1    0.0947    0.0899
   23    1    1   -3    0.0336    0.2766    0.0347    0.2716    0.0050    1    0.1697    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7339   -0.0559   -0.7310   -0.0567    0.0030    1          0.0662          0.0702
    2   -3   -1    3   -0.0127   -0.1719   -0.0130   -0.1762    0.0043    1          0.0992          0.0995
    3    2   -1   -4   -0.0290    0.0442   -0.0262    0.0895    0.0453    1          0.1015          0.0967
    4   -3   -1    1   -0.1965   -0.5859   -0.1957   -0.5833    0.0026    1          0.1025          0.1078
    5   -2    0    2    0.0567   -0.2214    0.0560   -0.2234    0.0021    1          0.0640          0.0654
    6    1   -1   -3   -0.1092    0.1226   -0.1085    0.1216    0.0013    1          0.0768          0.0778
    7   -4    0    2    0.1207   -0.5958    0.1201   -0.5973    0.0017    1          0.1311          0.1302
    8   -3    1    3    0.1435   -0.2181    0.1454   -0.2240    0.0062    1          0.1028          0.1017
    9    0   -2   -2   -0.1968    0.0494   -0.1952    0.0486    0.0018    1          0.0781          0.0726
   10   -1    1    1    0.2246   -0.1255    0.2251   -0.1274    0.0020    1          0.0460          0.0467
   11   -3    1    1    0.5373   -0.6121    0.5303   -0.6130    0.0071    1          0.1230          0.1248
   12   -1   -3   -1   -0.1820   -0.0377   -0.1829   -0.0381    0.0009    1          0.1003          0.0984
   13   -1    3    1    0.1970   -0.0081    0.1990   -0.0092    0.0022    1          0.1006          0.0927
   14   -3    3    1    0.5295   -0.1477    0.5293   -0.1451    0.0026    1          0.1484          0.1473
   15   -2   -2    0   -0.3365   -0.2359   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16    0    2    0    0.1263    0.0355    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -2    2    0    0.7293   -0.0792    0.7293   -0.0807    0.0016    1          0.1144          0.1198
   18   -4    2    0    1.0625   -0.5086    1.0696   -0.4972    0.0135    1          0.2500          0.2483
   19    1    3   -1    0.0449    0.0293    0.0442    0.0295    0.0008    1          0.0972          0.0994
   20   -1    3   -1    0.4453    0.1650    0.4423    0.1634    0.0033    1          0.1184          0.1178
   21   -1   -1    1   -0.0324   -0.0561   -0.0341   -0.0579    0.0025    1          0.0434          0.0568
   22    0    2   -2    0.3013    0.3353    0.3053    0.3413    0.0072    1          0.0900          0.0899
   23    1    1   -3    0.0365    0.2765    0.0347    0.2716    0.0051    1          0.0805          0.0816

###            No.53                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7964    1.1185    1.1228   90.5251   90.4131   90.4455      0.5948
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7897    1.1287    1.1218   90.0000   89.9727   90.0000      0.2848         0.7040    1.0062    2.7732    3.9636    3.9393
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0190    0.0200    0.0000    1.0732    0.0000      0.0187         0.0125    0.0186    0.1824    0.2690    0.2683
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.1976    0.3397   -0.1650)
 a2 = (   -0.0257    0.4819    0.7527)
 a3 = (    0.2718   -0.7056    0.4708)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.2082    0.3427   -0.1621) (    0.0032    0.0100    0.0055)
 a2 = (   -0.0355    0.4776    0.7453) (    0.0044    0.0102    0.0124)
 a3 = (    0.2640   -0.7111    0.4683) (    0.0124    0.0160    0.0070)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -8.6515   58.3150   20.4035    0.2941    0.4123    0.5401
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0000   -0.0102      0.0022    0.0023    0.0149

# Number of computed bands
            171            295
# Figure of merit at the beginning and the end of the refinement
         2.1182         3.8976
# Chi-squares at the beginning and the end of the refinement
    5.1923    0.1604
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7285   -0.0585   -0.7310   -0.0567    0.0032    1    0.1409    0.0702
    2    1    2   -2   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1468    0.0995
    3    0   -1    2   -0.0275    0.0915   -0.0262    0.0895    0.0024    1    0.1025    0.0967
    4    1    3   -1   -0.1988   -0.5835   -0.1957   -0.5833    0.0031    1    0.2191    0.1078
    5    0    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0676    0.0654
    6    1   -1    3   -0.1089    0.1207   -0.1085    0.1216    0.0010    1    0.1622    0.0778
    7    0    2   -1    0.1156   -0.5974    0.1201   -0.5973    0.0045    1    0.1396    0.1302
    8   -1    2   -2    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1543    0.1017
    9    1    0    1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0822    0.0726
   10   -1    1   -1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0970    0.0467
   11   -1    3   -1    0.5321   -0.6234    0.5303   -0.6130    0.0106    1    0.2649    0.1248
   12    2    1    0   -0.1439   -0.0705   -0.1829   -0.0381    0.0507    1    0.1404    0.0984
   13   -2    1   -1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1510    0.0927
   14   -2    2   -1    0.4432   -0.1614    0.5293   -0.1451    0.0877    1    0.2007    0.1473
   15    1    1    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16   -1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0653    0.0679
   17   -1    1    0    0.7402   -0.0861    0.7293   -0.0807    0.0120    1    0.1222    0.1198
   18   -1    2    0    1.0701   -0.5348    1.0696   -0.4972    0.0376    1    0.2720    0.2483
   19   -2   -1    1    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1439    0.0994
   20   -3    1    1    0.4512    0.1676    0.4423    0.1634    0.0098    1    0.2512    0.1178
   21    1    1   -1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0912    0.0568
   22   -1    0    1    0.3019    0.3408    0.3053    0.3413    0.0035    1    0.0947    0.0899
   23   -1   -1    3    0.0336    0.2766    0.0347    0.2716    0.0050    1    0.1697    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    1   -0.7342   -0.0559   -0.7310   -0.0567    0.0032    1          0.0662          0.0702
    2    1    3   -3   -0.0127   -0.1718   -0.0130   -0.1762    0.0044    1          0.0992          0.0995
    3    1   -2    4   -0.0290    0.0442   -0.0262    0.0895    0.0453    1          0.1016          0.0967
    4    1    3   -1   -0.1964   -0.5858   -0.1957   -0.5833    0.0026    1          0.1025          0.1078
    5    0    2   -2    0.0567   -0.2214    0.0560   -0.2234    0.0021    1          0.0640          0.0654
    6    1   -1    3   -0.1092    0.1227   -0.1085    0.1216    0.0013    1          0.0768          0.0778
    7    0    4   -2    0.1207   -0.5957    0.1201   -0.5973    0.0017    1          0.1310          0.1302
    8   -1    3   -3    0.1435   -0.2181    0.1454   -0.2240    0.0062    1          0.1028          0.1017
    9    2    0    2   -0.1968    0.0495   -0.1952    0.0486    0.0018    1          0.0781          0.0726
   10   -1    1   -1    0.2247   -0.1256    0.2251   -0.1274    0.0019    1          0.0460          0.0467
   11   -1    3   -1    0.5373   -0.6121    0.5303   -0.6130    0.0071    1          0.1230          0.1248
   12    3    1    1   -0.1820   -0.0377   -0.1829   -0.0381    0.0009    1          0.1003          0.0984
   13   -3    1   -1    0.1971   -0.0081    0.1990   -0.0092    0.0022    1          0.1006          0.0927
   14   -3    3   -1    0.5296   -0.1477    0.5293   -0.1451    0.0026    1          0.1484          0.1473
   15    2    2    0   -0.3364   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16   -2    0    0    0.1263    0.0356    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -2    2    0    0.7294   -0.0791    0.7293   -0.0807    0.0016    1          0.1144          0.1198
   18   -2    4    0    1.0626   -0.5085    1.0696   -0.4972    0.0133    1          0.2500          0.2483
   19   -3   -1    1    0.0449    0.0293    0.0442    0.0295    0.0008    1          0.0973          0.0994
   20   -3    1    1    0.4453    0.1650    0.4423    0.1634    0.0033    1          0.1184          0.1178
   21    1    1   -1   -0.0324   -0.0561   -0.0341   -0.0579    0.0025    1          0.0434          0.0568
   22   -2    0    2    0.3013    0.3352    0.3053    0.3413    0.0073    1          0.0900          0.0899
   23   -1   -1    3    0.0365    0.2764    0.0347    0.2716    0.0051    1          0.0805          0.0816

###            No.54                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7925    1.1212    1.1255   90.5251   90.1662   90.1315      0.5719
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7897    1.1287    1.1218   90.0000   90.0273   90.0000      0.2848         0.7040    1.0062    2.7732    3.9636    3.9393
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0190    0.0200    0.0000    1.0732    0.0000      0.0187         0.0125    0.0186    0.1824    0.2690    0.2683
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.2034    0.3413   -0.1658)
 a2 = (    0.0342   -0.4783   -0.7521)
 a3 = (   -0.2625    0.7063   -0.4708)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.2082    0.3427   -0.1621) (    0.0032    0.0100    0.0055)
 a2 = (    0.0355   -0.4776   -0.7453) (    0.0044    0.0102    0.0124)
 a3 = (   -0.2640    0.7111   -0.4683) (    0.0124    0.0160    0.0070)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -171.3485  121.6850 -159.5965    0.2941    0.4123    0.5401
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0000   -0.0102      0.0022    0.0023    0.0149

# Number of computed bands
            181            295
# Figure of merit at the beginning and the end of the refinement
         2.3105         3.8976
# Chi-squares at the beginning and the end of the refinement
    4.8670    0.1604
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7338   -0.0581   -0.7310   -0.0567    0.0031    1    0.1353    0.0702
    2    1   -2    2   -0.0313   -0.1393   -0.0130   -0.1762    0.0412    1    0.1410    0.0995
    3    0    1   -2   -0.0273    0.0922   -0.0262    0.0895    0.0030    1    0.0983    0.0967
    4    1   -3    1   -0.1977   -0.5856   -0.1957   -0.5833    0.0030    1    0.2102    0.1078
    5    0   -1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0648    0.0654
    6    1    1   -3   -0.1090    0.1214   -0.1085    0.1216    0.0006    1    0.1554    0.0778
    7    0   -2    1    0.1190   -0.5977    0.1201   -0.5973    0.0012    1    0.1340    0.1302
    8   -1   -2    2    0.1782   -0.2012    0.1454   -0.2240    0.0400    1    0.1482    0.1017
    9    1    0   -1   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0788    0.0726
   10   -1   -1    1    0.2264   -0.1273    0.2251   -0.1274    0.0013    1    0.0933    0.0467
   11   -1   -3    1    0.5369   -0.6161    0.5303   -0.6130    0.0073    1    0.2543    0.1248
   12    2   -1    0   -0.1430   -0.0700   -0.1829   -0.0381    0.0511    1    0.1350    0.0984
   13   -2   -1    1    0.2191   -0.0407    0.1990   -0.0092    0.0374    1    0.1456    0.0927
   14   -2   -2    1    0.4419   -0.1582    0.5293   -0.1451    0.0884    1    0.1934    0.1473
   15    1   -1    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0887    0.0881
   16   -1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0631    0.0679
   17   -1   -1    0    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1174    0.1198
   18   -1   -2    0    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.2589    0.2483
   19   -2    1   -1    0.0134    0.0118    0.0442    0.0295    0.0355    1    0.1388    0.0994
   20   -3   -1   -1    0.4473    0.1656    0.4423    0.1634    0.0055    1    0.2426    0.1178
   21    1   -1    1   -0.0332   -0.0559   -0.0341   -0.0579    0.0022    1    0.0878    0.0568
   22   -1    0   -1    0.3021    0.3363    0.3053    0.3413    0.0059    1    0.0915    0.0899
   23   -1    1   -3    0.0359    0.2765    0.0347    0.2716    0.0050    1    0.1634    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7342   -0.0559   -0.7310   -0.0567    0.0032    1          0.0662          0.0702
    2    1   -3    3   -0.0127   -0.1718   -0.0130   -0.1762    0.0044    1          0.0992          0.0995
    3    1    2   -4   -0.0290    0.0442   -0.0262    0.0895    0.0453    1          0.1016          0.0967
    4    1   -3    1   -0.1964   -0.5858   -0.1957   -0.5833    0.0026    1          0.1025          0.1078
    5    0   -2    2    0.0567   -0.2214    0.0560   -0.2234    0.0021    1          0.0640          0.0654
    6    1    1   -3   -0.1092    0.1227   -0.1085    0.1216    0.0013    1          0.0768          0.0778
    7    0   -4    2    0.1207   -0.5957    0.1201   -0.5973    0.0017    1          0.1310          0.1302
    8   -1   -3    3    0.1435   -0.2181    0.1454   -0.2240    0.0062    1          0.1028          0.1017
    9    2    0   -2   -0.1968    0.0495   -0.1952    0.0486    0.0018    1          0.0781          0.0726
   10   -1   -1    1    0.2247   -0.1256    0.2251   -0.1274    0.0019    1          0.0460          0.0467
   11   -1   -3    1    0.5373   -0.6121    0.5303   -0.6130    0.0071    1          0.1230          0.1248
   12    3   -1   -1   -0.1820   -0.0377   -0.1829   -0.0381    0.0009    1          0.1003          0.0984
   13   -3   -1    1    0.1971   -0.0081    0.1990   -0.0092    0.0022    1          0.1006          0.0927
   14   -3   -3    1    0.5296   -0.1477    0.5293   -0.1451    0.0026    1          0.1484          0.1473
   15    2   -2    0   -0.3364   -0.2360   -0.3362   -0.2357    0.0003    1          0.0873          0.0881
   16   -2    0    0    0.1263    0.0356    0.1275    0.0362    0.0013    1          0.0624          0.0679
   17   -2   -2    0    0.7294   -0.0791    0.7293   -0.0807    0.0016    1          0.1144          0.1198
   18   -2   -4    0    1.0626   -0.5085    1.0696   -0.4972    0.0133    1          0.2500          0.2483
   19   -3    1   -1    0.0449    0.0293    0.0442    0.0295    0.0008    1          0.0973          0.0994
   20   -3   -1   -1    0.4453    0.1650    0.4423    0.1634    0.0033    1          0.1184          0.1178
   21    1   -1    1   -0.0324   -0.0561   -0.0341   -0.0579    0.0025    1          0.0434          0.0568
   22   -2    0   -2    0.3013    0.3352    0.3053    0.3413    0.0073    1          0.0900          0.0899
   23   -1    1   -3    0.0365    0.2764    0.0347    0.2716    0.0051    1          0.0805          0.0816

###            No.55                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1166    0.7893    1.1348   89.9292   90.7310   90.0363      0.2976
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1161    0.7969    1.1243   90.0000   89.9484   90.0000      0.2814         0.9927    0.7088    3.9664    2.8322    3.9957
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0200    0.0264    0.0000    2.4844    0.0000      0.0190         0.0233    0.0153    0.2674    0.2038    0.2853
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4974   -0.2871    0.6873)
 a2 = (   -0.3000    1.1977    0.2843)
 a3 = (   -0.7086   -0.0549   -0.5211)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4893   -0.2881    0.6931) (    0.0181    0.0044    0.0118)
 a2 = (   -0.2991    1.1856    0.2817) (    0.0111    0.0309    0.0067)
 a3 = (   -0.7138   -0.0547   -0.5278) (    0.0246    0.0113    0.0117)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   73.8184  126.3470  -85.6005    0.3457    1.3556    0.4973
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0005    0.0020      0.0023    0.0024    0.0424

# Number of computed bands
            183            180
# Figure of merit at the beginning and the end of the refinement
         3.6665         3.8188
# Chi-squares at the beginning and the end of the refinement
    0.0817    0.0279
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0693    0.0702
    2   -1    3   -1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1    0.1056    0.0995
    3    1   -3   -1   -0.0249    0.0857   -0.0262    0.0895    0.0040    1    0.1032    0.0967
    4    0    2   -2   -0.1896   -0.5812   -0.1957   -0.5833    0.0065    1    0.1086    0.1078
    5    0    2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0682    0.0654
    6    0   -2   -2   -0.1028    0.1165   -0.1085    0.1216    0.0076    1    0.0808    0.0778
    7    1    3   -1    0.1206   -0.5886    0.1201   -0.5973    0.0087    1    0.1395    0.1302
    8    1    3    1    0.1430   -0.2208    0.1454   -0.2240    0.0040    1    0.1096    0.1017
    9   -1   -1   -3   -0.1901    0.0485   -0.1952    0.0486    0.0051    1    0.0817    0.0726
   10    1    1    1    0.2261   -0.1285    0.2251   -0.1274    0.0014    1    0.0489    0.0467
   11    2    2    0    0.5288   -0.6039    0.5303   -0.6130    0.0092    1    0.1307    0.1248
   12   -2    0   -4   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.1051    0.0984
   13    3    1    3    0.1994   -0.0087    0.1990   -0.0092    0.0006    1    0.1064    0.0927
   14    4    2    2    0.5256   -0.1491    0.5293   -0.1451    0.0055    1    0.1580    0.1473
   15   -1    1   -3   -0.3321   -0.2358   -0.3362   -0.2357    0.0041    1    0.0918    0.0881
   16    2    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0658    0.0679
   17    3    1    1    0.7206   -0.0811    0.7293   -0.0807    0.0087    1    0.1214    0.1198
   18    4    2    0    1.0401   -0.5008    1.0696   -0.4972    0.0297    1    0.2632    0.2483
   19    3   -1    3    0.0445    0.0298    0.0442    0.0295    0.0004    1    0.1027    0.0994
   20    4    0    2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.1255    0.1178
   21   -1    1   -1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0460    0.0568
   22    3   -1    1    0.2955    0.3286    0.3053    0.3413    0.0161    1    0.0951    0.0899
   23    2   -2    0    0.0354    0.2667    0.0347    0.2716    0.0051    1    0.0851    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7334   -0.0567   -0.7310   -0.0567    0.0024    1          0.0665          0.0702
    2   -1    3   -1   -0.0134   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3    1   -3   -1   -0.0268    0.0905   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4    0    2   -2   -0.1957   -0.5863   -0.1957   -0.5833    0.0030    1          0.1031          0.1078
    5    0    2    0    0.0564   -0.2234    0.0560   -0.2234    0.0004    1          0.0640          0.0654
    6    0   -2   -2   -0.1078    0.1200   -0.1085    0.1216    0.0017    1          0.0765          0.0778
    7    1    3   -1    0.1208   -0.5965    0.1201   -0.5973    0.0011    1          0.1321          0.1302
    8    1    3    1    0.1438   -0.2204    0.1454   -0.2240    0.0040    1          0.1029          0.1017
    9   -1   -1   -3   -0.1949    0.0483   -0.1952    0.0486    0.0004    1          0.0777          0.0726
   10    1    1    1    0.2260   -0.1272    0.2251   -0.1274    0.0009    1          0.0460          0.0467
   11    2    2    0    0.5376   -0.6123    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12   -2    0   -4   -0.1807   -0.0380   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    3    1    3    0.1984   -0.0085    0.1990   -0.0092    0.0008    1          0.1005          0.0927
   14    4    2    2    0.5303   -0.1482    0.5293   -0.1451    0.0033    1          0.1495          0.1473
   15   -1    1   -3   -0.3357   -0.2364   -0.3362   -0.2357    0.0009    1          0.0873          0.0881
   16    2    0    2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    3    1    1    0.7292   -0.0789    0.7293   -0.0807    0.0018    1          0.1156          0.1198
   18    4    2    0    1.0614   -0.5067    1.0696   -0.4972    0.0126    1          0.2543          0.2483
   19    3   -1    3    0.0448    0.0293    0.0442    0.0295    0.0007    1          0.0970          0.0994
   20    4    0    2    0.4446    0.1651    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1    1   -1   -0.0331   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    3   -1    1    0.2994    0.3339    0.3053    0.3413    0.0095    1          0.0902          0.0899
   23    2   -2    0    0.0355    0.2735    0.0347    0.2716    0.0021    1          0.0805          0.0816

###            No.56                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7893    1.1348    1.1166   89.2690   90.0363   90.0708      0.2976
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7971    1.1240    1.1162   90.0000   90.1110   90.0000      0.2815         0.7141    1.0069    2.8315    3.9929    3.9654
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0223    0.0177    0.0000    1.0356    0.0000      0.0183         0.0113    0.0219    0.1838    0.2710    0.2650
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3000   -1.1977   -0.2843)
 a2 = (   -0.7086   -0.0549   -0.5211)
 a3 = (    0.4974    0.2871   -0.6873)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2999   -1.1852   -0.2820) (    0.0101    0.0036    0.0071)
 a2 = (   -0.7142   -0.0552   -0.5276) (    0.0168    0.0068    0.0082)
 a3 = (    0.4898    0.2870   -0.6931) (    0.0120    0.0102    0.0113)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -159.2451  140.6403  120.5290    0.5295    0.4387    0.7927
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            183            181
# Figure of merit at the beginning and the end of the refinement
         3.6665         3.8180
# Chi-squares at the beginning and the end of the refinement
    0.1041    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0693    0.0702
    2   -3   -1    1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1    0.1056    0.0995
    3    3   -1   -1   -0.0249    0.0857   -0.0262    0.0895    0.0040    1    0.1032    0.0967
    4   -2   -2    0   -0.1896   -0.5812   -0.1957   -0.5833    0.0065    1    0.1086    0.1078
    5   -2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0682    0.0654
    6    2   -2    0   -0.1028    0.1165   -0.1085    0.1216    0.0076    1    0.0808    0.0778
    7   -3   -1   -1    0.1206   -0.5886    0.1201   -0.5973    0.0087    1    0.1395    0.1302
    8   -3    1   -1    0.1430   -0.2208    0.1454   -0.2240    0.0040    1    0.1096    0.1017
    9    1   -3    1   -0.1901    0.0485   -0.1952    0.0486    0.0051    1    0.0817    0.0726
   10   -1    1   -1    0.2261   -0.1285    0.2251   -0.1274    0.0014    1    0.0489    0.0467
   11   -2    0   -2    0.5288   -0.6039    0.5303   -0.6130    0.0092    1    0.1307    0.1248
   12    0   -4    2   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.1051    0.0984
   13   -1    3   -3    0.1994   -0.0087    0.1990   -0.0092    0.0006    1    0.1064    0.0927
   14   -2    2   -4    0.5256   -0.1491    0.5293   -0.1451    0.0055    1    0.1580    0.1473
   15   -1   -3    1   -0.3321   -0.2358   -0.3362   -0.2357    0.0041    1    0.0918    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0658    0.0679
   17   -1    1   -3    0.7206   -0.0811    0.7293   -0.0807    0.0087    1    0.1214    0.1198
   18   -2    0   -4    1.0401   -0.5008    1.0696   -0.4972    0.0297    1    0.2632    0.2483
   19    1    3   -3    0.0445    0.0298    0.0442    0.0295    0.0004    1    0.1027    0.0994
   20    0    2   -4    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.1255    0.1178
   21   -1   -1    1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0460    0.0568
   22    1    1   -3    0.2955    0.3286    0.3053    0.3413    0.0161    1    0.0951    0.0899
   23    2    0   -2    0.0354    0.2667    0.0347    0.2716    0.0051    1    0.0851    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2   -3   -1    1   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3    3   -1   -1   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4   -2   -2    0   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5   -2    0    0    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6    2   -2    0   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7   -3   -1   -1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8   -3    1   -1    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9    1   -3    1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10   -1    1   -1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11   -2    0   -2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    0   -4    2   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13   -1    3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14   -2    2   -4    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15   -1   -3    1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    0    2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17   -1    1   -3    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18   -2    0   -4    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19    1    3   -3    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0    2   -4    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21   -1   -1    1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22    1    1   -3    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23    2    0   -2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.57                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7865    1.1469    1.1091   91.6844   90.0420   90.0095      0.6101
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7971    1.1240    1.1162   90.0000   89.8891   90.0000      0.2815         0.7141    1.0069    2.8315    3.9929    3.9654
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0223    0.0177    0.0000    1.0356    0.0000      0.0183         0.0113    0.0219    0.1838    0.2710    0.2650
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3011    1.2023    0.2832)
 a2 = (    0.7014    0.0544    0.5158)
 a3 = (    0.5128    0.2900   -0.6831)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2999    1.1852    0.2820) (    0.0101    0.0036    0.0071)
 a2 = (    0.7142    0.0552    0.5276) (    0.0168    0.0068    0.0082)
 a3 = (    0.4898    0.2870   -0.6931) (    0.0120    0.0102    0.0113)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   20.7549  140.6403  120.5289    0.5295    0.4387    0.7927
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0004    0.0015      0.0023    0.0023    0.0122

# Number of computed bands
            400            181
# Figure of merit at the beginning and the end of the refinement
         1.6478         3.8179
# Chi-squares at the beginning and the end of the refinement
    9.2352    0.0277
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    2    1    1   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1525    0.0995
    3   -2    0   -1   -0.0014    0.0433   -0.0262    0.0895    0.0524    1    0.1420    0.0967
    4    1    1    0   -0.1838   -0.5772   -0.1957   -0.5833    0.0133    1    0.1106    0.1078
    5    1    0    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0701    0.0654
    6   -1    1    0   -0.1004    0.1150   -0.1085    0.1216    0.0104    1    0.0827    0.0778
    7    3    1   -1    0.1233   -0.5815    0.1201   -0.5973    0.0162    1    0.2870    0.1302
    8    2   -1   -1    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1601    0.1017
    9    0    2    1   -0.1744   -0.0363   -0.1952    0.0486    0.0874    1    0.1076    0.0726
   10    1   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.1007    0.0467
   11    1    0   -1    0.5262   -0.5897    0.5303   -0.6130    0.0237    1    0.1329    0.1248
   12    0    2    1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13    1   -2   -2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1569    0.0927
   14    1   -1   -2    0.5182   -0.1451    0.5293   -0.1451    0.0111    1    0.1621    0.1473
   15    1    3    1   -0.3279   -0.2344   -0.3362   -0.2357    0.0084    1    0.1878    0.0881
   16    0   -1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1   -1   -3    0.7064   -0.0772    0.7293   -0.0807    0.0232    1    0.2490    0.1198
   18    1    0   -2    1.0190   -0.4779    1.0696   -0.4972    0.0542    0    0.2636    0.2483
   19   -1   -2   -2    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1496    0.0994
   20    0   -1   -2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    1    1    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0948    0.0568
   22   -1   -1   -3    0.2927    0.3211    0.3053    0.3413    0.0239    0    0.1964    0.0899
   23   -1    0   -1    0.0373    0.2627    0.0347    0.2716    0.0093    1    0.0875    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    2    0   -0.7331   -0.0571   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    3    1    1   -0.0134   -0.1737   -0.0130   -0.1762    0.0025    1          0.0991          0.0995
    3   -3    1   -1   -0.0269    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4    2    2    0   -0.1958   -0.5867   -0.1957   -0.5833    0.0034    1          0.1032          0.1078
    5    2    0    0    0.0566   -0.2237    0.0560   -0.2234    0.0007    1          0.0640          0.0654
    6   -2    2    0   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0765          0.0778
    7    3    1   -1    0.1212   -0.5966    0.1201   -0.5973    0.0013    1          0.1321          0.1302
    8    3   -1   -1    0.1441   -0.2204    0.1454   -0.2240    0.0038    1          0.1030          0.1017
    9   -1    3    1   -0.1947    0.0482   -0.1952    0.0486    0.0006    1          0.0777          0.0726
   10    1   -1   -1    0.2261   -0.1271    0.2251   -0.1274    0.0011    1          0.0460          0.0467
   11    2    0   -2    0.5376   -0.6118    0.5303   -0.6130    0.0073    1          0.1246          0.1248
   12    0    4    2   -0.1807   -0.0379   -0.1829   -0.0381    0.0022    1          0.0999          0.0984
   13    1   -3   -3    0.1984   -0.0085    0.1990   -0.0092    0.0009    1          0.1006          0.0927
   14    2   -2   -4    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    1    3    1   -0.3359   -0.2363   -0.3362   -0.2357    0.0007    1          0.0873          0.0881
   16    0   -2   -2    0.1270    0.0356    0.1275    0.0362    0.0007    1          0.0622          0.0679
   17    1   -1   -3    0.7287   -0.0794    0.7293   -0.0807    0.0015    1          0.1156          0.1198
   18    2    0   -4    1.0599   -0.5068    1.0696   -0.4972    0.0136    1          0.2541          0.2483
   19   -1   -3   -3    0.0448    0.0294    0.0442    0.0295    0.0006    1          0.0970          0.0994
   20    0   -2   -4    0.4448    0.1647    0.4423    0.1634    0.0028    1          0.1189          0.1178
   21    1    1    1   -0.0333   -0.0568   -0.0341   -0.0579    0.0014    1          0.0433          0.0568
   22   -1   -1   -3    0.2999    0.3340    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -2    0   -2    0.0355    0.2738    0.0347    0.2716    0.0023    1          0.0804          0.0816

###            No.59                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7893    1.1166    1.1348   89.2690   90.0708   90.0363      0.2976
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7968    1.1167    1.1239   90.0000   89.8773   90.0000      0.2818         0.7089    0.9936    2.8270    3.9623    3.9878
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0174    0.0213    0.0000    0.8440    0.0000      0.0182         0.0134    0.0221    0.1825    0.2631    0.2683
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3000    1.1977    0.2843)
 a2 = (   -0.4974   -0.2871    0.6873)
 a3 = (    0.7086    0.0549    0.5211)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3003    1.1857    0.2812) (    0.0106    0.0025    0.0060)
 a2 = (   -0.4891   -0.2881    0.6925) (    0.0118    0.0058    0.0099)
 a3 = (    0.7147    0.0540    0.5272) (    0.0168    0.0088    0.0078)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   16.1581   53.6261   94.4640    0.3597    0.4365    0.6522
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006    0.0006      0.0023    0.0022    0.0122

# Number of computed bands
            183            183
# Figure of merit at the beginning and the end of the refinement
         3.6665         3.8066
# Chi-squares at the beginning and the end of the refinement
    0.1138    0.0275
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0693    0.0702
    2    3   -1    1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1    0.1056    0.0995
    3   -3    1    1   -0.0249    0.0857   -0.0262    0.0895    0.0040    1    0.1032    0.0967
    4    2    0    2   -0.1896   -0.5812   -0.1957   -0.5833    0.0065    1    0.1086    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0682    0.0654
    6   -2    0    2   -0.1028    0.1165   -0.1085    0.1216    0.0076    1    0.0808    0.0778
    7    3    1    1    0.1206   -0.5886    0.1201   -0.5973    0.0087    1    0.1395    0.1302
    8    3    1   -1    0.1430   -0.2208    0.1454   -0.2240    0.0040    1    0.1096    0.1017
    9   -1   -1    3   -0.1901    0.0485   -0.1952    0.0486    0.0051    1    0.0817    0.0726
   10    1    1   -1    0.2261   -0.1285    0.2251   -0.1274    0.0014    1    0.0489    0.0467
   11    2    2    0    0.5288   -0.6039    0.5303   -0.6130    0.0092    1    0.1307    0.1248
   12    0   -2    4   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.1051    0.0984
   13    1    3   -3    0.1994   -0.0087    0.1990   -0.0092    0.0006    1    0.1064    0.0927
   14    2    4   -2    0.5256   -0.1491    0.5293   -0.1451    0.0055    1    0.1580    0.1473
   15    1   -1    3   -0.3321   -0.2358   -0.3362   -0.2357    0.0041    1    0.0918    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0658    0.0679
   17    1    3   -1    0.7206   -0.0811    0.7293   -0.0807    0.0087    1    0.1214    0.1198
   18    2    4    0    1.0401   -0.5008    1.0696   -0.4972    0.0297    1    0.2632    0.2483
   19   -1    3   -3    0.0445    0.0298    0.0442    0.0295    0.0004    1    0.1027    0.0994
   20    0    4   -2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.1255    0.1178
   21    1   -1    1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0460    0.0568
   22   -1    3   -1    0.2955    0.3286    0.3053    0.3413    0.0161    1    0.0951    0.0899
   23   -2    2    0    0.0354    0.2667    0.0347    0.2716    0.0051    1    0.0851    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7330   -0.0559   -0.7310   -0.0567    0.0021    1          0.0665          0.0702
    2    3   -1    1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1          0.0992          0.0995
    3   -3    1    1   -0.0269    0.0905   -0.0262    0.0895    0.0013    1          0.0972          0.0967
    4    2    0    2   -0.1958   -0.5868   -0.1957   -0.5833    0.0035    1          0.1031          0.1078
    5    2    0    0    0.0565   -0.2233    0.0560   -0.2234    0.0006    1          0.0640          0.0654
    6   -2    0    2   -0.1079    0.1198   -0.1085    0.1216    0.0019    1          0.0766          0.0778
    7    3    1    1    0.1213   -0.5965    0.1201   -0.5973    0.0014    1          0.1320          0.1302
    8    3    1   -1    0.1438   -0.2201    0.1454   -0.2240    0.0042    1          0.1030          0.1017
    9   -1   -1    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0778          0.0726
   10    1    1   -1    0.2258   -0.1271    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    2    2    0    0.5378   -0.6119    0.5303   -0.6130    0.0075    1          0.1244          0.1248
   12    0   -2    4   -0.1807   -0.0379   -0.1829   -0.0381    0.0021    1          0.0999          0.0984
   13    1    3   -3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1006          0.0927
   14    2    4   -2    0.5301   -0.1482    0.5293   -0.1451    0.0032    1          0.1495          0.1473
   15    1   -1    3   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0873          0.0881
   16    0    2   -2    0.1271    0.0355    0.1275    0.0362    0.0008    1          0.0622          0.0679
   17    1    3   -1    0.7290   -0.0791    0.7293   -0.0807    0.0017    1          0.1155          0.1198
   18    2    4    0    1.0614   -0.5064    1.0696   -0.4972    0.0123    1          0.2539          0.2483
   19   -1    3   -3    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0970          0.0994
   20    0    4   -2    0.4449    0.1650    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1   -1    1   -0.0331   -0.0568   -0.0341   -0.0579    0.0016    1          0.0433          0.0568
   22   -1    3   -1    0.2996    0.3343    0.3053    0.3413    0.0090    1          0.0902          0.0899
   23   -2    2    0    0.0353    0.2738    0.0347    0.2716    0.0022    1          0.0805          0.0816

###            No.60                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9875    1.0070    1.0057   89.9624   90.8496   90.0220      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9938    1.0085    0.9996   90.0000   93.3722   90.0000      0.3918         0.9942    1.0089    2.5363    2.5738    2.5511
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0014    0.0404    0.0431    0.0000    1.3402    0.0000      0.0255         0.0434    0.0145    0.1649    0.1965    0.1990
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.2012   -0.1799    0.9761)
 a2 = (    0.2352   -0.9391   -0.2212)
 a3 = (    0.9484    0.2690   -0.1306)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2261   -0.1638    0.9686) (    0.0173    0.0099    0.0031)
 a2 = (    0.2518   -0.9343   -0.2167) (    0.0121    0.0384    0.0057)
 a3 = (    0.9545    0.2836   -0.1135) (    0.0426    0.0125    0.0059)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  102.8150   99.7926  107.2992    0.4016    1.0340    0.4351
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0087   -0.0080    0.0021      0.0023    0.0024    0.0433

# Number of computed bands
            133            400
# Figure of merit at the beginning and the end of the refinement
         2.7728         3.7380
# Chi-squares at the beginning and the end of the refinement
    3.1246    1.5815
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    0   -2    1   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3    1    3    0   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4    1   -2    1   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0   -1    0    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6    1    2    1   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7    1   -3    0    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    0   -2   -1    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9    1    1    2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11    1   -2   -1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12    1    0    3   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    0   -1   -2    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14    1   -2   -3    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15    1   -1    2   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17    1   -1   -2    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18    1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    0    1   -2    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20    1    0   -3    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    0   -1    1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22    1    1   -2    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23    1    2   -1    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7067   -0.0647   -0.7310   -0.0567    0.0256    1          0.0750          0.0702
    2    0   -3    1   -0.0025   -0.1648   -0.0130   -0.1762    0.0155    1          0.1092          0.0995
    3    1    3    0   -0.0233    0.1045   -0.0262    0.0895    0.0153    1          0.1072          0.0967
    4    1   -2    1   -0.1886   -0.5715   -0.1957   -0.5833    0.0138    1          0.1145          0.1078
    5    0   -2    0    0.0668   -0.2079    0.0560   -0.2234    0.0190    0          0.0703          0.0654
    6    1    2    1   -0.1115    0.1328   -0.1085    0.1216    0.0116    1          0.0857          0.0778
    7    1   -3    0    0.1267   -0.5805    0.1201   -0.5973    0.0181    1          0.1446          0.1302
    8    0   -3   -1    0.1492   -0.1992    0.1454   -0.2240    0.0251    0          0.1127          0.1017
    9    1    1    2   -0.2004    0.0545   -0.1952    0.0486    0.0078    1          0.0883          0.0726
   10    0   -1   -1    0.2203   -0.1062    0.2251   -0.1274    0.0218    0          0.0503          0.0467
   11    1   -2   -1    0.5353   -0.5996    0.5303   -0.6130    0.0143    1          0.1346          0.1248
   12    1    0    3   -0.1846   -0.0350   -0.1829   -0.0381    0.0035    1          0.1133          0.0984
   13    0   -1   -2    0.2079   -0.0259    0.1990   -0.0092    0.0190    1          0.0786          0.0927
   14    1   -2   -3    0.5242   -0.1322    0.5293   -0.1451    0.0139    1          0.1607          0.1473
   15    1   -1    2   -0.3288   -0.2318   -0.3362   -0.2357    0.0084    1          0.0990          0.0881
   16    0    0   -2    0.1177    0.0404    0.1275    0.0362    0.0106    1          0.0685          0.0679
   17    1   -1   -2    0.7292   -0.0678    0.7293   -0.0807    0.0129    1          0.1240          0.1198
   18    2   -2   -2    1.0692   -0.5189    1.0696   -0.4972    0.0218    1          0.2776          0.2483
   19    0    1   -3    0.0409    0.0300    0.0442    0.0295    0.0033    1          0.1071          0.0994
   20    1    0   -3    0.4402    0.1739    0.4423    0.1634    0.0108    1          0.1278          0.1178
   21    0   -1    1   -0.0279   -0.0555   -0.0341   -0.0579    0.0067    1          0.0478          0.0568
   22    1    1   -2    0.2986    0.3454    0.3053    0.3413    0.0078    1          0.0973          0.0899
   23    1    2   -1    0.0355    0.2848    0.0347    0.2716    0.0132    1          0.0879          0.0816

###            No.61                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7902    1.1160    1.1341   90.7305   90.4012   90.0643      0.3924
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8043    1.1291    1.1016   90.0000   88.4514   90.0000      0.3437         0.7301    1.0249    2.3400    3.2848    3.2049
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0003    0.0176    0.0202    0.0000    0.8603    0.0000      0.0230         0.0134    0.0222    0.1568    0.2260    0.2227
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3084   -1.1954   -0.2783)
 a2 = (    0.4977    0.2873   -0.6877)
 a3 = (    0.7090    0.0550    0.5214)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2932   -1.1753   -0.2821) (    0.0106    0.0024    0.0060)
 a2 = (    0.4778    0.2846   -0.6893) (    0.0117    0.0058    0.0099)
 a3 = (    0.7280    0.0787    0.5371) (    0.0167    0.0090    0.0076)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -163.7547   54.1587   94.3262    0.3614    0.4316    0.6552
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0016   -0.0091    0.0093      0.0023    0.0022    0.0121

# Number of computed bands
            179            175
# Figure of merit at the beginning and the end of the refinement
         3.1450         3.3672
# Chi-squares at the beginning and the end of the refinement
    2.1638    1.4226
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0915    0.0702
    2   -3    1    1   -0.0121   -0.1693   -0.0130   -0.1762    0.0069    1    0.1389    0.0995
    3    3   -1    1   -0.0268    0.0900   -0.0262    0.0895    0.0008    1    0.1364    0.0967
    4   -2    0    2   -0.1859   -0.5800   -0.1957   -0.5833    0.0104    1    0.1424    0.1078
    5   -1    0    0    0.0563   -0.2183    0.0560   -0.2234    0.0051    1    0.0448    0.0654
    6    1    0    1   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0535    0.0778
    7   -3   -1    1    0.1241   -0.5830    0.1201   -0.5973    0.0148    1    0.1831    0.1302
    8   -2   -1   -1    0.1752   -0.1969    0.1454   -0.2240    0.0403    1    0.1024    0.1017
    9    1    1    3   -0.1917    0.0486   -0.1952    0.0486    0.0035    1    0.1082    0.0726
   10   -1   -1   -1    0.2228   -0.1254    0.2251   -0.1274    0.0031    1    0.0645    0.0467
   11   -1   -1    0    0.5281   -0.5950    0.5303   -0.6130    0.0182    1    0.0855    0.1248
   12    0    1    2   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0693    0.0984
   13   -1   -2   -2    0.2168   -0.0407    0.1990   -0.0092    0.0362    1    0.1003    0.0927
   14   -1   -2   -1    0.5213   -0.1466    0.5293   -0.1451    0.0081    1    0.1038    0.1473
   15   -1    1    3   -0.3311   -0.2355   -0.3362   -0.2357    0.0051    1    0.1207    0.0881
   16    0   -2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0869    0.0679
   17   -1   -3   -1    0.7161   -0.0795    0.7293   -0.0807    0.0133    1    0.1598    0.1198
   18   -1   -2    0    1.0339   -0.4924    1.0696   -0.4972    0.0360    1    0.1714    0.2483
   19    1   -2   -2    0.0143    0.0128    0.0442    0.0295    0.0343    1    0.0953    0.0994
   20    0   -2   -1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0827    0.1178
   21   -1    1    1   -0.0317   -0.0543   -0.0341   -0.0579    0.0043    1    0.0604    0.0568
   22    1   -3   -1    0.2972    0.3316    0.3053    0.3413    0.0127    1    0.1257    0.0899
   23    1   -1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0562    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7208   -0.0690   -0.7310   -0.0567    0.0160    1          0.0833          0.0702
    2   -3    1    1   -0.0131   -0.1665   -0.0130   -0.1762    0.0097    1          0.1221          0.0995
    3    3   -1    1   -0.0264    0.1015   -0.0262    0.0895    0.0121    1          0.1180          0.0967
    4   -2    0    2   -0.1987   -0.5686   -0.1957   -0.5833    0.0150    1          0.1286          0.1078
    5   -2    0    0    0.0575   -0.2148    0.0560   -0.2234    0.0088    1          0.0782          0.0654
    6    2    0    2   -0.1133    0.1324   -0.1085    0.1216    0.0119    1          0.0933          0.0778
    7   -3   -1    1    0.1148   -0.5879    0.1201   -0.5973    0.0108    1          0.1630          0.1302
    8   -3   -1   -1    0.1453   -0.2089    0.1454   -0.2240    0.0151    1          0.1251          0.1017
    9    1    1    3   -0.2029    0.0544   -0.1952    0.0486    0.0096    1          0.0964          0.0726
   10   -1   -1   -1    0.2235   -0.1111    0.2251   -0.1274    0.0164    1          0.0558          0.0467
   11   -2   -2    0    0.5362   -0.6085    0.5303   -0.6130    0.0074    1          0.1532          0.1248
   12    0    2    4   -0.1858   -0.0338   -0.1829   -0.0381    0.0052    1          0.1252          0.0984
   13   -1   -2   -2    0.2107   -0.0256    0.1990   -0.0092    0.0202    1          0.0874          0.0927
   14   -2   -4   -2    0.5273   -0.1312    0.5293   -0.1451    0.0141    1          0.1817          0.1473
   15   -1    1    3   -0.3313   -0.2293   -0.3362   -0.2357    0.0081    1          0.1101          0.0881
   16    0   -2   -2    0.1163    0.0436    0.1275    0.0362    0.0135    1          0.0768          0.0679
   17   -1   -3   -1    0.7262   -0.0626    0.7293   -0.0807    0.0184    1          0.1408          0.1198
   18   -2   -4    0    1.0679   -0.5084    1.0696   -0.4972    0.0114    1          0.3161          0.2483
   19    1   -3   -3    0.0372    0.0333    0.0442    0.0295    0.0079    1          0.1204          0.0994
   20    0   -4   -2    0.4329    0.1750    0.4423    0.1634    0.0150    1          0.1448          0.1178
   21   -1    1    1   -0.0351   -0.0528   -0.0341   -0.0579    0.0052    1          0.0537          0.0568
   22    1   -3   -1    0.2929    0.3378    0.3053    0.3413    0.0129    1          0.1100          0.0899
   23    2   -2    0    0.0360    0.2811    0.0347    0.2716    0.0095    1          0.0981          0.0816

###            No.63                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7928    1.1216    1.1246   89.8497   90.1495   90.1152      0.3820
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8051    1.1362    1.0938   90.0000   91.7727   90.0000      0.3197         0.7360    1.0387    2.5180    3.5535    3.4211
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0004    0.0178    0.0199    0.0000    0.8600    0.0000      0.0213         0.0134    0.0225    0.1679    0.2433    0.2364
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2987    1.1923    0.2830)
 a2 = (   -0.4871   -0.2841    0.6907)
 a3 = (    0.7154    0.0570    0.5250)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2927    1.1732    0.2870) (    0.0106    0.0024    0.0061)
 a2 = (   -0.4729   -0.2856    0.6852) (    0.0116    0.0058    0.0099)
 a3 = (    0.7337    0.0809    0.5401) (    0.0167    0.0090    0.0076)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   16.5230   54.2933   94.1884    0.3641    0.4291    0.6582
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0029   -0.0094    0.0075      0.0023    0.0022    0.0121

# Number of computed bands
            179            181
# Figure of merit at the beginning and the end of the refinement
         3.2721         3.3649
# Chi-squares at the beginning and the end of the refinement
    1.8599    0.9673
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7293   -0.0581   -0.7310   -0.0567    0.0023    1    0.0897    0.0702
    2    3   -1    1   -0.0136   -0.1734   -0.0130   -0.1762    0.0029    1    0.1351    0.0995
    3   -3    1    1   -0.0262    0.0886   -0.0262    0.0895    0.0008    1    0.1321    0.0967
    4    2    0    2   -0.1941   -0.5820   -0.1957   -0.5833    0.0020    1    0.1399    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0872    0.0654
    6   -2    0    2   -0.1059    0.1185   -0.1085    0.1216    0.0040    1    0.1038    0.0778
    7    3    1    1    0.1182   -0.5928    0.1201   -0.5973    0.0049    1    0.1795    0.1302
    8    3    1   -1    0.1432   -0.2208    0.1454   -0.2240    0.0039    1    0.1402    0.1017
    9   -1   -1    3   -0.1929    0.0485   -0.1952    0.0486    0.0023    1    0.1053    0.0726
   10    1    1   -1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0625    0.0467
   11    1    1    0    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0841    0.1248
   12    0   -1    2   -0.1796   -0.0373   -0.1829   -0.0381    0.0033    1    0.0676    0.0984
   13    1    2   -2    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.0972    0.0927
   14    1    2   -1    0.5299   -0.1512    0.5293   -0.1451    0.0061    1    0.1011    0.1473
   15    1   -1    3   -0.3338   -0.2356   -0.3362   -0.2357    0.0024    1    0.1184    0.0881
   16    0    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0843    0.0679
   17    1    3   -1    0.7297   -0.0835    0.7293   -0.0807    0.0028    1    0.1566    0.1198
   18    1    2    0    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1710    0.2483
   19   -1    3   -3    0.0446    0.0299    0.0442    0.0295    0.0006    1    0.1315    0.0994
   20    0    2   -1    0.4458    0.1649    0.4423    0.1634    0.0037    1    0.0803    0.1178
   21    1   -1    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0588    0.0568
   22   -1    3   -1    0.2988    0.3344    0.3053    0.3413    0.0095    1    0.1219    0.0899
   23   -1    1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0544    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7189   -0.0702   -0.7310   -0.0567    0.0182    1          0.0778          0.0702
    2    3   -1    1   -0.0124   -0.1721   -0.0130   -0.1762    0.0041    1          0.1136          0.0995
    3   -3    1    1   -0.0242    0.0982   -0.0262    0.0895    0.0090    1          0.1093          0.0967
    4    2    0    2   -0.2019   -0.5731   -0.1957   -0.5833    0.0119    1          0.1204          0.1078
    5    2    0    0    0.0600   -0.2192    0.0560   -0.2234    0.0058    1          0.0727          0.0654
    6   -2    0    2   -0.1119    0.1316   -0.1085    0.1216    0.0105    1          0.0866          0.0778
    7    3    1    1    0.1154   -0.5943    0.1201   -0.5973    0.0056    1          0.1521          0.1302
    8    3    1   -1    0.1486   -0.2109    0.1454   -0.2240    0.0134    1          0.1161          0.1017
    9   -1   -1    3   -0.2041    0.0544   -0.1952    0.0486    0.0106    1          0.0899          0.0726
   10    1    1   -1    0.2248   -0.1099    0.2251   -0.1274    0.0175    1          0.0517          0.0467
   11    2    2    0    0.5406   -0.6139    0.5303   -0.6130    0.0103    1          0.1425          0.1248
   12    0   -2    4   -0.1889   -0.0348   -0.1829   -0.0381    0.0069    1          0.1169          0.0984
   13    1    2   -2    0.2092   -0.0241    0.1990   -0.0092    0.0181    1          0.0810          0.0927
   14    2    4   -2    0.5285   -0.1294    0.5293   -0.1451    0.0157    1          0.1678          0.1473
   15    1   -1    3   -0.3343   -0.2315   -0.3362   -0.2357    0.0046    1          0.1032          0.0881
   16    0    2   -2    0.1122    0.0426    0.1275    0.0362    0.0166    1          0.0712          0.0679
   17    1    3   -1    0.7279   -0.0604    0.7293   -0.0807    0.0204    1          0.1299          0.1198
   18    2    4    0    1.0773   -0.5128    1.0696   -0.4972    0.0174    1          0.2939          0.2483
   19   -1    3   -3    0.0331    0.0300    0.0442    0.0295    0.0111    1          0.1119          0.0994
   20    0    4   -2    0.4293    0.1750    0.4423    0.1634    0.0174    1          0.1334          0.1178
   21    1   -1    1   -0.0372   -0.0582   -0.0341   -0.0579    0.0031    1          0.0500          0.0568
   22   -1    3   -1    0.2894    0.3346    0.3053    0.3413    0.0172    1          0.1012          0.0899
   23   -2    2    0    0.0359    0.2763    0.0347    0.2716    0.0048    1          0.0905          0.0816

###            No.65                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7898    1.1344    1.1163   90.7307   90.0331   90.4012      0.3914
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8049    1.0953    1.1344   90.0000   90.1554   90.0000      0.3464         0.7095    0.9655    2.3234    3.1617    3.2747
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0000    0.0208    0.0182    0.0000    1.0477    0.0000      0.0233         0.0114    0.0202    0.1563    0.2211    0.2265
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3081    1.1963    0.2779)
 a2 = (   -0.7088   -0.0549   -0.5213)
 a3 = (   -0.4975   -0.2872    0.6875)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3085    1.1711    0.2777) (    0.0099    0.0036    0.0070)
 a2 = (   -0.7370   -0.0674   -0.5346) (    0.0165    0.0069    0.0081)
 a3 = (   -0.4726   -0.2850    0.6874) (    0.0118    0.0103    0.0113)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  159.1089   38.8118  -58.6775    0.5345    0.4344    0.7946
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0012   -0.0082    0.0036      0.0023    0.0023    0.0122

# Number of computed bands
            179            175
# Figure of merit at the beginning and the end of the refinement
         3.1429         3.3511
# Chi-squares at the beginning and the end of the refinement
    2.1774    1.4775
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0912    0.0702
    2    3   -1   -1   -0.0121   -0.1689   -0.0130   -0.1762    0.0073    1    0.1385    0.0995
    3   -3   -1    1   -0.0268    0.0902   -0.0262    0.0895    0.0010    1    0.1361    0.0967
    4    2   -2    0   -0.1855   -0.5793   -0.1957   -0.5833    0.0110    1    0.1420    0.1078
    5    1    0    0    0.0561   -0.2179    0.0560   -0.2234    0.0055    1    0.0447    0.0654
    6   -1   -1    0   -0.1059    0.1189   -0.1085    0.1216    0.0037    1    0.0534    0.0778
    7    3   -1    1    0.1237   -0.5822    0.1201   -0.5973    0.0155    1    0.1825    0.1302
    8    2    1    1    0.1749   -0.1967    0.1454   -0.2240    0.0401    1    0.1021    0.1017
    9   -1   -3   -1   -0.1918    0.0487   -0.1952    0.0486    0.0034    1    0.1079    0.0726
   10    1    1    1    0.2225   -0.1255    0.2251   -0.1274    0.0033    1    0.0643    0.0467
   11    1    0    1    0.5271   -0.5948    0.5303   -0.6130    0.0185    1    0.0852    0.1248
   12    0   -2   -1   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0691    0.0984
   13    1    2    2    0.2166   -0.0408    0.1990   -0.0092    0.0362    1    0.1000    0.0927
   14    1    1    2    0.5210   -0.1468    0.5293   -0.1451    0.0084    1    0.1034    0.1473
   15    1   -3   -1   -0.3308   -0.2355   -0.3362   -0.2357    0.0054    1    0.1203    0.0881
   16    0    2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0866    0.0679
   17    1    1    3    0.7159   -0.0798    0.7293   -0.0807    0.0134    1    0.1593    0.1198
   18    1    0    2    1.0331   -0.4929    1.0696   -0.4972    0.0367    1    0.1709    0.2483
   19   -1    2    2    0.0144    0.0129    0.0442    0.0295    0.0341    1    0.0950    0.0994
   20    0    1    2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0824    0.1178
   21    1   -1   -1   -0.0316   -0.0542   -0.0341   -0.0579    0.0045    1    0.0603    0.0568
   22   -1    1    3    0.2971    0.3316    0.3053    0.3413    0.0127    1    0.1253    0.0899
   23   -1    0    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0561    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7155   -0.0574   -0.7310   -0.0567    0.0155    1          0.0830          0.0702
    2    3   -1   -1   -0.0116   -0.1662   -0.0130   -0.1762    0.0100    1          0.1213          0.0995
    3   -3   -1    1   -0.0289    0.1025   -0.0262    0.0895    0.0133    1          0.1189          0.0967
    4    2   -2    0   -0.2007   -0.5755   -0.1957   -0.5833    0.0093    1          0.1277          0.1078
    5    2    0    0    0.0594   -0.2128    0.0560   -0.2234    0.0112    1          0.0782          0.0654
    6   -2   -2    0   -0.1146    0.1304   -0.1085    0.1216    0.0108    1          0.0948          0.0778
    7    3   -1    1    0.1210   -0.5891    0.1201   -0.5973    0.0082    1          0.1621          0.1302
    8    3    1    1    0.1454   -0.2052    0.1454   -0.2240    0.0187    1          0.1257          0.1017
    9   -1   -3   -1   -0.2009    0.0544   -0.1952    0.0486    0.0081    1          0.0978          0.0726
   10    1    1    1    0.2201   -0.1099    0.2251   -0.1274    0.0183    1          0.0564          0.0467
   11    2    0    2    0.5396   -0.6025    0.5303   -0.6130    0.0139    1          0.1523          0.1248
   12    0   -4   -2   -0.1855   -0.0321   -0.1829   -0.0381    0.0065    1          0.1258          0.0984
   13    1    2    2    0.2082   -0.0272    0.1990   -0.0092    0.0203    1          0.0883          0.0927
   14    2    2    4    0.5232   -0.1318    0.5293   -0.1451    0.0146    1          0.1819          0.1473
   15    1   -3   -1   -0.3356   -0.2270   -0.3362   -0.2357    0.0088    1          0.1096          0.0881
   16    0    2    2    0.1172    0.0420    0.1275    0.0362    0.0118    1          0.0770          0.0679
   17    1    1    3    0.7241   -0.0648    0.7293   -0.0807    0.0167    1          0.1404          0.1198
   18    2    0    4    1.0691   -0.5039    1.0696   -0.4972    0.0067    1          0.3136          0.2483
   19   -1    3    3    0.0386    0.0333    0.0442    0.0295    0.0067    1          0.1200          0.0994
   20    0    2    4    0.4364    0.1731    0.4423    0.1634    0.0113    1          0.1448          0.1178
   21    1   -1   -1   -0.0346   -0.0524   -0.0341   -0.0579    0.0056    1          0.0533          0.0568
   22   -1    1    3    0.2964    0.3428    0.3053    0.3413    0.0091    1          0.1098          0.0899
   23   -2    0    2    0.0324    0.2850    0.0347    0.2716    0.0136    1          0.0981          0.0816

###            No.67                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9806    0.9798    1.1474   90.5837  114.8752   90.0006      0.2787
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9617    0.9651    1.1751   90.0000  113.5250   90.0000      0.2606         0.8184    0.8213    3.6909    3.7041    4.5101
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0127    0.0152    0.0311    0.0000    1.7372    0.0000      0.0205         0.0281    0.0266    0.2946    0.2973    0.3745
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5984    0.7881    0.5334)
 a2 = (   -0.8599    0.4868    0.2556)
 a3 = (    0.1634   -0.1771    0.9301)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6116    0.8033    0.5166) (    0.0050    0.0126    0.0176)
 a2 = (   -0.8714    0.4981    0.2570) (    0.0148    0.0102    0.0073)
 a3 = (    0.1629   -0.1774    0.8963) (    0.0164    0.0148    0.0294)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   61.4299   31.2432   -4.7883    0.4840    1.1321    0.6459
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0021   -0.0024   -0.0473      0.0026    0.0023    0.0461

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         3.0437         3.1397
# Chi-squares at the beginning and the end of the refinement
    0.7655    0.4720
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7405   -0.0567   -0.7310   -0.0567    0.0095    1    0.0753    0.0702
    2    4    2   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1127    0.0995
    3   -1   -4    2   -0.0492    0.0480   -0.0262    0.0895    0.0474    1    0.1068    0.0967
    4    3    1    0   -0.1928   -0.5877   -0.1957   -0.5833    0.0053    1    0.1169    0.1078
    5    2    2   -1    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0728    0.0654
    6   -1   -3    2   -0.1068    0.1204   -0.1085    0.1216    0.0020    1    0.0866    0.0778
    7    3    3    0    0.1218   -0.5939    0.1201   -0.5973    0.0038    1    0.1499    0.1302
    8    2    4   -1    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1170    0.1017
    9    1   -3    1   -0.1958    0.0498   -0.1952    0.0486    0.0013    1    0.0877    0.0726
   10    0    2    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0522    0.0467
   11    1    3    1    0.5338   -0.6082    0.5303   -0.6130    0.0059    1    0.1407    0.1248
   12    3   -3    0   -0.1827   -0.0377   -0.1829   -0.0381    0.0003    1    0.1127    0.0984
   13   -2    4    1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1137    0.0927
   14   -1    4    2    0.6045   -0.1311    0.5293   -0.1451    0.0765    0    0.1482    0.1473
   15    3   -1    0   -0.3377   -0.2388   -0.3362   -0.2357    0.0034    1    0.0988    0.0881
   16   -2    2    1    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0703    0.0679
   17   -1    3    2    0.7252   -0.0809    0.7293   -0.0807    0.0042    1    0.1305    0.1198
   18    0    4    3    1.0505   -0.5043    1.0696   -0.4972    0.0204    1    0.2855    0.2483
   19   -3    3    1    0.0215    0.0055    0.0442    0.0295    0.0330    1    0.1043    0.0994
   20   -3    3    3    0.4432    0.1637    0.4423    0.1634    0.0009    1    0.1344    0.1178
   21    2    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0491    0.0568
   22   -3    1    3    0.2983    0.3319    0.3053    0.3413    0.0117    1    0.1019    0.0899
   23   -3   -1    3    0.0357    0.2715    0.0347    0.2716    0.0011    1    0.0911    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    1   -0.7290   -0.0543   -0.7310   -0.0567    0.0031    1          0.0641          0.0702
    2    4    2   -2   -0.0128   -0.1771   -0.0130   -0.1762    0.0010    1          0.1022          0.0995
    3   -1   -4    2   -0.0391    0.0430   -0.0262    0.0895    0.0482    1          0.0963          0.0967
    4    3    1    0   -0.1921   -0.5839   -0.1957   -0.5833    0.0037    1          0.1023          0.1078
    5    2    2   -1    0.0589   -0.2288    0.0560   -0.2234    0.0062    1          0.0659          0.0654
    6   -1   -3    2   -0.0968    0.1150   -0.1085    0.1216    0.0134    1          0.0776          0.0778
    7    3    3    0    0.1216   -0.5962    0.1201   -0.5973    0.0018    1          0.1319          0.1302
    8    2    4   -1    0.1490   -0.2263    0.1454   -0.2240    0.0043    1          0.1057          0.1017
    9    1   -3    1   -0.1840    0.0501   -0.1952    0.0486    0.0113    1          0.0784          0.0726
   10    0    2    0    0.2349   -0.1307    0.2251   -0.1274    0.0103    1          0.0471          0.0467
   11    1    3    1    0.5361   -0.6130    0.5303   -0.6130    0.0058    1          0.1219          0.1248
   12    3   -3    0   -0.1738   -0.0338   -0.1829   -0.0381    0.0100    1          0.1013          0.0984
   13   -2    4    1    0.2070   -0.0070    0.1990   -0.0092    0.0083    1          0.1028          0.0927
   14   -1    4    2    0.6121   -0.1325    0.5293   -0.1451    0.0837    0          0.1303          0.1473
   15    3   -1    0   -0.3317   -0.2334   -0.3362   -0.2357    0.0051    1          0.0875          0.0881
   16   -2    2    1    0.1327    0.0391    0.1275    0.0362    0.0060    1          0.0637          0.0679
   17   -1    3    2    0.7316   -0.0822    0.7293   -0.0807    0.0026    1          0.1136          0.1198
   18    0    4    3    1.0518   -0.5090    1.0696   -0.4972    0.0214    1          0.2401          0.2483
   19   -3    3    1    0.0291    0.0093    0.0442    0.0295    0.0253    1          0.0945          0.0994
   20   -3    3    3    0.4477    0.1653    0.4423    0.1634    0.0057    1          0.1192          0.1178
   21    2    0   -1   -0.0332   -0.0570   -0.0341   -0.0579    0.0013    1          0.0445          0.0568
   22   -3    1    3    0.2998    0.3306    0.3053    0.3413    0.0121    1          0.0902          0.0899
   23   -3   -1    3    0.0384    0.2659    0.0347    0.2716    0.0068    1          0.0814          0.0816

###            No.68                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7925    1.1255    1.1212   90.5251   90.1315   90.1662      0.5719
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7802    1.1505    1.1145   90.0000   88.4695   90.0000      0.3260         0.7000    1.0323    2.3933    3.5293    3.4189
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0003    0.0197    0.0187    0.0000    0.8672    0.0000      0.0220         0.0117    0.0204    0.1616    0.2459    0.2378
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.2034   -0.3413    0.1658)
 a2 = (    0.2625   -0.7063    0.4708)
 a3 = (   -0.0342    0.4783    0.7521)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.2187   -0.3676    0.1536) (    0.0028    0.0093    0.0067)
 a2 = (    0.2653   -0.6861    0.4630) (    0.0078    0.0138    0.0063)
 a3 = (   -0.0294    0.4939    0.7489) (    0.0098    0.0106    0.0122)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   12.6756   33.0882 -173.8849    0.5400    0.4177    0.6633
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0017   -0.0105   -0.0117      0.0023    0.0024    0.0144

# Number of computed bands
            181            297
# Figure of merit at the beginning and the end of the refinement
         2.3105         3.1038
# Chi-squares at the beginning and the end of the refinement
    4.6462    1.0840
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7338   -0.0581   -0.7310   -0.0567    0.0031    1    0.1353    0.0702
    2   -1   -2    2   -0.0313   -0.1393   -0.0130   -0.1762    0.0412    1    0.1410    0.0995
    3    0    2   -1   -0.0273    0.0922   -0.0262    0.0895    0.0030    1    0.0983    0.0967
    4   -1   -1    3   -0.1977   -0.5856   -0.1957   -0.5833    0.0030    1    0.2102    0.1078
    5    0   -1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0648    0.0654
    6   -1    3   -1   -0.1090    0.1214   -0.1085    0.1216    0.0006    1    0.1554    0.0778
    7    0   -1    2    0.1190   -0.5977    0.1201   -0.5973    0.0012    1    0.1340    0.1302
    8    1   -2    2    0.1782   -0.2012    0.1454   -0.2240    0.0400    1    0.1482    0.1017
    9   -1    1    0   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0788    0.0726
   10    1   -1    1    0.2264   -0.1273    0.2251   -0.1274    0.0013    1    0.0933    0.0467
   11    1   -1    3    0.5369   -0.6161    0.5303   -0.6130    0.0073    1    0.2543    0.1248
   12   -2    0    1   -0.1430   -0.0700   -0.1829   -0.0381    0.0511    1    0.1350    0.0984
   13    2   -1    1    0.2191   -0.0407    0.1990   -0.0092    0.0374    1    0.1456    0.0927
   14    2   -1    2    0.4419   -0.1582    0.5293   -0.1451    0.0884    1    0.1934    0.1473
   15   -1    0    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0887    0.0881
   16    1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0631    0.0679
   17    1    0    1    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1174    0.1198
   18    1    0    2    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.2589    0.2483
   19    2    1   -1    0.0134    0.0118    0.0442    0.0295    0.0355    1    0.1388    0.0994
   20    3    1    1    0.4473    0.1656    0.4423    0.1634    0.0055    1    0.2426    0.1178
   21   -1   -1    1   -0.0332   -0.0559   -0.0341   -0.0579    0.0022    1    0.0878    0.0568
   22    1    1    0    0.3021    0.3363    0.3053    0.3413    0.0059    1    0.0915    0.0899
   23    1    3   -1    0.0359    0.2765    0.0347    0.2716    0.0050    1    0.1634    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    1   -0.7238   -0.0770   -0.7310   -0.0567    0.0215    1          0.0761          0.0702
    2   -1   -3    3   -0.0138   -0.1704   -0.0130   -0.1762    0.0058    1          0.1140          0.0995
    3    0    4   -2   -0.0248    0.0986   -0.0262    0.0895    0.0092    1          0.1093          0.0967
    4   -1   -1    3   -0.1971   -0.5720   -0.1957   -0.5833    0.0114    1          0.1191          0.1078
    5    0   -2    2    0.0593   -0.2202    0.0560   -0.2234    0.0046    1          0.0730          0.0654
    6   -1    3   -1   -0.1107    0.1306   -0.1085    0.1216    0.0093    1          0.0862          0.0778
    7    0   -2    4    0.1184   -0.5923    0.1201   -0.5973    0.0053    1          0.1514          0.1302
    8    1   -3    3    0.1502   -0.2135    0.1454   -0.2240    0.0115    1          0.1169          0.1017
    9   -2    2    0   -0.2000    0.0538   -0.1952    0.0486    0.0070    1          0.0894          0.0726
   10    1   -1    1    0.2297   -0.1119    0.2251   -0.1274    0.0162    1          0.0523          0.0467
   11    1   -1    3    0.5411   -0.6071    0.5303   -0.6130    0.0122    1          0.1414          0.1248
   12   -3    1    1   -0.1834   -0.0328   -0.1829   -0.0381    0.0053    1          0.1167          0.0984
   13    2   -1    1    0.2156   -0.0243    0.1990   -0.0092    0.0225    1          0.0820          0.0927
   14    3   -1    3    0.5307   -0.1300    0.5293   -0.1451    0.0152    1          0.1693          0.1473
   15   -2    0    2   -0.3304   -0.2300   -0.3362   -0.2357    0.0081    1          0.1022          0.0881
   16    2    0    0    0.1185    0.0458    0.1275    0.0362    0.0132    1          0.0720          0.0679
   17    2    0    2    0.7258   -0.0627    0.7293   -0.0807    0.0183    1          0.1300          0.1198
   18    2    0    4    1.0600   -0.5033    1.0696   -0.4972    0.0113    1          0.2855          0.2483
   19    3    1   -1    0.0377    0.0350    0.0442    0.0295    0.0085    1          0.1129          0.0994
   20    3    1    1    0.4344    0.1744    0.4423    0.1634    0.0136    1          0.1349          0.1178
   21   -1   -1    1   -0.0364   -0.0532   -0.0341   -0.0579    0.0052    1          0.0503          0.0568
   22    2    2    0    0.2962    0.3360    0.3053    0.3413    0.0106    1          0.1020          0.0899
   23    1    3   -1    0.0380    0.2806    0.0347    0.2716    0.0096    1          0.0906          0.0816

###            No.69                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7964    1.1228    1.1185   90.5251   90.4455   90.4131      0.5948
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7802    1.1505    1.1145   90.0000   91.5305   90.0000      0.3260         0.7000    1.0323    2.3933    3.5293    3.4189
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0003    0.0197    0.0187    0.0000    0.8672    0.0000      0.0220         0.0117    0.0204    0.1616    0.2459    0.2378
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.1976   -0.3397    0.1650)
 a2 = (   -0.2718    0.7056   -0.4708)
 a3 = (    0.0257   -0.4819   -0.7527)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.2187   -0.3676    0.1536) (    0.0028    0.0093    0.0067)
 a2 = (   -0.2653    0.6861   -0.4630) (    0.0078    0.0138    0.0063)
 a3 = (    0.0294   -0.4939   -0.7489) (    0.0098    0.0106    0.0122)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  167.3244  146.9118    6.1151    0.5400    0.4177    0.6633
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0017   -0.0105   -0.0117      0.0023    0.0024    0.0144

# Number of computed bands
            171            299
# Figure of merit at the beginning and the end of the refinement
         2.1182         3.0969
# Chi-squares at the beginning and the end of the refinement
    5.0712    1.0840
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7285   -0.0585   -0.7310   -0.0567    0.0032    1    0.1409    0.0702
    2   -1    2   -2   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1468    0.0995
    3    0   -2    1   -0.0275    0.0915   -0.0262    0.0895    0.0024    1    0.1025    0.0967
    4   -1    1   -3   -0.1988   -0.5835   -0.1957   -0.5833    0.0031    1    0.2191    0.1078
    5    0    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0676    0.0654
    6   -1   -3    1   -0.1089    0.1207   -0.1085    0.1216    0.0010    1    0.1622    0.0778
    7    0    1   -2    0.1156   -0.5974    0.1201   -0.5973    0.0045    1    0.1396    0.1302
    8    1    2   -2    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1543    0.1017
    9   -1   -1    0   -0.1960    0.0488   -0.1952    0.0486    0.0008    1    0.0822    0.0726
   10    1    1   -1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.0970    0.0467
   11    1    1   -3    0.5321   -0.6234    0.5303   -0.6130    0.0106    1    0.2649    0.1248
   12   -2    0   -1   -0.1439   -0.0705   -0.1829   -0.0381    0.0507    1    0.1404    0.0984
   13    2    1   -1    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1510    0.0927
   14    2    1   -2    0.4432   -0.1614    0.5293   -0.1451    0.0877    1    0.2007    0.1473
   15   -1    0   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.0925    0.0881
   16    1    0    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0653    0.0679
   17    1    0   -1    0.7402   -0.0861    0.7293   -0.0807    0.0120    1    0.1222    0.1198
   18    1    0   -2    1.0701   -0.5348    1.0696   -0.4972    0.0376    1    0.2720    0.2483
   19    2   -1    1    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1439    0.0994
   20    3   -1   -1    0.4512    0.1676    0.4423    0.1634    0.0098    1    0.2512    0.1178
   21   -1    1   -1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0912    0.0568
   22    1   -1    0    0.3019    0.3408    0.3053    0.3413    0.0035    1    0.0947    0.0899
   23    1   -3    1    0.0336    0.2766    0.0347    0.2716    0.0050    1    0.1697    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1   -1   -0.7238   -0.0770   -0.7310   -0.0567    0.0215    1          0.0761          0.0702
    2   -1    3   -3   -0.0138   -0.1704   -0.0130   -0.1762    0.0058    1          0.1140          0.0995
    3    0   -4    2   -0.0248    0.0986   -0.0262    0.0895    0.0092    1          0.1093          0.0967
    4   -1    1   -3   -0.1971   -0.5720   -0.1957   -0.5833    0.0114    1          0.1191          0.1078
    5    0    2   -2    0.0593   -0.2202    0.0560   -0.2234    0.0046    1          0.0730          0.0654
    6   -1   -3    1   -0.1107    0.1306   -0.1085    0.1216    0.0093    1          0.0862          0.0778
    7    0    2   -4    0.1184   -0.5923    0.1201   -0.5973    0.0053    1          0.1514          0.1302
    8    1    3   -3    0.1502   -0.2135    0.1454   -0.2240    0.0115    1          0.1169          0.1017
    9   -2   -2    0   -0.2000    0.0538   -0.1952    0.0486    0.0070    1          0.0894          0.0726
   10    1    1   -1    0.2297   -0.1119    0.2251   -0.1274    0.0162    1          0.0523          0.0467
   11    1    1   -3    0.5411   -0.6071    0.5303   -0.6130    0.0122    1          0.1414          0.1248
   12   -3   -1   -1   -0.1834   -0.0328   -0.1829   -0.0381    0.0053    1          0.1167          0.0984
   13    2    1   -1    0.2156   -0.0243    0.1990   -0.0092    0.0225    1          0.0820          0.0927
   14    3    1   -3    0.5307   -0.1300    0.5293   -0.1451    0.0152    1          0.1693          0.1473
   15   -2    0   -2   -0.3304   -0.2300   -0.3362   -0.2357    0.0081    1          0.1022          0.0881
   16    2    0    0    0.1185    0.0458    0.1275    0.0362    0.0132    1          0.0720          0.0679
   17    2    0   -2    0.7258   -0.0627    0.7293   -0.0807    0.0183    1          0.1300          0.1198
   18    2    0   -4    1.0600   -0.5033    1.0696   -0.4972    0.0113    1          0.2855          0.2483
   19    3   -1    1    0.0377    0.0350    0.0442    0.0295    0.0085    1          0.1129          0.0994
   20    3   -1   -1    0.4344    0.1744    0.4423    0.1634    0.0136    1          0.1349          0.1178
   21   -1    1   -1   -0.0364   -0.0532   -0.0341   -0.0579    0.0052    1          0.0503          0.0568
   22    2   -2    0    0.2962    0.3360    0.3053    0.3413    0.0106    1          0.1020          0.0899
   23    1   -3    1    0.0380    0.2806    0.0347    0.2716    0.0096    1          0.0906          0.0816

###            No.70                ###
# Bravais type
   Monoclinic(P)
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.1163    0.7898    1.1344   90.4012   90.7307   90.0331      0.3914
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.1545    0.7908    1.0979   90.0000   93.9527   90.0000      0.3718         1.0516    0.7203    3.1051    2.1268    2.9528
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0038    0.0213    0.0254    0.0000    2.7309    0.0000      0.0274         0.0257    0.0168    0.2291    0.1670    0.2282
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4975   -0.2872    0.6875)
 a2 = (   -0.3081    1.1963    0.2779)
 a3 = (   -0.7088   -0.0549   -0.5213)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4914   -0.2789    0.6592) (    0.0190    0.0044    0.0132)
 a2 = (   -0.3139    1.1945    0.2714) (    0.0120    0.0334    0.0066)
 a3 = (   -0.7517   -0.0813   -0.5118) (    0.0264    0.0126    0.0126)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   74.2154  127.9066  -85.1278    0.3563    1.5034    0.4940
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0007   -0.0096   -0.0649      0.0023    0.0024    0.0503

# Number of computed bands
            179            181
# Figure of merit at the beginning and the end of the refinement
         3.1429         3.0290
# Chi-squares at the beginning and the end of the refinement
    2.0745    1.4490
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0912    0.0702
    2   -1    3   -1   -0.0121   -0.1689   -0.0130   -0.1762    0.0073    1    0.1385    0.0995
    3    1   -3   -1   -0.0268    0.0902   -0.0262    0.0895    0.0010    1    0.1361    0.0967
    4    0    2   -2   -0.1855   -0.5793   -0.1957   -0.5833    0.0110    1    0.1420    0.1078
    5    0    1    0    0.0561   -0.2179    0.0560   -0.2234    0.0055    1    0.0447    0.0654
    6    0   -1   -1   -0.1059    0.1189   -0.1085    0.1216    0.0037    1    0.0534    0.0778
    7    1    3   -1    0.1237   -0.5822    0.1201   -0.5973    0.0155    1    0.1825    0.1302
    8    1    2    1    0.1749   -0.1967    0.1454   -0.2240    0.0401    1    0.1021    0.1017
    9   -1   -1   -3   -0.1918    0.0487   -0.1952    0.0486    0.0034    1    0.1079    0.0726
   10    1    1    1    0.2225   -0.1255    0.2251   -0.1274    0.0033    1    0.0643    0.0467
   11    1    1    0    0.5271   -0.5948    0.5303   -0.6130    0.0185    1    0.0852    0.1248
   12   -1    0   -2   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0691    0.0984
   13    2    1    2    0.2166   -0.0408    0.1990   -0.0092    0.0362    1    0.1000    0.0927
   14    2    1    1    0.5210   -0.1468    0.5293   -0.1451    0.0084    1    0.1034    0.1473
   15   -1    1   -3   -0.3308   -0.2355   -0.3362   -0.2357    0.0054    1    0.1203    0.0881
   16    2    0    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0866    0.0679
   17    3    1    1    0.7159   -0.0798    0.7293   -0.0807    0.0134    1    0.1593    0.1198
   18    2    1    0    1.0331   -0.4929    1.0696   -0.4972    0.0367    1    0.1709    0.2483
   19    2   -1    2    0.0144    0.0129    0.0442    0.0295    0.0341    1    0.0950    0.0994
   20    2    0    1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0824    0.1178
   21   -1    1   -1   -0.0316   -0.0542   -0.0341   -0.0579    0.0045    1    0.0603    0.0568
   22    3   -1    1    0.2971    0.3316    0.3053    0.3413    0.0127    1    0.1253    0.0899
   23    1   -1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0561    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7160   -0.0679   -0.7310   -0.0567    0.0188    1          0.0796          0.0702
    2   -1    3   -1   -0.0130   -0.1694   -0.0130   -0.1762    0.0068    1          0.1234          0.0995
    3    1   -3   -1   -0.0283    0.1008   -0.0262    0.0895    0.0116    1          0.1202          0.0967
    4    0    2   -2   -0.2000   -0.5753   -0.1957   -0.5833    0.0091    1          0.1248          0.1078
    5    0    1    0    0.0602   -0.2167    0.0560   -0.2234    0.0079    1          0.0396          0.0654
    6    0   -1   -1   -0.1142    0.1296   -0.1085    0.1216    0.0098    1          0.0477          0.0778
    7    1    3   -1    0.1215   -0.5905    0.1201   -0.5973    0.0070    1          0.1588          0.1302
    8    1    3    1    0.1482   -0.2081    0.1454   -0.2240    0.0161    1          0.1274          0.1017
    9   -1   -1   -3   -0.2001    0.0536   -0.1952    0.0486    0.0070    1          0.0990          0.0726
   10    1    1    1    0.2232   -0.1097    0.2251   -0.1274    0.0179    1          0.0573          0.0467
   11    2    2    0    0.5375   -0.6007    0.5303   -0.6130    0.0142    1          0.1453          0.1248
   12   -1    0   -2   -0.1847   -0.0315   -0.1829   -0.0381    0.0069    1          0.0640          0.0984
   13    2    1    2    0.2100   -0.0259    0.1990   -0.0092    0.0201    1          0.0900          0.0927
   14    2    1    1    0.5227   -0.1320    0.5293   -0.1451    0.0147    1          0.0895          0.1473
   15   -1    1   -3   -0.3346   -0.2271   -0.3362   -0.2357    0.0087    1          0.1096          0.0881
   16    2    0    2    0.1172    0.0433    0.1275    0.0362    0.0125    1          0.0789          0.0679
   17    3    1    1    0.7206   -0.0688    0.7293   -0.0807    0.0148    1          0.1352          0.1198
   18    4    2    0    1.0527   -0.5069    1.0696   -0.4972    0.0195    1          0.2860          0.2483
   19    2   -1    2    0.0072    0.0153    0.0442    0.0295    0.0397    1          0.0866          0.0994
   20    2    0    1    0.4367    0.1702    0.4423    0.1634    0.0088    1          0.0717          0.1178
   21   -1    1   -1   -0.0367   -0.0530   -0.0341   -0.0579    0.0055    1          0.0545          0.0568
   22    3   -1    1    0.3003    0.3406    0.3053    0.3413    0.0051    1          0.1086          0.0899
   23    1   -1    0    0.0340    0.2858    0.0347    0.2716    0.0142    1          0.0489          0.0816

###                                ###
### Candidates for       Triclinic ###
###                                ###

###            No.1                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0830    1.0844    1.0861  109.5780  107.9853  109.3009      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0869    1.0946    1.0922  109.5286  109.6433  109.2605      0.4496         0.9951    1.0021    2.4175    2.4346    2.4294
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1453    0.0922    0.1993    6.4888    5.5486   19.5594      0.1033         0.0517    0.1002    0.6426    0.5958    0.7128
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5820   -0.3837    0.8633)
 a2 = (   -0.0268    0.5989    0.9445)
 a3 = (   -0.9338    0.5286    0.2776)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6182   -0.3656    0.8681) (    0.1440    0.0852    0.1377)
 a2 = (   -0.0474    0.6003    0.9420) (    0.0187    0.1398    0.1497)
 a3 = (   -0.9482    0.5325    0.2803) (    0.2198    0.1235    0.0446)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   55.5254  110.8339 -122.0185    9.1081    7.5014    0.6172
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006   -0.0034      0.0024    0.0024    0.3913

# Number of computed bands
            400             89
# Figure of merit at the beginning and the end of the refinement
         8.6014        30.3828
# Chi-squares at the beginning and the end of the refinement
    0.1944    0.0224
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0678    0.0702
    2   -2    2    1   -0.0124   -0.1755   -0.0130   -0.1762    0.0009    1    0.1024    0.0995
    3    2   -1   -2   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1003    0.0967
    4   -1    2    0   -0.1949   -0.5834   -0.1957   -0.5833    0.0008    1    0.1056    0.1078
    5   -1    1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0658    0.0654
    6    1    0   -2   -0.1062    0.1191   -0.1085    0.1216    0.0033    1    0.0784    0.0778
    7   -1    2    1    0.1144   -0.5956    0.1201   -0.5973    0.0060    1    0.1346    0.1302
    8   -1    1    2    0.1419   -0.2206    0.1454   -0.2240    0.0048    1    0.1049    0.1017
    9    0    1   -2   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0789    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0462    0.0467
   11    0    1    1    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1264    0.1248
   12   -1    2   -2   -0.1875   -0.0410   -0.1829   -0.0381    0.0055    1    0.1013    0.0984
   13    1   -1    2    0.1954   -0.0060    0.1990   -0.0092    0.0047    1    0.1003    0.0927
   14    1    0    2    0.5384   -0.1480    0.5293   -0.1451    0.0095    1    0.1496    0.1473
   15   -1    2   -1   -0.3370   -0.2427   -0.3362   -0.2357    0.0070    1    0.0895    0.0881
   16    1   -1    1    0.1206    0.0368    0.1275    0.0362    0.0069    1    0.0623    0.0679
   17    1    0    1    0.7458   -0.0713    0.7293   -0.0807    0.0190    1    0.1163    0.1198
   18    1    1    1    1.0968   -0.5289    1.0696   -0.4972    0.0418    1    0.2633    0.2483
   19    2   -2    1    0.0377    0.0265    0.0442    0.0295    0.0072    1    0.0981    0.0994
   20    2   -1    1    0.4397    0.1779    0.4423    0.1634    0.0147    1    0.1186    0.1178
   21   -1    1    0   -0.0354   -0.0626   -0.0341   -0.0579    0.0049    1    0.0445    0.0568
   22    2   -1    0    0.2814    0.3381    0.3053    0.3413    0.0241    0    0.0907    0.0899
   23    2   -1   -1    0.0283    0.2632    0.0347    0.2716    0.0106    1    0.0825    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7328   -0.0558   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2    2    1   -0.0135   -0.1739   -0.0130   -0.1762    0.0023    1          0.0996          0.0995
    3    2   -1   -2   -0.0264    0.0893   -0.0262    0.0895    0.0003    1          0.0975          0.0967
    4   -1    2    0   -0.1955   -0.5861   -0.1957   -0.5833    0.0028    1          0.1030          0.1078
    5   -1    1    1    0.0563   -0.2237    0.0560   -0.2234    0.0005    1          0.0642          0.0654
    6    1    0   -2   -0.1070    0.1193   -0.1085    0.1216    0.0027    1          0.0767          0.0778
    7   -1    2    1    0.1206   -0.5960    0.1201   -0.5973    0.0014    1          0.1319          0.1302
    8   -1    1    2    0.1436   -0.2205    0.1454   -0.2240    0.0039    1          0.1032          0.1017
    9    0    1   -2   -0.1945    0.0483   -0.1952    0.0486    0.0008    1          0.0779          0.0726
   10    0    0    1    0.2257   -0.1273    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    0    1    1    0.5370   -0.6115    0.5303   -0.6130    0.0069    1          0.1240          0.1248
   12   -1    2   -2   -0.1809   -0.0381   -0.1829   -0.0381    0.0020    1          0.1001          0.0984
   13    1   -1    2    0.1978   -0.0086    0.1990   -0.0092    0.0013    1          0.1007          0.0927
   14    1    0    2    0.5293   -0.1478    0.5293   -0.1451    0.0027    1          0.1492          0.1473
   15   -1    2   -1   -0.3357   -0.2365   -0.3362   -0.2357    0.0010    1          0.0874          0.0881
   16    1   -1    1    0.1262    0.0353    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1    0    1    0.7275   -0.0781    0.7293   -0.0807    0.0032    1          0.1151          0.1198
   18    1    1    1    1.0603   -0.5046    1.0696   -0.4972    0.0119    1          0.2520          0.2483
   19    2   -2    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0973          0.0994
   20    2   -1    1    0.4428    0.1648    0.4423    0.1634    0.0015    1          0.1188          0.1178
   21   -1    1    0   -0.0335   -0.0575   -0.0341   -0.0579    0.0008    1          0.0435          0.0568
   22    2   -1    0    0.2975    0.3323    0.3053    0.3413    0.0119    1          0.0902          0.0899
   23    2   -1   -1    0.0353    0.2715    0.0347    0.2716    0.0006    1          0.0806          0.0816

###            No.2                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0616    1.0861    1.0985  111.5217  106.7376  107.8862      0.4715
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0863    1.0947    1.0904  109.9986  109.1221  109.1426      0.4499         0.9963    1.0040    2.4148    2.4334    2.4238
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0184    0.0529    0.1361   15.1868   12.0859   20.3778      0.1633         0.1336    0.0815    0.8777    0.8913    0.9306
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2679    0.8947   -0.5997)
 a2 = (   -0.8980   -0.0696   -0.6604)
 a3 = (   -0.9245    0.5234    0.2748)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3271    0.8977   -0.5876) (    0.0433    0.1004    0.1730)
 a2 = (   -0.9004   -0.0679   -0.6612) (    0.1029    0.0161    0.1947)
 a3 = (   -0.9487    0.5327    0.2798) (    0.1084    0.0604    0.0824)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -126.0531   40.3859 -116.2765    4.8150   11.4701    1.2158
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0005    0.0006   -0.0062      0.0031    0.0024    0.4086

# Number of computed bands
            400             91
# Figure of merit at the beginning and the end of the refinement
         5.7306        29.4387
# Chi-squares at the beginning and the end of the refinement
    0.5087    0.0251
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0696    0.0702
    2    2   -2    1   -0.0217   -0.1586   -0.0130   -0.1762    0.0196    1    0.1042    0.0995
    3   -2    1   -1   -0.0248    0.1051   -0.0262    0.0895    0.0157    1    0.1010    0.0967
    4    1   -2    1   -0.2154   -0.5560   -0.1957   -0.5833    0.0337    0    0.1069    0.1078
    5    1   -1    1    0.0430   -0.2170    0.0560   -0.2234    0.0145    1    0.0660    0.0654
    6   -1    0   -1   -0.1129    0.1342   -0.1085    0.1216    0.0134    1    0.0786    0.0778
    7    1   -2    2    0.0920   -0.5965    0.1201   -0.5973    0.0281    0    0.1361    0.1302
    8    1   -1    2    0.1345   -0.2219    0.1454   -0.2240    0.0111    1    0.1052    0.1017
    9    0   -1   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0810    0.0726
   10    0    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0474    0.0467
   11    0   -1    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1296    0.1248
   12    1   -2   -1   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1065    0.0984
   13   -1    1    2    0.1970   -0.0066    0.1990   -0.0092    0.0032    1    0.1065    0.0927
   14   -1    0    3    0.5299   -0.1428    0.5293   -0.1451    0.0023    1    0.1564    0.1473
   15    1   -2    0   -0.3237   -0.2190   -0.3362   -0.2357    0.0209    1    0.0926    0.0881
   16   -1    1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0672    0.0679
   17   -1    0    2    0.7203   -0.0693    0.7293   -0.0807    0.0146    1    0.1211    0.1198
   18   -1   -1    3    1.0674   -0.4947    1.0696   -0.4972    0.0033    1    0.2656    0.2483
   19   -2    2    1    0.0497    0.0320    0.0442    0.0295    0.0060    1    0.1059    0.0994
   20   -2    1    2    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1278    0.1178
   21    1   -1    0   -0.0288   -0.0441   -0.0341   -0.0579    0.0148    1    0.0468    0.0568
   22   -2    1    1    0.3044    0.3161    0.3053    0.3413    0.0253    0    0.0979    0.0899
   23   -2    1    0    0.0544    0.2794    0.0347    0.2716    0.0212    0    0.0863    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7342   -0.0561   -0.7310   -0.0567    0.0033    1          0.0660          0.0702
    2    2   -2    1   -0.0134   -0.1739   -0.0130   -0.1762    0.0024    1          0.0993          0.0995
    3   -2    1   -1   -0.0261    0.0899   -0.0262    0.0895    0.0005    1          0.0973          0.0967
    4    1   -2    1   -0.1959   -0.5866   -0.1957   -0.5833    0.0032    1          0.1026          0.1078
    5    1   -1    1    0.0564   -0.2239    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6   -1    0   -1   -0.1071    0.1200   -0.1085    0.1216    0.0021    1          0.0765          0.0778
    7    1   -2    2    0.1208   -0.5968    0.1201   -0.5973    0.0009    1          0.1314          0.1302
    8    1   -1    2    0.1440   -0.2207    0.1454   -0.2240    0.0036    1          0.1029          0.1017
    9    0   -1   -1   -0.1948    0.0484   -0.1952    0.0486    0.0005    1          0.0777          0.0726
   10    0    0    1    0.2260   -0.1273    0.2251   -0.1274    0.0010    1          0.0460          0.0467
   11    0   -1    2    0.5379   -0.6115    0.5303   -0.6130    0.0077    1          0.1235          0.1248
   12    1   -2   -1   -0.1808   -0.0381   -0.1829   -0.0381    0.0021    1          0.1000          0.0984
   13   -1    1    2    0.1980   -0.0086    0.1990   -0.0092    0.0011    1          0.1006          0.0927
   14   -1    0    3    0.5295   -0.1477    0.5293   -0.1451    0.0026    1          0.1488          0.1473
   15    1   -2    0   -0.3358   -0.2365   -0.3362   -0.2357    0.0009    1          0.0872          0.0881
   16   -1    1    1    0.1265    0.0352    0.1275    0.0362    0.0013    1          0.0623          0.0679
   17   -1    0    2    0.7272   -0.0782    0.7293   -0.0807    0.0033    1          0.1147          0.1198
   18   -1   -1    3    1.0597   -0.5035    1.0696   -0.4972    0.0117    1          0.2504          0.2483
   19   -2    2    1    0.0445    0.0288    0.0442    0.0295    0.0008    1          0.0972          0.0994
   20   -2    1    2    0.4430    0.1641    0.4423    0.1634    0.0010    1          0.1186          0.1178
   21    1   -1    0   -0.0332   -0.0573   -0.0341   -0.0579    0.0011    1          0.0434          0.0568
   22   -2    1    1    0.2988    0.3316    0.3053    0.3413    0.0117    1          0.0900          0.0899
   23   -2    1    0    0.0365    0.2721    0.0347    0.2716    0.0019    1          0.0805          0.0816

###            No.3                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0749    1.0860    1.0971  108.1618  110.5048  108.5388      0.4541
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0912    1.0947    1.0898  109.8651  109.3044  109.4110      0.4503         1.0014    1.0045    2.4233    2.4310    2.4200
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0647    0.0477    0.1302   14.5264   18.3985    6.4991      0.1580         0.1773    0.0800    0.8622    0.8594    0.8969
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3715    0.8863   -0.5985)
 a2 = (    0.5458    0.9574    0.0760)
 a3 = (    0.5729    0.3516   -0.8793)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3319    0.8953   -0.5890) (    0.0395    0.0965    0.1663)
 a2 = (    0.5703    0.9639    0.0729) (    0.0630    0.1044    0.0216)
 a3 = (    0.6178    0.3629   -0.8695) (    0.0700    0.0403    0.2452)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -54.1806  139.6512   63.7820    4.5619   11.0129    0.6957
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0049      0.0024    0.0024    0.3918

# Number of computed bands
            400             93
# Figure of merit at the beginning and the end of the refinement
         7.5123        29.2014
# Chi-squares at the beginning and the end of the refinement
    0.2074    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    1    2   -1   -0.0106   -0.1761   -0.0130   -0.1762    0.0025    1    0.1003    0.0995
    3   -2   -1    1   -0.0298    0.0920   -0.0262    0.0895    0.0044    1    0.0990    0.0967
    4    0    2   -1   -0.1972   -0.5943   -0.1957   -0.5833    0.0111    1    0.1057    0.1078
    5    1    1   -1    0.0596   -0.2232    0.0560   -0.2234    0.0037    1    0.0652    0.0654
    6   -2    0    1   -0.1115    0.1204   -0.1085    0.1216    0.0033    1    0.0787    0.0778
    7    1    2   -2    0.1219   -0.6007    0.1201   -0.5973    0.0038    1    0.1350    0.1302
    8    2    1   -2    0.1448   -0.2186    0.1454   -0.2240    0.0054    1    0.1049    0.1017
    9   -2    1    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12   -2    2    1   -0.1873   -0.0384   -0.1829   -0.0381    0.0045    1    0.1013    0.0984
   13    2   -1   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1009    0.0927
   14    2    0   -3    0.5394   -0.1573    0.5293   -0.1451    0.0158    1    0.1513    0.1473
   15   -1    2    0   -0.3434   -0.2414   -0.3362   -0.2357    0.0091    1    0.0891    0.0881
   16    1   -1   -1    0.1271    0.0361    0.1275    0.0362    0.0004    1    0.0620    0.0679
   17    1    0   -2    0.7535   -0.0909    0.7293   -0.0807    0.0262    1    0.1181    0.1198
   18    1    1   -3    1.0862   -0.5548    1.0696   -0.4972    0.0600    0    0.2669    0.2483
   19    1   -2   -1    0.0433    0.0293    0.0442    0.0295    0.0009    1    0.0964    0.0994
   20    1   -1   -2    0.4605    0.1728    0.4423    0.1634    0.0205    1    0.1192    0.1178
   21    0    1    0   -0.0342   -0.0599   -0.0341   -0.0579    0.0020    1    0.0433    0.0568
   22    0   -1   -1    0.3031    0.3546    0.3053    0.3413    0.0135    1    0.0903    0.0899
   23   -1   -1    0    0.0266    0.2809    0.0347    0.2716    0.0123    1    0.0811    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2    1    2   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -2   -1    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    0    2   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5    1    1   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -2    0    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    1    2   -2    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    2    1   -2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -2    1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1    0   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    1    1   -2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12   -2    2    1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    2   -1   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    2    0   -3    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1494          0.1473
   15   -1    2    0   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1   -1   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1    0   -2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18    1    1   -3    1.0606   -0.5064    1.0696   -0.4972    0.0129    1          0.2521          0.2483
   19    1   -2   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    1   -1   -2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0    1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    0   -1   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1   -1    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.5                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0892    1.0899    1.0920  109.4876  109.3612  109.3915      0.3078
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0947    1.0899    1.0888  109.1581  109.3712  109.8871      0.4505         1.0054    1.0010    2.4302    2.4196    2.4172
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0168    0.1005    0.0484   11.6251   19.5830   14.5477      0.1459         0.0535    0.1293    0.7881    0.8150    0.7904
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9014   -0.0731   -0.6640)
 a2 = (   -0.9454    0.5352    0.2810)
 a3 = (   -0.3321    0.8929   -0.5886)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9024   -0.0686   -0.6616) (    0.1226    0.0161    0.1682)
 a2 = (   -0.9499    0.5325    0.2803) (    0.1302    0.0738    0.0715)
 a3 = (   -0.3320    0.8955   -0.5888) (    0.0471    0.1239    0.1498)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -42.9994  120.0745  159.2978    8.3571    9.7114    0.5745
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            195             93
# Figure of merit at the beginning and the end of the refinement
         3.3663        29.1270
# Chi-squares at the beginning and the end of the refinement
    0.5037    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2    0    0   -0.7317   -0.0593   -0.7310   -0.0567    0.0028    1    0.0914    0.0702
    2   -2    1    2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0685    0.0995
    3    1   -1   -2   -0.0264    0.0892   -0.0262    0.0895    0.0003    1    0.0669    0.0967
    4   -4    2    2   -0.1946   -0.5832   -0.1957   -0.5833    0.0011    1    0.1423    0.1078
    5   -1    1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0442    0.0654
    6    0   -1   -1   -0.1070    0.1197   -0.1085    0.1216    0.0024    1    0.0526    0.0778
    7   -2    2    1    0.1181   -0.5934    0.1201   -0.5973    0.0044    1    0.0909    0.1302
    8   -1    2    1    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0710    0.1017
    9   -1   -1    0   -0.1952    0.0488   -0.1952    0.0486    0.0002    1    0.0534    0.0726
   10    0    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0316    0.0467
   11   -1    2    0    0.5304   -0.6131    0.5303   -0.6130    0.0002    1    0.0853    0.1248
   12   -2   -1    1   -0.1818   -0.0379   -0.1829   -0.0381    0.0011    1    0.0687    0.0984
   13    1    2   -1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0690    0.0927
   14    0    3   -1    0.5288   -0.1505    0.5293   -0.1451    0.0054    1    0.1024    0.1473
   15   -2    0    1   -0.3353   -0.2369   -0.3362   -0.2357    0.0015    1    0.0602    0.0881
   16    2    2   -2    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0855    0.0679
   17    0    4   -2    0.7287   -0.0830    0.7293   -0.0807    0.0024    1    0.1586    0.1198
   18   -1    3   -1    1.0541   -0.5169    1.0696   -0.4972    0.0251    1    0.1735    0.2483
   19    3    2   -3    0.0742    0.0377    0.0442    0.0295    0.0311    1    0.1080    0.0994
   20    1    2   -2    0.4442    0.1646    0.4423    0.1634    0.0022    1    0.0813    0.1178
   21   -2    0    2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0597    0.0568
   22    1    1   -2    0.2981    0.3336    0.3053    0.3413    0.0105    1    0.0617    0.0899
   23    1    0   -2    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0552    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2    1    2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1   -1   -2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -2    1    1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1    1    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0   -1   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2    2    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -1    2    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1   -1    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    2    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -2   -1    1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    1    2   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    0    3   -1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -2    0    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1    1   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0    2   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1    3   -1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    2    1   -2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    1    2   -2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    0    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    1    1   -2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1    0   -2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.6                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0863    1.0896    1.0928  110.5886  108.7827  108.6687      0.5055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0899    1.0947    1.0888  109.3710  109.1582  109.8873      0.4505         1.0010    1.0054    2.4196    2.4302    2.4172
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.2205    0.1364    0.0828   19.5832   11.6252   14.5478      0.1956         0.1293    0.0535    1.1593    1.0980    1.0658
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9391   -0.5316   -0.2791)
 a2 = (    0.8941    0.0716    0.6772)
 a3 = (    0.3293   -0.8866    0.6025)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9499   -0.5325   -0.2803) (    0.0236    0.0154    0.1026)
 a2 = (    0.9024    0.0686    0.6616) (    0.0270    0.0133    0.2425)
 a3 = (    0.3320   -0.8955    0.5888) (    0.0189    0.0285    0.2158)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -16.7441   59.9254  -20.7022    4.6235    9.7115    0.5745
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             75             93
# Figure of merit at the beginning and the end of the refinement
         9.3876        29.1259
# Chi-squares at the beginning and the end of the refinement
    0.1899    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7526   -0.0603   -0.7310   -0.0567    0.0219    1    0.0767    0.0702
    2   -1    2   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1117    0.0995
    3    1   -1    2   -0.0285    0.0962   -0.0262    0.0895    0.0071    1    0.1094    0.0967
    4   -1    2   -1   -0.1979   -0.5945   -0.1957   -0.5833    0.0114    1    0.1176    0.1078
    5   -1    1   -1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0721    0.0654
    6    1    0    1   -0.1133    0.1267   -0.1085    0.1216    0.0070    1    0.0863    0.0778
    7   -2    2   -1    0.1206   -0.6019    0.1201   -0.5973    0.0046    1    0.1501    0.1302
    8   -2    1   -1    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1159    0.1017
    9    1    1    0   -0.2043    0.0513   -0.1952    0.0486    0.0095    1    0.0877    0.0726
   10   -1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0516    0.0467
   11   -2    1    0    0.5388   -0.6214    0.5303   -0.6130    0.0120    1    0.1419    0.1248
   12    1    2   -1   -0.1891   -0.0393   -0.1829   -0.0381    0.0063    1    0.1125    0.0984
   13   -2   -1    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1126    0.0927
   14   -3    0    1    0.5353   -0.1524    0.5293   -0.1451    0.0095    1    0.1689    0.1473
   15    0    2   -1   -0.3440   -0.2429   -0.3362   -0.2357    0.0106    1    0.0992    0.0881
   16   -1   -1    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0697    0.0679
   17   -2    0    1    0.7398   -0.0844    0.7293   -0.0807    0.0111    1    0.1314    0.1198
   18   -3    1    1    1.0717   -0.5244    1.0696   -0.4972    0.0274    1    0.2927    0.2483
   19   -1   -2    2    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1087    0.0994
   20   -2   -1    2    0.4520    0.1671    0.4423    0.1634    0.0103    1    0.1341    0.1178
   21    0    1   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0486    0.0568
   22   -1   -1    2    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1019    0.0899
   23    0   -1    2    0.0359    0.2814    0.0347    0.2716    0.0099    1    0.0908    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1    2   -2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1   -1    2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1    2   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1    1   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    0    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2    2   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2    1   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1    1    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -2    1    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    1    2   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -2   -1    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -3    0    1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0    2   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1   -1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2    0    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -3    1    1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -1   -2    2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2   -1    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1   -1    2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0   -1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.7                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0873    1.0884    1.0933  109.4475  109.5463  109.0841      0.5252
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0899    1.0888    1.0911  109.7143  109.2763  109.1583      0.4505         0.9989    0.9979    2.4196    2.4172    2.4222
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0555    0.1951    0.2479    5.5502   18.4243   11.6253      0.0848         0.1771    0.0517    0.4719    0.6282    0.7147
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.0489   -0.5988   -0.9476)
 a2 = (   -0.5675   -0.9628   -0.0751)
 a3 = (   -0.8976   -0.0653   -0.6639)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.0475   -0.6011   -0.9419) (    0.0202    0.1667    0.1071)
 a2 = (   -0.5704   -0.9641   -0.0728) (    0.1581    0.2667    0.0103)
 a3 = (   -0.9024   -0.0686   -0.6616) (    0.2498    0.0230    0.0756)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -64.3356  110.8668 -122.0300    7.6293    7.5157    0.5843
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             91             93
# Figure of merit at the beginning and the end of the refinement
         7.8810        29.1258
# Chi-squares at the beginning and the end of the refinement
    0.1729    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7358   -0.0536   -0.7310   -0.0567    0.0057    1    0.0779    0.0702
    2   -1   -2    1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1166    0.0995
    3    1    2   -2   -0.0262    0.0883   -0.0262    0.0895    0.0012    1    0.1142    0.0967
    4   -1   -1    0   -0.1959   -0.5899   -0.1957   -0.5833    0.0065    1    0.1214    0.1078
    5   -1   -1    1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0754    0.0654
    6    1    1   -2   -0.1059    0.1187   -0.1085    0.1216    0.0038    1    0.0899    0.0778
    7   -2   -1    1    0.1222   -0.5986    0.1201   -0.5973    0.0025    1    0.1556    0.1302
    8   -2   -1    2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1213    0.1017
    9    1    0   -2   -0.1937    0.0492   -0.1952    0.0486    0.0016    1    0.0911    0.0726
   10   -1    0    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0541    0.0467
   11   -2    0    1    0.5393   -0.6135    0.5303   -0.6130    0.0090    1    0.1467    0.1248
   12    1   -1   -2   -0.1812   -0.0372   -0.1829   -0.0381    0.0019    1    0.1170    0.0984
   13   -2    1    2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1180    0.0927
   14   -3    1    2    0.5321   -0.1490    0.5293   -0.1451    0.0048    1    0.1759    0.1473
   15    0   -1   -1   -0.3380   -0.2372   -0.3362   -0.2357    0.0023    1    0.1024    0.0881
   16   -1    1    1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0729    0.0679
   17   -2    1    1    0.7312   -0.0792    0.7293   -0.0807    0.0024    1    0.1359    0.1198
   18   -3    1    1    1.0637   -0.5069    1.0696   -0.4972    0.0114    1    0.2994    0.2483
   19   -1    2    1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1136    0.0994
   20   -2    2    1    0.4456    0.1660    0.4423    0.1634    0.0041    1    0.1395    0.1178
   21    0   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0508    0.0568
   22   -1    2    0    0.2985    0.3345    0.3053    0.3413    0.0096    1    0.1057    0.0899
   23    0    2   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0944    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1   -2    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1    2   -2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1   -1    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2   -1    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2   -1    2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1    0   -2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -2    0    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    1   -1   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -2    1    2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -3    1    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0   -1   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2    1    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -3    1    1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -1    2    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2    2    1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1    2    0    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0    2   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.8                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0901    1.0905    1.0911  109.4385  109.4552  109.3938      0.4144
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0888    1.0899    1.0947  109.8874  109.3708  109.1583      0.4505         0.9946    0.9956    2.4172    2.4195    2.4302
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0152    0.1306    0.0479   14.5479   19.5833   11.6253      0.1584         0.0530    0.0794    0.8509    0.8991    0.8614
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3315   -0.8956    0.5891)
 a2 = (    0.9448   -0.5349   -0.2808)
 a3 = (    0.9005    0.0698    0.6645)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3320   -0.8955    0.5888) (    0.0395    0.0966    0.1665)
 a2 = (    0.9499   -0.5325   -0.2803) (    0.1040    0.0583    0.0793)
 a3 = (    0.9024    0.0686    0.6616) (    0.0989    0.0157    0.1871)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  138.2517   52.0076  139.1240    6.9121   10.8626    0.7543
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             75             93
# Figure of merit at the beginning and the end of the refinement
        16.2101        29.1254
# Chi-squares at the beginning and the end of the refinement
    0.0623    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0615    0.0702
    2   -2   -1    2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.0922    0.0995
    3    2    1   -1   -0.0264    0.0894   -0.0262    0.0895    0.0002    1    0.0902    0.0967
    4   -1   -1    2   -0.1954   -0.5847   -0.1957   -0.5833    0.0014    1    0.0956    0.1078
    5   -1   -1    1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0595    0.0654
    6    1    1    0   -0.1071    0.1200   -0.1085    0.1216    0.0021    1    0.0709    0.0778
    7   -1   -2    2    0.1187   -0.5946    0.1201   -0.5973    0.0031    1    0.1224    0.1302
    8   -1   -2    1    0.1429   -0.2202    0.1454   -0.2240    0.0045    1    0.0955    0.1017
    9    0    1    1   -0.1955    0.0493   -0.1952    0.0486    0.0007    1    0.0720    0.0726
   10    0   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0426    0.0467
   11    0   -2    1    0.5326   -0.6136    0.5303   -0.6130    0.0023    1    0.1150    0.1248
   12   -1    1    2   -0.1823   -0.0378   -0.1829   -0.0381    0.0006    1    0.0925    0.0984
   13    1   -2   -1    0.1974   -0.0084    0.1990   -0.0092    0.0017    1    0.0929    0.0927
   14    1   -3    0    0.5294   -0.1500    0.5293   -0.1451    0.0049    1    0.1380    0.1473
   15   -1    0    2   -0.3365   -0.2370   -0.3362   -0.2357    0.0013    1    0.0810    0.0881
   16    1   -1   -1    0.1256    0.0357    0.1275    0.0362    0.0020    1    0.0575    0.0679
   17    1   -2    0    0.7294   -0.0815    0.7293   -0.0807    0.0008    1    0.1066    0.1198
   18    1   -3    1    1.0580   -0.5142    1.0696   -0.4972    0.0206    1    0.2345    0.2483
   19    2   -1   -2    0.0431    0.0289    0.0442    0.0295    0.0013    1    0.0897    0.0994
   20    2   -2   -1    0.4441    0.1652    0.4423    0.1634    0.0025    1    0.1096    0.1178
   21   -1    0    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0402    0.0568
   22    2   -1   -1    0.2976    0.3338    0.3053    0.3413    0.0107    1    0.0832    0.0899
   23    2    0   -1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0745    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2   -1    2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    2    1   -1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1   -1    2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    1    0   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1   -2    2    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -1   -2    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    0    1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0   -1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0   -2    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -1    1    2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    1   -2   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    1   -3    0    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -1    0    2   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1   -1   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1   -2    0    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1   -3    1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    2   -1   -2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    2   -2   -1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    0    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    2   -1   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    2    0   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.10                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0855    1.0858    1.0967  110.5077  108.9709  108.5088      0.4773
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0911    1.0947    1.0888  109.3702  109.7145  109.4210      0.4505         1.0021    1.0054    2.4221    2.4301    2.4171
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0307    0.1364    0.0828   19.5838    5.5504    6.5118      0.1957         0.0519    0.0535    1.0542    1.0981    1.0658
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9397   -0.5320   -0.2793)
 a2 = (    0.0270   -0.6027   -0.9505)
 a3 = (    0.5921    0.3561   -0.8785)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9499   -0.5325   -0.2803) (    0.0236    0.0154    0.1026)
 a2 = (    0.0475   -0.6011   -0.9419) (    0.0149    0.0192    0.3448)
 a3 = (    0.6179    0.3630   -0.8691) (    0.0219    0.0180    0.3182)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -163.2561  120.0750  159.2978    4.6235    9.7119    0.5745
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             57             93
# Figure of merit at the beginning and the end of the refinement
        14.8418        29.1228
# Chi-squares at the beginning and the end of the refinement
    0.1582    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0716    0.0702
    2   -1   -2    2   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1054    0.0995
    3    2    1   -2   -0.0290    0.0954   -0.0262    0.0895    0.0066    1    0.1036    0.0967
    4    0   -2    1   -0.2017   -0.5853   -0.1957   -0.5833    0.0063    1    0.1103    0.1078
    5   -1   -1    1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0681    0.0654
    6    2    0   -1   -0.1121    0.1237   -0.1085    0.1216    0.0042    1    0.0819    0.0778
    7   -1   -2    1    0.1150   -0.5998    0.1201   -0.5973    0.0057    1    0.1409    0.1302
    8   -2   -1    1    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1094    0.1017
    9    2   -1    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0833    0.0726
   10   -1    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0488    0.0467
   11   -1   -1    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1334    0.1248
   12    2   -2    1   -0.1841   -0.0379   -0.1829   -0.0381    0.0013    1    0.1067    0.0984
   13   -2    1   -1    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1065    0.0927
   14   -2    0   -1    0.5374   -0.1539    0.5293   -0.1451    0.0119    1    0.1589    0.1473
   15    1   -2    1   -0.3386   -0.2359   -0.3362   -0.2357    0.0024    1    0.0936    0.0881
   16   -1    1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0659    0.0679
   17   -1    0   -1    0.7460   -0.0857    0.7293   -0.0807    0.0174    1    0.1238    0.1198
   18   -1   -1   -1    1.0824   -0.5407    1.0696   -0.4972    0.0454    1    0.2780    0.2483
   19   -1    2   -2    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1027    0.0994
   20   -1    1   -2    0.4544    0.1697    0.4423    0.1634    0.0136    1    0.1262    0.1178
   21    0   -1    1   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0459    0.0568
   22    0    1   -2    0.3042    0.3456    0.3053    0.3413    0.0044    1    0.0959    0.0899
   23    1    1   -2    0.0332    0.2815    0.0347    0.2716    0.0100    1    0.0857    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1   -2    2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    2    1   -2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    0   -2    1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    2    0   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1   -2    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2   -1    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    2   -1    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1   -1    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2   -2    1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -2    1   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -2    0   -1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    1   -2    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    0   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1   -1   -1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -1    2   -2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1    1   -2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    0    1   -2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1    1   -2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.12                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0816    1.0900    1.0934  109.9566  108.9669  108.8509      0.4551
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0888    1.0911    1.0899  109.2754  109.1588  109.7146      0.4505         0.9990    1.0011    2.4171    2.4221    2.4195
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1054    0.0556    0.2451   18.4249   11.6258    5.5505      0.2056         0.1290    0.1775    1.1278    1.1124    1.2311
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5676   -0.9629   -0.0751)
 a2 = (   -0.8963   -0.0550   -0.6667)
 a3 = (    0.0461   -0.5885   -0.9468)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5704   -0.9641   -0.0728) (    0.0096    0.0058    0.0290)
 a2 = (   -0.9024   -0.0686   -0.6616) (    0.0203    0.0130    0.2572)
 a3 = (    0.0475   -0.6011   -0.9419) (    0.0150    0.0124    0.3659)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -174.2469  139.6686   63.7820    1.0676   11.0262    0.6957
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             77             93
# Figure of merit at the beginning and the end of the refinement
        23.7846        29.1220
# Chi-squares at the beginning and the end of the refinement
    0.0665    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7410   -0.0455   -0.7310   -0.0567    0.0150    1    0.0678    0.0702
    2   -2    1   -1   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3    2   -2    1   -0.0265    0.0906   -0.0262    0.0895    0.0011    1    0.0994    0.0967
    4   -1    0   -1   -0.1989   -0.5918   -0.1957   -0.5833    0.0091    1    0.1050    0.1078
    5   -1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    1   -2    1   -0.1072    0.1216   -0.1085    0.1216    0.0013    1    0.0782    0.0778
    7   -1    1   -2    0.1211   -0.6000    0.1201   -0.5973    0.0029    1    0.1343    0.1302
    8   -1    2   -2    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    0   -2    1   -0.1969    0.0512   -0.1952    0.0486    0.0031    1    0.0790    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    0    1   -2    0.5424   -0.6157    0.5303   -0.6130    0.0123    1    0.1267    0.1248
   12   -1   -2    1   -0.1844   -0.0371   -0.1829   -0.0381    0.0018    1    0.1012    0.0984
   13    1    2   -2    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    1    2   -3    0.5322   -0.1476    0.5293   -0.1451    0.0038    1    0.1515    0.1473
   15   -1   -1    0   -0.3416   -0.2375   -0.3362   -0.2357    0.0057    1    0.0886    0.0881
   16    1    1   -1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    1    1   -2    0.7326   -0.0749    0.7293   -0.0807    0.0066    1    0.1173    0.1198
   18    1    1   -3    1.0757   -0.5020    1.0696   -0.4972    0.0078    1    0.2598    0.2483
   19    2    1   -1    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20    2    1   -2    0.4435    0.1679    0.4423    0.1634    0.0046    1    0.1205    0.1178
   21   -1    0    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22    2    0   -1    0.2956    0.3346    0.3053    0.3413    0.0118    1    0.0917    0.0899
   23    2   -1    0    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0822    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2    1   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    2   -2    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1    0   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1    1   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1   -2    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1    1   -2    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -1    2   -2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    0   -2    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0    1   -2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -1   -2    1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    1    2   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    1    2   -3    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -1   -1    0   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1    1   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1    1   -2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1    1   -3    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    2    1   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    2    1   -2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    0    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    2    0   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    2   -1    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.14                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0845    1.0853    1.0973  110.4143  108.9765  108.5291      0.5223
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0947    1.0911    1.0899  109.2752  109.8882  109.4212      0.4505         1.0044    1.0011    2.4301    2.4221    2.4195
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1605    0.0556    0.2451   18.4250   14.5485    6.5119      0.2056         0.0801    0.1775    1.1650    1.1124    1.2311
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5654   -0.9593   -0.0749)
 a2 = (    0.3477   -0.8885    0.5967)
 a3 = (   -0.5924   -0.3563    0.8761)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5704   -0.9641   -0.0728) (    0.0096    0.0058    0.0290)
 a2 = (    0.3320   -0.8955    0.5888) (    0.0194    0.0145    0.2289)
 a3 = (   -0.6179   -0.3630    0.8691) (    0.0157    0.0133    0.3376)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -5.7531   40.3313 -116.2180    1.0676   11.0262    0.6957
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             61             93
# Figure of merit at the beginning and the end of the refinement
         8.6151        29.1213
# Chi-squares at the beginning and the end of the refinement
    0.2490    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0784    0.0702
    2   -2   -1    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1155    0.0995
    3    1    2   -1   -0.0283    0.0932   -0.0262    0.0895    0.0043    1    0.1134    0.0967
    4   -2    0    1   -0.2023   -0.5869   -0.1957   -0.5833    0.0075    1    0.1211    0.1078
    5   -1   -1    1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0746    0.0654
    6    0    2   -1   -0.1111    0.1226   -0.1085    0.1216    0.0028    1    0.0897    0.0778
    7   -2   -1    2    0.1153   -0.6011    0.1201   -0.5973    0.0061    1    0.1546    0.1302
    8   -1   -2    2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1199    0.1017
    9   -1    2   -1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0912    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0534    0.0467
   11   -1   -1    2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1461    0.1248
   12   -2    2   -1   -0.1852   -0.0381   -0.1829   -0.0381    0.0024    1    0.1170    0.0984
   13    1   -2    2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1165    0.0927
   14    0   -2    3    0.5363   -0.1536    0.5293   -0.1451    0.0110    1    0.1739    0.1473
   15   -2    1    0   -0.3399   -0.2368   -0.3362   -0.2357    0.0038    1    0.1026    0.0881
   16    1   -1    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0721    0.0679
   17    0   -1    2    0.7442   -0.0855    0.7293   -0.0807    0.0156    1    0.1352    0.1198
   18   -1   -1    3    1.0810   -0.5400    1.0696   -0.4972    0.0443    1    0.3040    0.2483
   19    2   -1    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1124    0.0994
   20    1   -1    2    0.4521    0.1688    0.4423    0.1634    0.0111    1    0.1378    0.1178
   21   -1    0    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0503    0.0568
   22    1    0    1    0.3021    0.3432    0.3053    0.3413    0.0037    1    0.1047    0.0899
   23    1    1    0    0.0328    0.2785    0.0347    0.2716    0.0071    1    0.0936    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2   -1    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1    2   -1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -2    0    1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0    2   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2   -1    2    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -1   -2    2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1    2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1   -1    2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -2    2   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    1   -2    2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    0   -2    3    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -2    1    0   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1   -1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0   -1    2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1   -1    3    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    2   -1    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    1   -1    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    0    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    1    0    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1    1    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.18                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0895    1.0902    1.0922  109.0263  109.6726  109.6024      0.4932
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0947    1.0899    1.0911  109.2748  109.4213  109.8885      0.4505         1.0033    0.9989    2.4301    2.4195    2.4221
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1605    0.2451    0.0556   18.4253    6.5121   14.5487      0.2056         0.0994    0.1771    1.1650    1.2311    1.1124
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5703    0.9675    0.0755)
 a2 = (    0.6147    0.3573   -0.8661)
 a3 = (   -0.3335    0.8941   -0.5842)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5704    0.9641    0.0728) (    0.0096    0.0058    0.0290)
 a2 = (    0.6179    0.3630   -0.8691) (    0.0157    0.0133    0.3376)
 a3 = (   -0.3320    0.8955   -0.5888) (    0.0194    0.0145    0.2289)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  176.0187  110.8674 -122.0300    1.3949    7.5163    0.5843
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             91             93
# Figure of merit at the beginning and the end of the refinement
        11.9806        29.1198
# Chi-squares at the beginning and the end of the refinement
    0.1024    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7252   -0.0589   -0.7310   -0.0567    0.0063    1    0.0727    0.0702
    2    2   -1    1   -0.0135   -0.1741   -0.0130   -0.1762    0.0022    1    0.1100    0.0995
    3   -1    1   -2   -0.0258    0.0869   -0.0262    0.0895    0.0026    1    0.1074    0.0967
    4    2   -1    0   -0.1934   -0.5802   -0.1957   -0.5833    0.0039    1    0.1136    0.1078
    5    1   -1    1    0.0561   -0.2235    0.0560   -0.2234    0.0002    1    0.0711    0.0654
    6    0    1   -2   -0.1050    0.1172   -0.1085    0.1216    0.0055    1    0.0845    0.0778
    7    2   -2    1    0.1180   -0.5907    0.1201   -0.5973    0.0070    1    0.1457    0.1302
    8    1   -2    2    0.1431   -0.2202    0.1454   -0.2240    0.0044    1    0.1141    0.1017
    9    1    1   -2   -0.1920    0.0480   -0.1952    0.0486    0.0032    1    0.0857    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0509    0.0467
   11    1   -2    1    0.5278   -0.6099    0.5303   -0.6130    0.0041    1    0.1365    0.1248
   12    2    1   -2   -0.1794   -0.0373   -0.1829   -0.0381    0.0035    1    0.1103    0.0984
   13   -1   -2    2    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1110    0.0927
   14    0   -3    2    0.5265   -0.1502    0.5293   -0.1451    0.0058    1    0.1644    0.1473
   15    2    0   -1   -0.3328   -0.2350   -0.3362   -0.2357    0.0035    1    0.0964    0.0881
   16   -1   -1    1    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0686    0.0679
   17    0   -2    1    0.7249   -0.0833    0.7293   -0.0807    0.0051    1    0.1266    0.1198
   18    1   -3    1    1.0471   -0.5145    1.0696   -0.4972    0.0284    1    0.2770    0.2483
   19   -2   -1    1    0.0432    0.0290    0.0442    0.0295    0.0011    1    0.1071    0.0994
   20   -1   -2    1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1305    0.1178
   21    1    0    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0479    0.0568
   22   -1   -1    0    0.2965    0.3315    0.3053    0.3413    0.0132    1    0.0988    0.0899
   23   -1    0   -1    0.0342    0.2689    0.0347    0.2716    0.0028    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    2   -1    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -1    1   -2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    2   -1    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1   -1    1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    2   -2    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    1   -2    2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1    1   -2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -2    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2    1   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -1   -2    2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    0   -3    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    2    0   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1   -1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0   -2    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1   -3    1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -2   -1    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1   -2    1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    0    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1   -1    0    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1    0   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.19                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0834    1.0873    1.0968  108.8887  109.7803  109.2913      0.3055
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0899    1.0888    1.0947  109.3692  109.8886  109.1593      0.4505         0.9956    0.9946    2.4195    2.4171    2.4301
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.2205    0.0828    0.1364   19.5845   14.5488   11.6261      0.1957         0.0794    0.0530    1.1594    1.0659    1.0981
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.9510    0.5360    0.2851)
 a2 = (   -0.3236    0.8982   -0.5819)
 a3 = (   -0.8939   -0.0693   -0.6574)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.9499    0.5325    0.2803) (    0.0236    0.0154    0.1026)
 a2 = (   -0.3320    0.8955   -0.5888) (    0.0189    0.0285    0.2158)
 a3 = (   -0.9024   -0.0686   -0.6616) (    0.0270    0.0133    0.2425)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  161.5581  127.9933  -40.8760    4.1829   10.8633    0.7543
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             95             93
# Figure of merit at the beginning and the end of the refinement
         4.1659        29.1193
# Chi-squares at the beginning and the end of the refinement
    0.4741    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0898    0.0702
    2    1    2   -2   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.0681    0.0995
    3   -1   -2    1   -0.0249    0.0848   -0.0262    0.0895    0.0048    1    0.0665    0.0967
    4    2    2   -4   -0.1909   -0.5850   -0.1957   -0.5833    0.0051    1    0.1408    0.1078
    5    1    1   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0440    0.0654
    6   -1   -1    0   -0.1028    0.1156   -0.1085    0.1216    0.0082    1    0.0522    0.0778
    7    2    1   -2    0.1230   -0.5924    0.1201   -0.5973    0.0057    1    0.0903    0.1302
    8    2    1   -1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.0708    0.1017
    9   -1    0   -1   -0.1897    0.0480   -0.1952    0.0486    0.0056    1    0.0528    0.0726
   10    1    0    0    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0316    0.0467
   11    2    0   -1    0.5337   -0.6041    0.5303   -0.6130    0.0095    1    0.0847    0.1248
   12   -1    1   -2   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.0680    0.0984
   13    2   -1    1    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.0689    0.0927
   14    3   -1    0    0.5267   -0.1478    0.5293   -0.1451    0.0038    1    0.1022    0.1473
   15    0    1   -2   -0.3334   -0.2361   -0.3362   -0.2357    0.0029    1    0.0594    0.0881
   16    2   -2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0853    0.0679
   17    4   -2    0    0.7211   -0.0794    0.7293   -0.0807    0.0084    1    0.1576    0.1198
   18    3   -1   -1    1.0438   -0.4972    1.0696   -0.4972    0.0258    1    0.1702    0.2483
   19    1   -2    2    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.0663    0.0994
   20    2   -2    1    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.0811    0.1178
   21    0    2   -2   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0594    0.0568
   22    1   -2    1    0.2960    0.3286    0.3053    0.3413    0.0158    1    0.0614    0.0899
   23    0   -2    1    0.0353    0.2667    0.0347    0.2716    0.0049    1    0.0549    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    1    2   -2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -1   -2    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1    1   -2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1    1   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1   -1    0   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    2    1   -2    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    2    1   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1    0   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1    0    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    2    0   -1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -1    1   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    2   -1    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    3   -1    0    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0    1   -2   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1   -1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    2   -1    0    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    3   -1   -1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    1   -2    2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    2   -2    1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    1   -2    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0   -2    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.20                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0790    1.0793    1.1036  107.8834  110.2733  109.3487      0.4844
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0888    1.0899    1.0911  109.2746  109.7148  109.1593      0.4505         0.9979    0.9989    2.4171    2.4195    2.4221
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1054    0.2451    0.0556   18.4255    5.5508   11.6262      0.2056         0.0517    0.1771    1.1278    1.2312    1.1124
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5744    0.9745    0.0732)
 a2 = (   -0.0716    0.6092    0.9336)
 a3 = (    0.8835    0.0685    0.6497)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5704    0.9641    0.0728) (    0.0096    0.0058    0.0290)
 a2 = (   -0.0475    0.6011    0.9419) (    0.0150    0.0124    0.3659)
 a3 = (    0.9024    0.0686    0.6616) (    0.0203    0.0130    0.2572)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
    3.9813   69.1325   57.9700    1.3949    7.5163    0.5843
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            400             93
# Figure of merit at the beginning and the end of the refinement
         5.8773        29.1189
# Chi-squares at the beginning and the end of the refinement
    0.1721    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0703    0.0702
    2    2    1   -1   -0.0134   -0.1718   -0.0130   -0.1762    0.0044    1    0.1087    0.0995
    3   -2   -1    2   -0.0239    0.0838   -0.0262    0.0895    0.0061    1    0.1061    0.0967
    4    1    1    0   -0.1834   -0.5775   -0.1957   -0.5833    0.0137    1    0.1107    0.1078
    5    1    1   -1    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0702    0.0654
    6   -1   -1    2   -0.1002    0.1147   -0.1085    0.1216    0.0107    1    0.0828    0.0778
    7    1    2   -1    0.1237   -0.5812    0.1201   -0.5973    0.0165    1    0.1426    0.1302
    8    1    2   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.1128    0.1017
    9    0   -1    2   -0.1867    0.0479   -0.1952    0.0486    0.0086    1    0.0835    0.0726
   10    0    1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0503    0.0467
   11    0    2   -1    0.5260   -0.5892    0.5303   -0.6130    0.0242    1    0.1329    0.1248
   12    1   -1    2   -0.1744   -0.0363   -0.1829   -0.0381    0.0086    1    0.1076    0.0984
   13   -1    2   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.1098    0.0927
   14   -1    3   -2    0.5181   -0.1451    0.5293   -0.1451    0.0112    1    0.1622    0.1473
   15    1    0    1   -0.3280   -0.2347   -0.3362   -0.2357    0.0083    1    0.0936    0.0881
   16   -1    1   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17   -1    2   -1    0.7063   -0.0774    0.7293   -0.0807    0.0233    1    0.1239    0.1198
   18   -1    3   -1    1.0183   -0.4776    1.0696   -0.4972    0.0549    0    0.2635    0.2483
   19   -2    1   -1    0.0451    0.0302    0.0442    0.0295    0.0012    1    0.1059    0.0994
   20   -2    2   -1    0.4338    0.1594    0.4423    0.1634    0.0094    1    0.1292    0.1178
   21    1    0    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0474    0.0568
   22   -2    1    0    0.2925    0.3211    0.3053    0.3413    0.0239    0    0.0978    0.0899
   23   -2    0    1    0.0370    0.2624    0.0347    0.2716    0.0095    1    0.0876    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    2    1   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -2   -1    2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1    1    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1    1   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1   -1    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    1    2   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    1    2   -2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    0   -1    2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0    2   -1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    1   -1    2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -1    2   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -1    3   -2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    1    0    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    2   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1    3   -1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -2    1   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2    2   -1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    0    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -2    1    0    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -2    0    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.24                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0845    1.0858    1.0968  109.0266  110.3354  108.5653      0.4564
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0947    1.0911    1.0888  109.7149  109.3687  109.4215      0.4505         1.0054    1.0021    2.4301    2.4220    2.4170
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1410    0.2479    0.1951    5.5509   19.5849    6.5123      0.0848         0.0536    0.0519    0.5545    0.7147    0.6283
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.0270    0.6028    0.9506)
 a2 = (   -0.9397    0.5320    0.2793)
 a3 = (   -0.5929   -0.3574    0.8757)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.0475    0.6011    0.9419) (    0.0202    0.1667    0.1071)
 a2 = (   -0.9499    0.5325    0.2803) (    0.2631    0.1476    0.0322)
 a3 = (   -0.6179   -0.3630    0.8691) (    0.1722    0.1013    0.0990)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.2817   59.9243  -20.7022    3.8623    9.7124    0.5745
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
             57             93
# Figure of merit at the beginning and the end of the refinement
        19.8589        29.1176
# Chi-squares at the beginning and the end of the refinement
    0.1198    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0685    0.0702
    2    2    1   -2   -0.0136   -0.1739   -0.0130   -0.1762    0.0023    1    0.1010    0.0995
    3   -1   -2    2   -0.0282    0.0931   -0.0262    0.0895    0.0042    1    0.0990    0.0967
    4    2    0   -1   -0.2022   -0.5864   -0.1957   -0.5833    0.0072    1    0.1057    0.1078
    5    1    1   -1    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0652    0.0654
    6    0   -2    1   -0.1110    0.1226   -0.1085    0.1216    0.0027    1    0.0783    0.0778
    7    2    1   -1    0.1149   -0.6008    0.1201   -0.5973    0.0063    1    0.1350    0.1302
    8    1    2   -1    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1047    0.1017
    9    1   -2    0   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.0797    0.0726
   10    0    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    1    1    0    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1275    0.1248
   12    2   -2   -1   -0.1851   -0.0382   -0.1829   -0.0381    0.0023    1    0.1022    0.0984
   13   -1    2    1    0.1975   -0.0084    0.1990   -0.0092    0.0017    1    0.1018    0.0927
   14    0    2    1    0.5363   -0.1533    0.5293   -0.1451    0.0108    1    0.1517    0.1473
   15    2   -1   -1   -0.3395   -0.2367   -0.3362   -0.2357    0.0035    1    0.0897    0.0881
   16   -1    1    1    0.1256    0.0357    0.1275    0.0362    0.0019    1    0.0630    0.0679
   17    0    1    1    0.7439   -0.0847    0.7293   -0.0807    0.0151    1    0.1181    0.1198
   18    1    1    1    1.0814   -0.5390    1.0696   -0.4972    0.0434    1    0.2650    0.2483
   19   -2    1    2    0.0431    0.0289    0.0442    0.0295    0.0012    1    0.0983    0.0994
   20   -1    1    2    0.4514    0.1690    0.4423    0.1634    0.0106    1    0.1204    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0440    0.0568
   22   -1    0    2    0.3014    0.3427    0.3053    0.3413    0.0041    1    0.0914    0.0899
   23   -1   -1    2    0.0329    0.2780    0.0347    0.2716    0.0066    1    0.0818    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    2    1   -2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -1   -2    2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    2    0   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1    1   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0   -2    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    2    1   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    1    2   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1   -2    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    1    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2   -2   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -1    2    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    0    2    1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    2   -1   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0    1    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1    1    1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -2    1    2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1    1    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    0   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1    0    2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1   -1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.27                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8622    0.8656    1.4233   90.2612   90.3122  109.7062      0.4015
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8651    0.8660    1.4141   89.8941   90.4850  109.2686      0.3575         0.6118    0.6124    2.4198    2.4222    3.9554
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0969    0.2502    0.4758    1.5950    2.4671   18.4341      0.0472         0.1374    0.0310    0.4190    0.7695    1.4295
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.4191   -0.1494   -1.1489)
 a2 = (   -0.7736    0.5258   -0.7944)
 a3 = (    0.3560    0.6040    0.0457)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.4192   -0.1500   -1.1408) (    0.1435    0.0534    0.0594)
 a2 = (   -0.7776    0.5210   -0.7876) (    0.2637    0.1769    0.0422)
 a3 = (    0.3593    0.6074    0.0459) (    0.1218    0.2056    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -110.9349   85.8732  149.6600    7.5011    1.8365    0.6287
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0057      0.0024    0.0024    0.3928

# Number of computed bands
            157            163
# Figure of merit at the beginning and the end of the refinement
         6.8940        12.6426
# Chi-squares at the beginning and the end of the refinement
    0.1208    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7402   -0.0512   -0.7310   -0.0567    0.0107    1    0.0754    0.0702
    2   -1    1    4   -0.0129   -0.1729   -0.0130   -0.1762    0.0033    1    0.1119    0.0995
    3    1   -2   -3   -0.0275    0.0922   -0.0262    0.0895    0.0031    1    0.1101    0.0967
    4   -1    0    3   -0.1955   -0.5910   -0.1957   -0.5833    0.0077    1    0.1166    0.1078
    5   -1    1    2    0.0568   -0.2224    0.0560   -0.2234    0.0013    1    0.0724    0.0654
    6    1   -2   -1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0868    0.0778
    7   -2    1    3    0.1231   -0.5969    0.1201   -0.5973    0.0030    1    0.1495    0.1302
    8   -2    2    2    0.1433   -0.2192    0.1454   -0.2240    0.0053    1    0.1166    0.1017
    9    1   -2    1   -0.1961    0.0504   -0.1952    0.0486    0.0020    1    0.0879    0.0726
   10   -1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0521    0.0467
   11   -2    1    1    0.5377   -0.6117    0.5303   -0.6130    0.0075    1    0.1410    0.1248
   12    1   -2    3   -0.1828   -0.0368   -0.1829   -0.0381    0.0013    1    0.1125    0.0984
   13   -2    2   -2    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1135    0.0927
   14   -3    2   -1    0.5307   -0.1504    0.5293   -0.1451    0.0055    1    0.1693    0.1473
   15    0   -1    3   -0.3400   -0.2375   -0.3362   -0.2357    0.0042    1    0.0984    0.0881
   16   -1    1   -2    0.1281    0.0358    0.1275    0.0362    0.0007    1    0.0701    0.0679
   17   -2    1   -1    0.7316   -0.0820    0.7293   -0.0807    0.0026    1    0.1310    0.1198
   18   -3    1    0    1.0618   -0.5092    1.0696   -0.4972    0.0144    1    0.2883    0.2483
   19   -1    1   -4    0.0454    0.0302    0.0442    0.0295    0.0014    1    0.1090    0.0994
   20   -2    1   -3    0.4489    0.1654    0.4423    0.1634    0.0068    1    0.1344    0.1178
   21    0    0    2   -0.0331   -0.0562   -0.0341   -0.0579    0.0020    1    0.0487    0.0568
   22   -1    0   -3    0.3023    0.3380    0.3053    0.3413    0.0044    1    0.1020    0.0899
   23    0   -1   -3    0.0349    0.2767    0.0347    0.2716    0.0050    1    0.0910    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1    1    4   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3    1   -2   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1    0    3   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1    1    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6    1   -2   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2    1    3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8   -2    2    2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1   -2    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -2    1    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    1   -2    3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13   -2    2   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14   -3    2   -1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0   -1    3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2    1   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -3    1    0    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2518          0.2483
   19   -1    1   -4    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2    1   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    0    0    3   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0651          0.0568
   22   -1    0   -3    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23    0   -1   -3    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.28                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8546    0.8700    1.4185   90.5554   90.1547  108.5147      0.3559
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8628    0.8672    1.4189   89.8994   89.8421  109.6201      0.3565         0.6080    0.6112    2.4201    2.4325    3.9803
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0288    0.0211    0.2998   13.3343   18.7851    5.5171      0.1390         0.1087    0.1383    0.9469    0.9501    1.7648
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7352   -0.8600    0.4928)
 a2 = (   -1.1505    0.2867   -0.2521)
 a3 = (    0.0295   -0.3736   -0.5972)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7486   -0.8383    0.5009) (    0.0500    0.0547    0.1623)
 a2 = (   -1.1642    0.2926   -0.2405) (    0.0785    0.0221    0.0785)
 a3 = (    0.0299   -0.3780   -0.5941) (    0.0096    0.0264    0.1925)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  130.9850  147.3682    4.1271    3.3086   10.1048    0.7192
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0006   -0.0017      0.0024    0.0024    0.3892

# Number of computed bands
            400            157
# Figure of merit at the beginning and the end of the refinement
         5.9925        12.4264
# Chi-squares at the beginning and the end of the refinement
    0.1917    0.0225
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0677    0.0702
    2   -2    1   -3   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1005    0.0995
    3    2   -2    2   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.0982    0.0967
    4   -1    0   -3   -0.1935   -0.5926   -0.1957   -0.5833    0.0095    1    0.1044    0.1078
    5   -1    1   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0645    0.0654
    6    1   -2    1   -0.1098    0.1243   -0.1085    0.1216    0.0030    1    0.0768    0.0778
    7   -1    1   -4    0.1208   -0.5981    0.1201   -0.5973    0.0010    1    0.1327    0.1302
    8   -1    2   -3    0.1420   -0.2192    0.1454   -0.2240    0.0059    1    0.1028    0.1017
    9    0   -2    0   -0.2063    0.0514   -0.1952    0.0486    0.0114    1    0.0775    0.0726
   10    0    1   -1    0.2227   -0.1246    0.2251   -0.1274    0.0037    1    0.0455    0.0467
   11    0    1   -3    0.5425   -0.6163    0.5303   -0.6130    0.0126    1    0.1244    0.1248
   12   -1   -2   -1   -0.1931   -0.0424   -0.1829   -0.0381    0.0111    1    0.0998    0.0984
   13    1    2   -1    0.1909   -0.0054    0.1990   -0.0092    0.0088    1    0.0991    0.0927
   14    1    2   -3    0.5318   -0.1420    0.5293   -0.1451    0.0040    1    0.1474    0.1473
   15   -1   -1   -2   -0.3429   -0.2479   -0.3362   -0.2357    0.0139    1    0.0883    0.0881
   16    1    1    0    0.1168    0.0355    0.1275    0.0362    0.0107    1    0.0616    0.0679
   17    1    1   -2    0.7321   -0.0655    0.7293   -0.0807    0.0155    1    0.1143    0.1198
   18    1    1   -4    1.0834   -0.4980    1.0696   -0.4972    0.0139    1    0.2554    0.2483
   19    2    1    1    0.0354    0.0247    0.0442    0.0295    0.0101    1    0.0970    0.0994
   20    2    1   -1    0.4329    0.1731    0.4423    0.1634    0.0135    1    0.1174    0.1178
   21   -1    0   -1   -0.0365   -0.0638   -0.0341   -0.0579    0.0063    1    0.0438    0.0568
   22    2    0    0    0.2830    0.3311    0.3053    0.3413    0.0245    0    0.0898    0.0899
   23    2   -1    1    0.0323    0.2651    0.0347    0.2716    0.0069    1    0.0813    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7327   -0.0558   -0.7310   -0.0567    0.0019    1          0.0664          0.0702
    2   -2    1   -3   -0.0135   -0.1739   -0.0130   -0.1762    0.0023    1          0.0996          0.0995
    3    2   -2    2   -0.0264    0.0893   -0.0262    0.0895    0.0003    1          0.0976          0.0967
    4   -1    0   -3   -0.1955   -0.5861   -0.1957   -0.5833    0.0028    1          0.1031          0.1078
    5   -1    1   -2    0.0563   -0.2237    0.0560   -0.2234    0.0005    1          0.0643          0.0654
    6    1   -2    1   -0.1070    0.1193   -0.1085    0.1216    0.0027    1          0.0768          0.0778
    7   -1    1   -4    0.1206   -0.5960    0.1201   -0.5973    0.0014    1          0.1321          0.1302
    8   -1    2   -3    0.1436   -0.2205    0.1454   -0.2240    0.0039    1          0.1033          0.1017
    9    0   -2    0   -0.1945    0.0483   -0.1952    0.0486    0.0008    1          0.0779          0.0726
   10    0    1   -1    0.2257   -0.1273    0.2251   -0.1274    0.0006    1          0.0461          0.0467
   11    0    1   -3    0.5370   -0.6115    0.5303   -0.6130    0.0069    1          0.1242          0.1248
   12   -1   -2   -1   -0.1809   -0.0381   -0.1829   -0.0381    0.0020    1          0.1001          0.0984
   13    1    2   -1    0.1978   -0.0086    0.1990   -0.0092    0.0013    1          0.1008          0.0927
   14    1    2   -3    0.5293   -0.1478    0.5293   -0.1451    0.0027    1          0.1494          0.1473
   15   -1   -1   -2   -0.3357   -0.2365   -0.3362   -0.2357    0.0010    1          0.0874          0.0881
   16    1    1    0    0.1262    0.0353    0.1275    0.0362    0.0015    1          0.0624          0.0679
   17    1    1   -2    0.7275   -0.0781    0.7293   -0.0807    0.0032    1          0.1153          0.1198
   18    1    1   -4    1.0603   -0.5046    1.0696   -0.4972    0.0119    1          0.2528          0.2483
   19    2    1    1    0.0441    0.0288    0.0442    0.0295    0.0008    1          0.0973          0.0994
   20    2    1   -1    0.4428    0.1648    0.4423    0.1634    0.0015    1          0.1189          0.1178
   21   -1    0   -1   -0.0335   -0.0575   -0.0341   -0.0579    0.0008    1          0.0435          0.0568
   22    2    0    0    0.2975    0.3323    0.3053    0.3413    0.0119    1          0.0902          0.0899
   23    2   -1    1    0.0353    0.2715    0.0347    0.2716    0.0006    1          0.0807          0.0816

###            No.29                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8641    0.8727    1.4029   89.0979   88.5909   71.0106      0.3553
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8635    0.8657    1.4209   90.2433   89.9169   70.3040      0.3581         0.6077    0.6092    2.4113    2.4174    3.9678
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0301    0.0221    0.3059   13.6296   19.1857    5.7034      0.1435         0.1105    0.1402    0.9699    0.9707    1.8050
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7420    0.8296   -0.5097)
 a2 = (   -1.1489    0.2906   -0.2532)
 a3 = (   -0.0314    0.3776    0.6041)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7493    0.8370   -0.5009) (    0.0510    0.0555    0.1655)
 a2 = (   -1.1670    0.2934   -0.2398) (    0.0805    0.0257    0.0798)
 a3 = (   -0.0303    0.3786    0.5925) (    0.0108    0.0280    0.1957)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -130.9511   32.6311 -175.9757    3.4181   10.3001    0.8221
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0079      0.0024    0.0024    0.3993

# Number of computed bands
            400            161
# Figure of merit at the beginning and the end of the refinement
         5.7529        12.0988
# Chi-squares at the beginning and the end of the refinement
    0.1342    0.0296
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7625   -0.0593   -0.7310   -0.0567    0.0316    0    0.0683    0.0702
    2    2    1    3   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.0988    0.0995
    3   -2   -2   -2   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0968    0.0967
    4    1    0    3   -0.1976   -0.5985   -0.1957   -0.5833    0.0153    1    0.1043    0.1078
    5    1    1    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0638    0.0654
    6   -1   -2   -1   -0.1144    0.1289   -0.1085    0.1216    0.0094    1    0.0763    0.0778
    7    1    1    4    0.1222   -0.6037    0.1201   -0.5973    0.0068    1    0.1330    0.1302
    8    1    2    3    0.1429   -0.2203    0.1454   -0.2240    0.0045    1    0.1024    0.1017
    9    0   -2    0   -0.2071    0.0524   -0.1952    0.0486    0.0125    1    0.0774    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0456    0.0467
   11    0    1    3    0.5426   -0.6213    0.5303   -0.6130    0.0148    1    0.1258    0.1248
   12    1   -2    1   -0.1914   -0.0398   -0.1829   -0.0381    0.0087    1    0.0993    0.0984
   13   -1    2    1    0.1974   -0.0083    0.1990   -0.0092    0.0018    1    0.0995    0.0927
   14   -1    2    3    0.5365   -0.1514    0.5293   -0.1451    0.0096    1    0.1495    0.1473
   15    1   -1    2   -0.3468   -0.2455   -0.3362   -0.2357    0.0144    1    0.0878    0.0881
   16   -1    1    0    0.1255    0.0358    0.1275    0.0362    0.0021    1    0.0616    0.0679
   17   -1    1    2    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1165    0.1198
   18   -1    1    4    1.0757   -0.5181    1.0696   -0.4972    0.0219    1    0.2595    0.2483
   19   -2    1   -1    0.0430    0.0288    0.0442    0.0295    0.0014    1    0.0961    0.0994
   20   -2    1    1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1189    0.1178
   21    1    0    1   -0.0342   -0.0580   -0.0341   -0.0579    0.0001    1    0.0430    0.0568
   22   -2    0    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0905    0.0899
   23   -2   -1   -1    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.0806    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7339   -0.0555   -0.7310   -0.0567    0.0031    1          0.0661          0.0702
    2    2    1    3   -0.0134   -0.1735   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3   -2   -2   -2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0975          0.0967
    4    1    0    3   -0.1958   -0.5874   -0.1957   -0.5833    0.0041    1          0.1026          0.1078
    5    1    1    2    0.0565   -0.2234    0.0560   -0.2234    0.0006    1          0.0641          0.0654
    6   -1   -2   -1   -0.1078    0.1199   -0.1085    0.1216    0.0018    1          0.0768          0.0778
    7    1    1    4    0.1215   -0.5967    0.1201   -0.5973    0.0016    1          0.1315          0.1302
    8    1    2    3    0.1439   -0.2202    0.1454   -0.2240    0.0041    1          0.1031          0.1017
    9    0   -2    0   -0.1948    0.0485   -0.1952    0.0486    0.0005    1          0.0779          0.0726
   10    0    1    1    0.2258   -0.1272    0.2251   -0.1274    0.0008    1          0.0461          0.0467
   11    0    1    3    0.5379   -0.6116    0.5303   -0.6130    0.0077    1          0.1236          0.1248
   12    1   -2    1   -0.1809   -0.0378   -0.1829   -0.0381    0.0020    1          0.1001          0.0984
   13   -1    2    1    0.1984   -0.0087    0.1990   -0.0092    0.0007    1          0.1008          0.0927
   14   -1    2    3    0.5300   -0.1484    0.5293   -0.1451    0.0033    1          0.1491          0.1473
   15    1   -1    2   -0.3364   -0.2364   -0.3362   -0.2357    0.0007    1          0.0872          0.0881
   16   -1    1    0    0.1272    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    1    2    0.7289   -0.0792    0.7293   -0.0807    0.0016    1          0.1149          0.1198
   18   -1    1    4    1.0608   -0.5059    1.0696   -0.4972    0.0123    1          0.2509          0.2483
   19   -2    1   -1    0.0449    0.0294    0.0442    0.0295    0.0008    1          0.0972          0.0994
   20   -2    1    1    0.4450    0.1649    0.4423    0.1634    0.0030    1          0.1187          0.1178
   21    1    0    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -2    0    0    0.2998    0.3344    0.3053    0.3413    0.0089    1          0.0901          0.0899
   23   -2   -1   -1    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0805          0.0816

###            No.30                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8643    0.8653    1.4189   89.0448   89.6623   70.4853      0.3624
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8642    0.8658    1.4198   90.1631   89.8683   70.2739      0.3576         0.6086    0.6098    2.4164    2.4211    3.9702
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0293    0.0208    0.3012   13.4472   18.9550    5.5676      0.1414         0.1090    0.1385    0.9589    0.9590    1.7815
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7441    0.8319   -0.5111)
 a2 = (   -1.1666    0.2905   -0.2418)
 a3 = (   -0.0170    0.3796    0.5937)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.7488    0.8362   -0.5013) (    0.0503    0.0550    0.1635)
 a2 = (   -1.1672    0.2924   -0.2400) (    0.0792    0.0223    0.0789)
 a3 = (   -0.0299    0.3788    0.5930) (    0.0096    0.0266    0.1934)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -130.9650   32.6881 -175.9501    3.3321   10.1844    0.7033
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0064      0.0024    0.0024    0.3936

# Number of computed bands
            135            163
# Figure of merit at the beginning and the end of the refinement
         8.5872        12.0976
# Chi-squares at the beginning and the end of the refinement
    0.1499    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0676    0.0702
    2    2    1    3   -0.0145   -0.1659   -0.0130   -0.1762    0.0104    1    0.1008    0.0995
    3   -2   -2   -2   -0.0286    0.0977   -0.0262    0.0895    0.0086    1    0.0990    0.0967
    4    1    0    3   -0.2017   -0.5735   -0.1957   -0.5833    0.0115    1    0.1043    0.1078
    5    1    1    2    0.0529   -0.2180    0.0560   -0.2234    0.0062    1    0.0649    0.0654
    6   -1   -2   -1   -0.1112    0.1241   -0.1085    0.1216    0.0038    1    0.0781    0.0778
    7    1    1    4    0.1103   -0.5936    0.1201   -0.5973    0.0105    1    0.1335    0.1302
    8    1    2    3    0.1401   -0.2180    0.1454   -0.2240    0.0079    1    0.1042    0.1017
    9    0   -2    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0795    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11    0    1    3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1265    0.1248
   12    1   -2    1   -0.1775   -0.0366   -0.1829   -0.0381    0.0056    1    0.1022    0.0984
   13   -1    2    1    0.2004   -0.0083    0.1990   -0.0092    0.0016    1    0.1024    0.0927
   14   -1    2    3    0.5350   -0.1518    0.5293   -0.1451    0.0088    1    0.1520    0.1473
   15    1   -1    2   -0.3305   -0.2290   -0.3362   -0.2357    0.0088    1    0.0891    0.0881
   16   -1    1    0    0.1304    0.0370    0.1275    0.0362    0.0031    1    0.0635    0.0679
   17   -1    1    2    0.7397   -0.0828    0.7293   -0.0807    0.0106    1    0.1182    0.1198
   18   -1    1    4    1.0743   -0.5304    1.0696   -0.4972    0.0336    1    0.2625    0.2483
   19   -2    1   -1    0.0491    0.0326    0.0442    0.0295    0.0058    1    0.0992    0.0994
   20   -2    1    1    0.4518    0.1680    0.4423    0.1634    0.0105    1    0.1216    0.1178
   21    1    0    1   -0.0301   -0.0501   -0.0341   -0.0579    0.0088    1    0.0442    0.0568
   22   -2    0    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0925    0.0899
   23   -2   -1   -1    0.0369    0.2824    0.0347    0.2716    0.0110    1    0.0824    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0661          0.0702
    2    2    1    3   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3   -2   -2   -2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1    0    3   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1027          0.1078
    5    1    1    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6   -1   -2   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    1    1    4    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1316          0.1302
    8    1    2    3    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1031          0.1017
    9    0   -2    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10    0    1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0    1    3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1238          0.1248
   12    1   -2    1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13   -1    2    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14   -1    2    3    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1492          0.1473
   15    1   -1    2   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0872          0.0881
   16   -1    1    0    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    1    2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1150          0.1198
   18   -1    1    4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2514          0.2483
   19   -2    1   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2    1    1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    1    0    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -2    0    0    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23   -2   -1   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.31                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8635    0.8678    1.4161   89.6623   89.0448   70.4853      0.3616
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8660    0.8642    1.4195   89.8386   90.1422   70.2824      0.3575         0.6100    0.6088    2.4221    2.4172    3.9704
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0305    0.0740    0.3711   18.9278   13.4259    5.5556      0.1586         0.1384    0.1088    1.0780    1.0922    2.0446
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    1.1690   -0.2911    0.2423)
 a2 = (   -0.7411   -0.8285    0.5090)
 a3 = (    0.0170   -0.3804   -0.5949)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    1.1669   -0.2923    0.2401) (    0.0178    0.0132    0.0906)
 a2 = (   -0.7486   -0.8361    0.5015) (    0.0216    0.0233    0.1884)
 a3 = (    0.0299   -0.3787   -0.5933) (    0.0096    0.0110    0.2227)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   21.2418  147.2960    4.0499    2.3255   10.1729    0.7033
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0057      0.0024    0.0024    0.3929

# Number of computed bands
            135            163
# Figure of merit at the beginning and the end of the refinement
         9.0473        12.0974
# Chi-squares at the beginning and the end of the refinement
    0.1250    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0676    0.0702
    2   -1   -2   -3   -0.0143   -0.1685   -0.0130   -0.1762    0.0078    1    0.1006    0.0995
    3    2    2    2   -0.0284    0.0959   -0.0262    0.0895    0.0068    1    0.0988    0.0967
    4    0   -1   -3   -0.2021   -0.5768   -0.1957   -0.5833    0.0091    1    0.1045    0.1078
    5   -1   -1   -2    0.0540   -0.2199    0.0560   -0.2234    0.0040    1    0.0649    0.0654
    6    2    1    1   -0.1107    0.1229   -0.1085    0.1216    0.0026    1    0.0780    0.0778
    7   -1   -1   -4    0.1118   -0.5955    0.1201   -0.5973    0.0085    1    0.1337    0.1302
    8   -2   -1   -3    0.1412   -0.2187    0.1454   -0.2240    0.0067    1    0.1042    0.1017
    9    2    0    0   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0795    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0467    0.0467
   11   -1    0   -3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1265    0.1248
   12    2   -1   -1   -0.1788   -0.0366   -0.1829   -0.0381    0.0043    1    0.1021    0.0984
   13   -2    1   -1    0.1996   -0.0086    0.1990   -0.0092    0.0009    1    0.1022    0.0927
   14   -2    1   -3    0.5343   -0.1527    0.5293   -0.1451    0.0091    1    0.1518    0.1473
   15    1   -1   -2   -0.3327   -0.2302   -0.3362   -0.2357    0.0065    1    0.0890    0.0881
   16   -1    1    0    0.1294    0.0364    0.1275    0.0362    0.0019    1    0.0633    0.0679
   17   -1    1   -2    0.7394   -0.0849    0.7293   -0.0807    0.0109    1    0.1179    0.1198
   18   -1    1   -4    1.0723   -0.5334    1.0696   -0.4972    0.0364    1    0.2621    0.2483
   19   -1    2    1    0.0477    0.0316    0.0442    0.0295    0.0041    1    0.0988    0.0994
   20   -1    2   -1    0.4520    0.1670    0.4423    0.1634    0.0103    1    0.1210    0.1178
   21    0   -1   -1   -0.0313   -0.0522   -0.0341   -0.0579    0.0064    1    0.0440    0.0568
   22    0    2    0    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0920    0.0899
   23    1    2    1    0.0358    0.2813    0.0347    0.2716    0.0097    1    0.0819    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1   -2   -3   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3    2    2    2   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    0   -1   -3   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1   -2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6    2    1    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1   -1   -4    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8   -2   -1   -3    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    2    0    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    0   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    0   -3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2   -1   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13   -2    1   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14   -2    1   -3    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    1   -1   -2   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1    0    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    1   -2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1    1   -4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2517          0.2483
   19   -1    2    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1    2   -1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    0   -1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    0    2    0    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23    1    2    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.34                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8653    0.8728    1.4121   90.1009   90.1101  110.3296      0.3821
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8689    0.8642    1.4116   90.3313   89.7400  109.3613      0.3575         0.6155    0.6122    2.4301    2.4170    3.9481
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1040    0.1475    0.3446    5.6573    6.8432   19.5943      0.0704         0.0768    0.0466    0.5602    0.6300    1.2384
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5440   -0.4260   -1.0206)
 a2 = (    0.1663    0.7790   -0.9265)
 a3 = (    0.5962   -0.3375   -0.1792)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5386   -0.4219   -1.0100) (    0.1443    0.1141    0.1241)
 a2 = (    0.1801    0.7929   -0.9183) (    0.0534    0.2131    0.1132)
 a3 = (    0.5984   -0.3355   -0.1766) (    0.1605    0.0901    0.0221)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -121.2616  104.3986   60.3464    9.3332    5.4274    0.5794
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0057      0.0024    0.0024    0.3928

# Number of computed bands
            155            163
# Figure of merit at the beginning and the end of the refinement
         7.9512        11.7462
# Chi-squares at the beginning and the end of the refinement
    0.1071    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7335   -0.0569   -0.7310   -0.0567    0.0025    1    0.0718    0.0702
    2   -2    2   -2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1065    0.0995
    3    1   -2    3   -0.0274    0.0900   -0.0262    0.0895    0.0014    1    0.1043    0.0967
    4   -2    1   -1   -0.1976   -0.5912   -0.1957   -0.5833    0.0081    1    0.1116    0.1078
    5   -1    1   -2    0.0579   -0.2258    0.0560   -0.2234    0.0031    1    0.0690    0.0654
    6    0   -1    3   -0.1080    0.1193   -0.1085    0.1216    0.0024    1    0.0825    0.0778
    7   -2    1   -3    0.1214   -0.6005    0.1201   -0.5973    0.0034    1    0.1431    0.1302
    8   -1    1   -4    0.1455   -0.2220    0.1454   -0.2240    0.0020    1    0.1112    0.1017
    9   -1    0    3   -0.1947    0.0490   -0.1952    0.0486    0.0006    1    0.0838    0.0726
   10    0    0   -2    0.2276   -0.1289    0.2251   -0.1274    0.0029    1    0.0497    0.0467
   11   -1    0   -3    0.5359   -0.6195    0.5303   -0.6130    0.0086    1    0.1351    0.1248
   12   -2    1    3   -0.1821   -0.0370   -0.1829   -0.0381    0.0013    1    0.1074    0.0984
   13    1   -1   -4    0.2008   -0.0094    0.1990   -0.0092    0.0018    1    0.1081    0.0927
   14    0   -1   -5    0.5345   -0.1543    0.5293   -0.1451    0.0106    1    0.1616    0.1473
   15   -2    1    1   -0.3396   -0.2374   -0.3362   -0.2357    0.0037    1    0.0941    0.0881
   16    1   -1   -2    0.1289    0.0359    0.1275    0.0362    0.0015    1    0.0666    0.0679
   17    0   -1   -3    0.7384   -0.0882    0.7293   -0.0807    0.0118    1    0.1253    0.1198
   18   -1   -1   -4    1.0645   -0.5288    1.0696   -0.4972    0.0321    1    0.2774    0.2483
   19    2   -2   -2    0.0452    0.0300    0.0442    0.0295    0.0012    1    0.1035    0.0994
   20    1   -2   -3    0.4538    0.1654    0.4423    0.1634    0.0116    1    0.1277    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0462    0.0568
   22    1   -2   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.0966    0.0899
   23    1   -2    1    0.0335    0.2773    0.0347    0.2716    0.0058    1    0.0860    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2    2   -3    0.0216   -0.2070   -0.0130   -0.1762    0.0464    1          0.1125          0.0995
    3    1   -2    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -2    1   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1    1   -2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0   -1    3   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2    1   -3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8   -1    1   -4    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1    0    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    0   -2    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    0   -3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -2    1    3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13    1   -1   -4    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14    0   -1   -5    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -2    1    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1   -1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0   -1   -3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1   -1   -4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2518          0.2483
   19    2   -2   -3    0.0903    0.0392    0.0442    0.0295    0.0471    1          0.1096          0.0994
   20    1   -2   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21   -1    1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    1   -2   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23    1   -2    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.35                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8629    0.8686    1.4167   89.9705   89.8768   70.3384      0.4654
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8642    0.8689    1.4116   89.7389   89.6696   70.6418      0.3576         0.6122    0.6155    2.4169    2.4300    3.9479
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1044    0.0637    0.2762    6.8445    5.6585   19.5973      0.0871         0.0467    0.0768    0.6575    0.6184    1.2339
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1783   -0.7942    0.9230)
 a2 = (   -0.5388   -0.4199   -1.0139)
 a3 = (    0.5947   -0.3367   -0.1768)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1801   -0.7929    0.9183) (    0.0447    0.1735    0.1576)
 a2 = (   -0.5386   -0.4219   -1.0100) (    0.1193    0.0945    0.1736)
 a3 = (    0.5984   -0.3355   -0.1766) (    0.1316    0.0738    0.0305)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  129.3798  104.3994   60.3464   10.3193    5.4284    0.5794
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0058      0.0024    0.0024    0.3928

# Number of computed bands
            151            163
# Figure of merit at the beginning and the end of the refinement
         3.7968        11.7439
# Chi-squares at the beginning and the end of the refinement
    1.2182    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7346   -0.0540   -0.7310   -0.0567    0.0045    1    0.0871    0.0702
    2   -2   -2   -2   -0.0135   -0.1715   -0.0130   -0.1762    0.0047    1    0.1302    0.0995
    3    2    1    3   -0.0271    0.0920   -0.0262    0.0895    0.0027    1    0.1278    0.0967
    4   -1   -2   -1   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1350    0.1078
    5   -1   -1   -2    0.0554   -0.2216    0.0560   -0.2234    0.0018    1    0.0840    0.0654
    6    1    0    3   -0.1081    0.1214   -0.1085    0.1216    0.0004    1    0.1005    0.0778
    7   -1   -2   -3    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.1730    0.1302
    8   -1   -1   -4    0.1423   -0.2193    0.1454   -0.2240    0.0056    1    0.1350    0.1017
    9    0   -1    3   -0.1956    0.0497   -0.1952    0.0486    0.0011    1    0.1018    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0602    0.0467
   11    0   -1   -3    0.5348   -0.6141    0.5303   -0.6130    0.0046    1    0.1630    0.1248
   12   -1   -2    3   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.1307    0.0984
   13    1    1   -3    0.1745    0.0142    0.1990   -0.0092    0.0338    1    0.1051    0.0927
   14    1    0   -5    0.5310   -0.1498    0.5293   -0.1451    0.0050    1    0.1959    0.1473
   15   -1   -2    1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1143    0.0881
   16    1    1   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0814    0.0679
   17    1    0   -3    0.7317   -0.0805    0.7293   -0.0807    0.0024    1    0.1515    0.1198
   18    1   -1   -4    1.0632   -0.5123    1.0696   -0.4972    0.0164    1    0.3345    0.2483
   19    2    2   -2    0.0452    0.0302    0.0442    0.0295    0.0013    1    0.1270    0.0994
   20    2    1   -3    0.4465    0.1663    0.4423    0.1634    0.0051    1    0.1558    0.1178
   21   -1   -1    0   -0.0328   -0.0555   -0.0341   -0.0579    0.0028    1    0.0567    0.0568
   22    2    1   -1    0.2998    0.3363    0.3053    0.3413    0.0075    1    0.1183    0.0899
   23    2    1    1    0.0353    0.2749    0.0347    0.2716    0.0033    1    0.1057    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -2   -2   -3    0.0216   -0.2070   -0.0130   -0.1762    0.0464    1          0.1125          0.0995
    3    2    1    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1   -2   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1   -2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    0    3   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1   -2   -3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8   -1   -1   -4    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    0   -1    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    0   -2    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0   -1   -3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -1   -2    3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13    1    1   -4    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14    1    0   -5    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -1   -2    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1    1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1    0   -3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1   -1   -4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2517          0.2483
   19    2    2   -3    0.0903    0.0392    0.0442    0.0295    0.0471    1          0.1096          0.0994
   20    2    1   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21   -1   -1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    2    1   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23    2    1    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.36                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8610    0.8717    1.4177   90.4724   90.4672  109.9463      0.3957
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8689    0.8642    1.4116   89.6696   90.2611  109.3582      0.3576         0.6155    0.6122    2.4300    2.4169    3.9479
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1040    0.1475    0.3446    5.6585    6.8445   19.5973      0.0705         0.0768    0.0467    0.5603    0.6301    1.2386
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5602    0.4260    1.0157)
 a2 = (   -0.1541   -0.7858    0.9212)
 a3 = (    0.5943   -0.3365   -0.1767)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5386    0.4219    1.0100) (    0.1443    0.1141    0.1241)
 a2 = (   -0.1801   -0.7929    0.9183) (    0.0534    0.2131    0.1132)
 a3 = (    0.5984   -0.3355   -0.1766) (    0.1605    0.0902    0.0221)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   58.7369  104.3994   60.3464    9.3345    5.4284    0.5794
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0058      0.0024    0.0024    0.3928

# Number of computed bands
            137            163
# Figure of merit at the beginning and the end of the refinement
         7.0851        11.7439
# Chi-squares at the beginning and the end of the refinement
    0.1537    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0742    0.0702
    2    2   -2   -2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1106    0.0995
    3   -1    2    3   -0.0275    0.0903   -0.0262    0.0895    0.0015    1    0.1084    0.0967
    4    2   -1   -1   -0.2008   -0.5827   -0.1957   -0.5833    0.0051    1    0.1152    0.1078
    5    1   -1   -2    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0714    0.0654
    6    0    1    3   -0.1084    0.1195   -0.1085    0.1216    0.0021    1    0.0857    0.0778
    7    2   -1   -3    0.1148   -0.5976    0.1201   -0.5973    0.0053    1    0.1473    0.1302
    8    1   -1   -4    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1148    0.1017
    9    1    0    3   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0872    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0512    0.0467
   11    1    0   -3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1388    0.1248
   12    2   -1    3   -0.1821   -0.0374   -0.1829   -0.0381    0.0010    1    0.1118    0.0984
   13   -1    1   -4    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1116    0.0927
   14    0    1   -5    0.5334   -0.1530    0.5293   -0.1451    0.0089    1    0.1658    0.1473
   15    2   -1    1   -0.3365   -0.2343   -0.3362   -0.2357    0.0014    1    0.0978    0.0881
   16   -1    1   -2    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0690    0.0679
   17    0    1   -3    0.7393   -0.0854    0.7293   -0.0807    0.0110    1    0.1286    0.1198
   18    1    1   -4    1.0727   -0.5366    1.0696   -0.4972    0.0396    1    0.2872    0.2483
   19   -2    2   -2    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1076    0.0994
   20   -1    2   -3    0.4493    0.1674    0.4423    0.1634    0.0080    1    0.1314    0.1178
   21    1   -1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0481    0.0568
   22   -1    2   -1    0.2996    0.3402    0.3053    0.3413    0.0058    1    0.0997    0.0899
   23   -1    2    1    0.0322    0.2747    0.0347    0.2716    0.0039    1    0.0893    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    2   -2   -3    0.0216   -0.2070   -0.0130   -0.1762    0.0464    1          0.1125          0.0995
    3   -1    2    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    2   -1   -1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1   -1   -2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0    1    3   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    2   -1   -3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1317          0.1302
    8    1   -1   -4    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1    0    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    0   -2    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    0   -3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2   -1    3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13   -1    1   -4    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14    0    1   -5    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    2   -1    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0    1   -3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1    1   -4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2517          0.2483
   19   -2    2   -3    0.0903    0.0392    0.0442    0.0295    0.0471    1          0.1096          0.0994
   20   -1    2   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21    1   -1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1    2   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23   -1    2    1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.38                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8646    0.8734    1.4084   91.0020   90.9707  109.8348      0.3938
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8641    0.8689    1.4114   89.7271   90.3206  109.3245      0.3576         0.6123    0.6156    2.4167    2.4300    3.9471
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1044    0.0636    0.2764    6.8618    5.6737   19.6381      0.0875         0.0468    0.0770    0.6595    0.6206    1.2371
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2012   -0.7842    0.9258)
 a2 = (    0.5113    0.4246    1.0202)
 a3 = (   -0.5980    0.3386    0.1798)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1802   -0.7931    0.9178) (    0.0448    0.1737    0.1580)
 a2 = (    0.5387    0.4220    1.0095) (    0.1195    0.0947    0.1740)
 a3 = (   -0.5986    0.3356    0.1765) (    0.1318    0.0739    0.0305)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   50.6026   75.5911 -119.6536   10.3382    5.4412    0.5794
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0064      0.0024    0.0024    0.3938

# Number of computed bands
            161            163
# Figure of merit at the beginning and the end of the refinement
         6.6338        11.7281
# Chi-squares at the beginning and the end of the refinement
    0.1376    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0741    0.0702
    2   -2    2    2   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.1101    0.0995
    3    2   -1   -3   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.1076    0.0967
    4   -1    2    1   -0.1892   -0.5963   -0.1957   -0.5833    0.0145    1    0.1150    0.1078
    5   -1    1    2    0.0579   -0.2258    0.0560   -0.2234    0.0031    1    0.0713    0.0654
    6    1    0   -3   -0.1066    0.1204   -0.1085    0.1216    0.0022    1    0.0845    0.0778
    7   -1    2    3    0.1285   -0.5967    0.1201   -0.5973    0.0083    1    0.1477    0.1302
    8   -1    1    4    0.1455   -0.2220    0.1454   -0.2240    0.0020    1    0.1150    0.1017
    9    0    1   -3   -0.1957    0.0502   -0.1952    0.0486    0.0017    1    0.0855    0.0726
   10    0    0    2    0.2276   -0.1289    0.2251   -0.1274    0.0029    1    0.0514    0.0467
   11    0    1    3    0.5378   -0.6038    0.5303   -0.6130    0.0118    1    0.1390    0.1248
   12   -1    2   -3   -0.1829   -0.0374   -0.1829   -0.0381    0.0006    1    0.1098    0.0984
   13    1   -1    4    0.2008   -0.0094    0.1990   -0.0092    0.0018    1    0.1117    0.0927
   14    1    0    5    0.5289   -0.1506    0.5293   -0.1451    0.0055    1    0.1673    0.1473
   15   -1    2   -1   -0.3409   -0.2423   -0.3362   -0.2357    0.0081    1    0.0964    0.0881
   16    1   -1    2    0.1289    0.0359    0.1275    0.0362    0.0015    1    0.0689    0.0679
   17    1    0    3    0.7245   -0.0841    0.7293   -0.0807    0.0059    1    0.1290    0.1198
   18    1    1    4    1.0422   -0.4979    1.0696   -0.4972    0.0274    1    0.2801    0.2483
   19    2   -2    2    0.0452    0.0300    0.0442    0.0295    0.0012    1    0.1070    0.0994
   20    2   -1    3    0.4479    0.1616    0.4423    0.1634    0.0058    1    0.1326    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0478    0.0568
   22    2   -1    1    0.3044    0.3331    0.3053    0.3413    0.0083    1    0.1002    0.0899
   23    2   -1   -1    0.0372    0.2745    0.0347    0.2716    0.0038    1    0.0890    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0661          0.0702
    2   -2    2    3    0.0216   -0.2070   -0.0130   -0.1762    0.0464    1          0.1124          0.0995
    3    2   -1   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1    2    1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1027          0.1078
    5   -1    1    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6    1    0   -3   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -1    2    3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1316          0.1302
    8   -1    1    4    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1031          0.1017
    9    0    1   -3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10    0    0    2    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    0    1    3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1237          0.1248
   12   -1    2   -3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13    1   -1    4    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14    1    0    5    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1492          0.1473
   15   -1    2   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0872          0.0881
   16    1   -1    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1    0    3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1150          0.1198
   18    1    1    4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2513          0.2483
   19    2   -2    3    0.0903    0.0392    0.0442    0.0295    0.0471    1          0.1095          0.0994
   20    2   -1    3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1188          0.1178
   21   -1    1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    2   -1    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0901          0.0899
   23    2   -1   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.39                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8639    0.8694    1.4228   90.1269   90.3441  110.6227      0.3538
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8626    0.8680    1.4198   90.1458   89.5866  109.8304      0.3500         0.6075    0.6114    2.4647    2.4803    4.0570
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0978    0.2482    0.4708    1.5603    2.4027   18.0642      0.0428         0.1328    0.0299    0.4108    0.7713    1.4337
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.4123    0.1502    1.1564)
 a2 = (    0.7701   -0.5191    0.8050)
 a3 = (    0.3559    0.6037    0.0539)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.4175    0.1494    1.1499) (    0.1408    0.0525    0.0577)
 a2 = (    0.7747   -0.5189    0.7939) (    0.2590    0.1736    0.0410)
 a3 = (    0.3579    0.6049    0.0462) (    0.1195    0.2018    0.0047)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   69.2933   85.9254  149.6631    7.3063    1.7892    0.6286
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005    0.0063      0.0024    0.0024    0.3813

# Number of computed bands
            141            159
# Figure of merit at the beginning and the end of the refinement
         7.8086        11.7106
# Chi-squares at the beginning and the end of the refinement
    0.1892    0.0248
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0681    0.0702
    2    1   -1    4   -0.0143   -0.1827   -0.0130   -0.1762    0.0066    1    0.0989    0.0995
    3   -1    2   -3   -0.0264    0.0895   -0.0262    0.0895    0.0002    1    0.0964    0.0967
    4    1    0    3   -0.2020   -0.6045   -0.1957   -0.5833    0.0221    1    0.1049    0.1078
    5    1   -1    2    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0639    0.0654
    6   -1    2   -1   -0.1108    0.1243   -0.1085    0.1216    0.0036    1    0.0760    0.0778
    7    2   -1    3    0.1222   -0.6101    0.1201   -0.5973    0.0130    1    0.1335    0.1302
    8    2   -2    2    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1024    0.1017
    9   -1    2    1   -0.2066    0.0523   -0.1952    0.0486    0.0120    1    0.0774    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0455    0.0467
   11    2   -1    1    0.5434   -0.6243    0.5303   -0.6130    0.0173    1    0.1256    0.1248
   12   -1    2    3   -0.1954   -0.0403   -0.1829   -0.0381    0.0127    1    0.0995    0.0984
   13    2   -2   -2    0.1931   -0.0082    0.1990   -0.0092    0.0059    1    0.0990    0.0927
   14    3   -2   -1    0.5337   -0.1508    0.5293   -0.1451    0.0072    1    0.1483    0.1473
   15    0    1    3   -0.3520   -0.2475   -0.3362   -0.2357    0.0197    1    0.0881    0.0881
   16    1   -1   -2    0.1190    0.0338    0.1275    0.0362    0.0088    1    0.0612    0.0679
   17    2   -1   -1    0.7364   -0.0815    0.7293   -0.0807    0.0071    1    0.1151    0.1198
   18    3   -1    0    1.0763   -0.5201    1.0696   -0.4972    0.0239    1    0.2577    0.2483
   19    1   -1   -4    0.0360    0.0241    0.0442    0.0295    0.0098    1    0.0957    0.0994
   20    2   -1   -3    0.4441    0.1654    0.4423    0.1634    0.0027    1    0.1172    0.1178
   21    0    0    3   -0.0390   -0.0662   -0.0341   -0.0579    0.0096    1    0.0645    0.0568
   22    1    0   -3    0.2975    0.3339    0.3053    0.3413    0.0108    1    0.0889    0.0899
   23    0    1   -3    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.0796    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7328   -0.0562   -0.7310   -0.0567    0.0019    1          0.0661          0.0702
    2    1   -1    4   -0.0133   -0.1736   -0.0130   -0.1762    0.0026    1          0.0981          0.0995
    3   -1    2   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0961          0.0967
    4    1    0    3   -0.1959   -0.5870   -0.1957   -0.5833    0.0037    1          0.1025          0.1078
    5    1   -1    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0634          0.0654
    6   -1    2   -1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0758          0.0778
    7    2   -1    3    0.1215   -0.5966    0.1201   -0.5973    0.0015    1          0.1312          0.1302
    8    2   -2    3    0.0952   -0.2292    0.1454   -0.2240    0.0505    1          0.1132          0.1017
    9   -1    2    1   -0.1946    0.0483   -0.1952    0.0486    0.0007    1          0.0770          0.0726
   10    1   -1    0    0.2259   -0.1271    0.2251   -0.1274    0.0008    1          0.0456          0.0467
   11    2   -1    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12   -1    2    3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.0989          0.0984
   13    2   -2   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.0996          0.0927
   14    3   -2   -1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1485          0.1473
   15    0    1    3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0866          0.0881
   16    1   -1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0616          0.0679
   17    2   -1   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1150          0.1198
   18    3   -1    0    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2536          0.2483
   19    1   -1   -4    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0959          0.0994
   20    2   -1   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1180          0.1178
   21    0    0    3   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0642          0.0568
   22    1    0   -3    0.3000    0.3344    0.3053    0.3413    0.0088    1          0.0895          0.0899
   23    0    1   -3    0.0352    0.2740    0.0347    0.2716    0.0024    1          0.0797          0.0816

###            No.40                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8510    0.8741    1.4201   90.4393   91.4103  108.7379      0.4667
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8657    0.8676    1.4143   90.3849   89.9218  109.7166      0.3551         0.6121    0.6135    2.4379    2.4433    3.9827
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1520    0.2117    0.4951    8.0351    9.6471   28.0396      0.0890         0.1071    0.0669    0.7463    0.8548    1.7150
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5281   -0.4719   -1.0194)
 a2 = (    0.1816    0.7620   -0.9198)
 a3 = (    0.5935   -0.3360   -0.1764)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5401   -0.4264   -1.0159) (    0.2072    0.1660    0.1790)
 a2 = (    0.1766    0.7855   -0.9225) (    0.0741    0.3024    0.1629)
 a3 = (    0.5968   -0.3352   -0.1774) (    0.2292    0.1289    0.0315)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -121.3107  104.2846   60.3656   13.4241    7.7040    0.5869
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002    0.0014      0.0025    0.0024    0.5589

# Number of computed bands
            400            163
# Figure of merit at the beginning and the end of the refinement
         2.5422        11.6906
# Chi-squares at the beginning and the end of the refinement
    0.5936    0.0257
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7407   -0.0898   -0.7310   -0.0567    0.0345    0    0.0880    0.0702
    2   -2    2   -2   -0.0129   -0.1749   -0.0130   -0.1762    0.0013    1    0.1323    0.0995
    3    1   -2    3   -0.0264    0.0891   -0.0262    0.0895    0.0004    1    0.1274    0.0967
    4   -2    1   -1   -0.1820   -0.5770   -0.1957   -0.5833    0.0151    1    0.1373    0.1078
    5   -1    1   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0852    0.0654
    6    0   -1    3   -0.1098    0.1215   -0.1085    0.1216    0.0013    1    0.0996    0.0778
    7   -2    1   -3    0.1168   -0.5840    0.1201   -0.5973    0.0137    1    0.1755    0.1302
    8   -1    1   -4    0.1423   -0.2205    0.1454   -0.2240    0.0047    1    0.1362    0.1017
    9   -1    0    3   -0.2015    0.0468   -0.1952    0.0486    0.0065    1    0.1013    0.0726
   10    0    0   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0603    0.0467
   11   -1    0   -3    0.5160   -0.6097    0.5303   -0.6130    0.0147    1    0.1634    0.1248
   12   -2    1    3   -0.1855   -0.0429   -0.1829   -0.0381    0.0055    1    0.1313    0.0984
   13    1   -1   -4    0.1963   -0.0070    0.1990   -0.0092    0.0034    1    0.1312    0.0927
   14    0   -1   -5    0.5274   -0.1537    0.5293   -0.1451    0.0088    1    0.1962    0.1473
   15   -2    1    1   -0.3301   -0.2469   -0.3362   -0.2357    0.0128    1    0.1162    0.0881
   16    1   -1   -2    0.1227    0.0364    0.1275    0.0362    0.0048    1    0.0813    0.0679
   17    0   -1   -3    0.7271   -0.0912    0.7293   -0.0807    0.0107    1    0.1514    0.1198
   18   -1   -1   -4    1.0270   -0.5339    1.0696   -0.4972    0.0562    0    0.3308    0.2483
   19    2   -2   -2    0.0400    0.0275    0.0442    0.0295    0.0047    1    0.1276    0.0994
   20    1   -2   -3    0.4443    0.1643    0.4423    0.1634    0.0022    1    0.1551    0.1178
   21   -1    1    0   -0.0349   -0.0607   -0.0341   -0.0579    0.0028    1    0.0575    0.0568
   22    1   -2   -1    0.2984    0.3335    0.3053    0.3413    0.0104    1    0.1176    0.0899
   23    1   -2    1    0.0347    0.2716    0.0347    0.2716    0.0000    1    0.1052    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7316   -0.0589   -0.7310   -0.0567    0.0023    1          0.0666          0.0702
    2   -2    2   -3    0.0218   -0.2074   -0.0130   -0.1762    0.0467    1          0.1124          0.0995
    3    1   -2    3   -0.0269    0.0904   -0.0262    0.0895    0.0012    1          0.0971          0.0967
    4   -2    1   -1   -0.1957   -0.5859   -0.1957   -0.5833    0.0025    1          0.1034          0.1078
    5   -1    1   -2    0.0568   -0.2237    0.0560   -0.2234    0.0009    1          0.0641          0.0654
    6    0   -1    3   -0.1080    0.1199   -0.1085    0.1216    0.0018    1          0.0766          0.0778
    7   -2    1   -3    0.1204   -0.5960    0.1201   -0.5973    0.0013    1          0.1324          0.1302
    8   -1    1   -4    0.1441   -0.2202    0.1454   -0.2240    0.0040    1          0.1032          0.1017
    9   -1    0    3   -0.1950    0.0483   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    0    0   -2    0.2259   -0.1270    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    0   -3    0.5351   -0.6129    0.5303   -0.6130    0.0047    1          0.1247          0.1248
   12   -2    1    3   -0.1811   -0.0379   -0.1829   -0.0381    0.0017    1          0.1001          0.0984
   13    1   -1   -4    0.1981   -0.0084    0.1990   -0.0092    0.0011    1          0.1007          0.0927
   14    0   -1   -5    0.5299   -0.1495    0.5293   -0.1451    0.0044    1          0.1497          0.1473
   15   -2    1    1   -0.3359   -0.2364   -0.3362   -0.2357    0.0008    1          0.0876          0.0881
   16    1   -1   -2    0.1267    0.0356    0.1275    0.0362    0.0010    1          0.0623          0.0679
   17    0   -1   -3    0.7296   -0.0819    0.7293   -0.0807    0.0012    1          0.1157          0.1198
   18   -1   -1   -4    1.0580   -0.5134    1.0696   -0.4972    0.0200    1          0.2545          0.2483
   19    2   -2   -3    0.0898    0.0392    0.0442    0.0295    0.0467    1          0.1093          0.0994
   20    1   -2   -3    0.4459    0.1645    0.4423    0.1634    0.0037    1          0.1189          0.1178
   21   -1    1    0   -0.0336   -0.0573   -0.0341   -0.0579    0.0009    1          0.0433          0.0568
   22    1   -2   -1    0.3007    0.3350    0.3053    0.3413    0.0078    1          0.0901          0.0899
   23    1   -2    1    0.0351    0.2743    0.0347    0.2716    0.0027    1          0.0803          0.0816

###            No.42                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8662    0.8668    1.4100   90.6302   90.4112  109.1454      0.3506
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8682    0.8624    1.4202   89.5914   90.1481  109.8686      0.3501         0.6113    0.6072    2.4802    2.4636    4.0571
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0987    0.0530    0.2276    2.3958    1.5571   18.0170      0.0988         0.0298    0.1323    0.7546    0.7116    1.3167
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.7829    0.5152   -0.7844)
 a2 = (    0.4103   -0.1603   -1.1391)
 a3 = (   -0.3591   -0.6093   -0.0544)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.7745    0.5188   -0.7944) (    0.1252    0.0850    0.1760)
 a2 = (    0.4174   -0.1494   -1.1506) (    0.0717    0.0294    0.2548)
 a3 = (   -0.3578   -0.6047   -0.0463) (    0.0583    0.0981    0.0110)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -139.4402   94.0713  -30.3369   10.7707    1.7844    0.6286
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005    0.0071      0.0024    0.0024    0.3800

# Number of computed bands
            149            159
# Figure of merit at the beginning and the end of the refinement
         9.0262        11.6824
# Chi-squares at the beginning and the end of the refinement
    0.1326    0.0248
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7295   -0.0601   -0.7310   -0.0567    0.0037    1    0.0657    0.0702
    2    1   -1   -4   -0.0143   -0.1827   -0.0130   -0.1762    0.0066    1    0.0989    0.0995
    3   -2    1    3   -0.0242    0.0811   -0.0262    0.0895    0.0086    1    0.0960    0.0967
    4    0   -1   -3   -0.1975   -0.5887   -0.1957   -0.5833    0.0057    1    0.1031    0.1078
    5    1   -1   -2    0.0577   -0.2302    0.0560   -0.2234    0.0070    1    0.0639    0.0654
    6   -2    1    1   -0.1037    0.1154   -0.1085    0.1216    0.0078    1    0.0755    0.0778
    7    1   -2   -3    0.1183   -0.5987    0.1201   -0.5973    0.0023    1    0.1317    0.1302
    8    2   -2   -2    0.1454   -0.2240    0.1454   -0.2240    0.0000    1    0.1024    0.1017
    9   -2    1   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0770    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0455    0.0467
   11    1   -2   -1    0.5297   -0.6152    0.5303   -0.6130    0.0022    1    0.1229    0.1248
   12   -2    1   -3   -0.1861   -0.0388   -0.1829   -0.0381    0.0033    1    0.0992    0.0984
   13    2   -2    2    0.1931   -0.0082    0.1990   -0.0092    0.0059    1    0.0990    0.0927
   14    2   -3    1    0.5255   -0.1502    0.5293   -0.1451    0.0063    1    0.1466    0.1473
   15   -1    0   -3   -0.3401   -0.2399   -0.3362   -0.2357    0.0057    1    0.0872    0.0881
   16    1   -1    2    0.1190    0.0338    0.1275    0.0362    0.0088    1    0.0612    0.0679
   17    1   -2    1    0.7237   -0.0835    0.7293   -0.0807    0.0063    1    0.1128    0.1198
   18    1   -3    0    1.0504   -0.5195    1.0696   -0.4972    0.0295    1    0.2486    0.2483
   19    1   -1    4    0.0360    0.0241    0.0442    0.0295    0.0098    1    0.0957    0.0994
   20    1   -2    3    0.4366    0.1615    0.4423    0.1634    0.0061    1    0.1157    0.1178
   21    0    0   -3   -0.0390   -0.0662   -0.0341   -0.0579    0.0096    1    0.0645    0.0568
   22    0   -1    3    0.2907    0.3259    0.3053    0.3413    0.0212    1    0.0875    0.0899
   23   -1    0    3    0.0328    0.2610    0.0347    0.2716    0.0108    1    0.0787    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7328   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2    1   -1   -4   -0.0133   -0.1736   -0.0130   -0.1762    0.0026    1          0.0982          0.0995
    3   -2    1    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0962          0.0967
    4    0   -1   -3   -0.1959   -0.5870   -0.1957   -0.5833    0.0037    1          0.1026          0.1078
    5    1   -1   -2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0635          0.0654
    6   -2    1    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0759          0.0778
    7    1   -2   -3    0.1215   -0.5966    0.1201   -0.5973    0.0015    1          0.1314          0.1302
    8    2   -2   -3    0.0952   -0.2292    0.1454   -0.2240    0.0505    1          0.1133          0.1017
    9   -2    1   -1   -0.1946    0.0483   -0.1952    0.0486    0.0007    1          0.0771          0.0726
   10    1   -1    0    0.2259   -0.1271    0.2251   -0.1274    0.0008    1          0.0457          0.0467
   11    1   -2   -1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1242          0.1248
   12   -2    1   -3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.0990          0.0984
   13    2   -2    2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.0997          0.0927
   14    2   -3    1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1487          0.1473
   15   -1    0   -3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0867          0.0881
   16    1   -1    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0617          0.0679
   17    1   -2    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18    1   -3    0    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2542          0.2483
   19    1   -1    4    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0960          0.0994
   20    1   -2    3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1182          0.1178
   21    0    0   -3   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0643          0.0568
   22    0   -1    3    0.3000    0.3344    0.3053    0.3413    0.0088    1          0.0896          0.0899
   23   -1    0    3    0.0352    0.2740    0.0347    0.2716    0.0024    1          0.0797          0.0816

###            No.44                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8651    0.8665    1.4171   89.7413   89.6028   70.3004      0.5416
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8649    0.8688    1.4149   89.9706   90.1211   70.1363      0.3574         0.6113    0.6141    2.4201    2.4310    3.9588
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0787    0.0176    0.0469   14.4380   17.8792   14.5249      0.1159         0.0733    0.0270    0.8148    0.7896    1.2900
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9839   -0.1089   -0.7264)
 a2 = (   -0.9295   -0.6516   -0.4628)
 a3 = (   -0.2122    0.5653   -0.3653)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9874   -0.1068   -0.7244) (    0.1337    0.0183    0.1844)
 a2 = (   -0.9276   -0.6504   -0.4629) (    0.1260    0.0887    0.1183)
 a3 = (   -0.2091    0.5640   -0.3711) (    0.0305    0.0769    0.0948)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -136.2250  121.5932 -159.5170    8.0987    9.9950    0.5428
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0049      0.0024    0.0024    0.3917

# Number of computed bands
            161            157
# Figure of merit at the beginning and the end of the refinement
         2.3953         9.8563
# Chi-squares at the beginning and the end of the refinement
    1.2034    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7213   -0.0546   -0.7310   -0.0567    0.0100    1    0.1002    0.0702
    2   -1   -2    3   -0.0136   -0.1779   -0.0130   -0.1762    0.0018    1    0.1524    0.0995
    3    1    1   -4   -0.0247    0.0826   -0.0262    0.0895    0.0070    1    0.1488    0.0967
    4   -1   -2    1   -0.1961   -0.5850   -0.1957   -0.5833    0.0017    1    0.1578    0.1078
    5   -1   -1    2    0.0577   -0.2279    0.0560   -0.2234    0.0049    1    0.0985    0.0654
    6    1    0   -3   -0.1018    0.1134   -0.1085    0.1216    0.0106    1    0.1170    0.0778
    7   -1   -1    1    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1011    0.1302
    8   -2   -1    3    0.1463   -0.2240    0.1454   -0.2240    0.0009    1    0.1586    0.1017
    9    1   -1   -2   -0.1879    0.0472   -0.1952    0.0486    0.0074    1    0.1187    0.0726
   10   -1    0    1    0.2291   -0.1291    0.2251   -0.1274    0.0044    1    0.0707    0.0467
   11   -2   -1    1    0.5353   -0.6141    0.5303   -0.6130    0.0050    1    0.1907    0.1248
   12    1   -2   -1   -0.1773   -0.0365   -0.1829   -0.0381    0.0058    1    0.1527    0.0984
   13   -2    1    1    0.2005   -0.0085    0.1990   -0.0092    0.0017    1    0.1541    0.0927
   14   -3    0    1    0.5311   -0.1497    0.5293   -0.1451    0.0049    1    0.2292    0.1473
   15    0   -1    0   -0.3339   -0.2341   -0.3362   -0.2357    0.0029    1    0.0665    0.0881
   16   -1    1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0951    0.0679
   17   -1    0    0    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.0879    0.1198
   18   -3   -1    0    1.0587   -0.5122    1.0696   -0.4972    0.0185    1    0.3893    0.2483
   19   -1    2   -1    0.0436    0.0292    0.0442    0.0295    0.0007    1    0.1482    0.0994
   20   -2    1   -1    0.4434    0.1650    0.4423    0.1634    0.0019    1    0.1811    0.1178
   21    0   -1    1   -0.0351   -0.0595   -0.0341   -0.0579    0.0018    1    0.0662    0.0568
   22   -1    1   -2    0.2951    0.3316    0.3053    0.3413    0.0141    1    0.1368    0.0899
   23    0    1   -3    0.0331    0.2656    0.0347    0.2716    0.0063    1    0.1223    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2   -1   -2    3   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1    1   -4   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1   -2    1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5   -1   -1    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    0   -3   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -2   -2    2    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2   -1    3    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1   -1   -2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11   -2   -1    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12    1   -2   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -2    1    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -3    0    1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1494          0.1473
   15    0   -2    0   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1    0    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2    0    0    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18   -3   -1    0    1.0606   -0.5064    1.0696   -0.4972    0.0129    1          0.2522          0.2483
   19   -1    2   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20   -2    1   -1    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1    1   -2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0    1   -3    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.45                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8568    0.8716    1.4208   89.9154   87.8602   70.5941      0.2271
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8660    0.8689    1.4092   90.3091   90.2411   70.5796      0.3575         0.6145    0.6166    2.4222    2.4302    3.9416
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0349    0.1204    0.3167   21.2121   12.3444    6.5112      0.1602         0.1139    0.0543    1.0899    1.1400    1.9761
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.8137    0.9121   -0.1991)
 a2 = (   -0.3296   -0.9823   -0.6375)
 a3 = (   -0.3663   -0.2441    0.5499)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.8075    0.8996   -0.1943) (    0.0149    0.0145    0.0744)
 a2 = (   -0.3294   -0.9860   -0.6393) (    0.0135    0.0184    0.2431)
 a3 = (   -0.3892   -0.2287    0.5475) (    0.0129    0.0090    0.2081)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -165.4495   39.1708  -59.4652    2.2579   10.9469    0.7933
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            400            115
# Figure of merit at the beginning and the end of the refinement
         1.7440         9.5962
# Chi-squares at the beginning and the end of the refinement
    2.9865    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -2   -2    0   -0.7291   -0.0447   -0.7310   -0.0567    0.0121    1    0.0849    0.0702
    2    2   -3   -1    0.0104   -0.1917   -0.0130   -0.1762    0.0281    1    0.1036    0.0995
    3   -3    1    1   -0.0475    0.1078   -0.0262    0.0895    0.0281    1    0.0863    0.0967
    4    0   -3    0   -0.1957   -0.5833   -0.1957   -0.5833    0.0000    1    0.0982    0.1078
    5    2   -2    0    0.0555   -0.2172    0.0560   -0.2234    0.0062    1    0.0822    0.0654
    6   -3    0    0   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0744    0.0778
    7    2   -4    2    0.1176   -0.5943    0.1201   -0.5973    0.0040    1    0.1679    0.1302
    8    4   -2    2    0.1407   -0.2166    0.1454   -0.2240    0.0088    1    0.1316    0.1017
    9   -2   -1   -1   -0.1962    0.0505   -0.1952    0.0486    0.0021    1    0.0497    0.0726
   10    2    0    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0583    0.0467
   11    2   -2    4    0.5412   -0.6255    0.5303   -0.6130    0.0166    1    0.1590    0.1248
   12   -2   -3   -3   -0.1425   -0.0711   -0.1829   -0.0381    0.0522    1    0.0842    0.0984
   13    2    1    3    0.2006   -0.0072    0.1990   -0.0092    0.0026    1    0.0633    0.0927
   14    3    0    5    0.4474   -0.1587    0.5293   -0.1451    0.0831    1    0.1201    0.1473
   15   -2   -4   -2   -0.3357   -0.2367   -0.3362   -0.2357    0.0011    1    0.1111    0.0881
   16    2    2    4    0.1289    0.0384    0.1275    0.0362    0.0026    1    0.0785    0.0679
   17    2    0    6    0.7517   -0.0707    0.7293   -0.0807    0.0245    1    0.1478    0.1198
   18    2   -1    6    0.8822   -0.3387    1.0696   -0.4972    0.2454    0    0.1909    0.2483
   19    0    3    4    0.0329    0.0526    0.0442    0.0295    0.0257    1    0.0909    0.0994
   20    2    2    8    0.4500    0.1806    0.4423    0.1634    0.0188    1    0.1509    0.1178
   21    0   -2   -2   -0.0307   -0.0540   -0.0341   -0.0579    0.0052    1    0.0553    0.0568
   22    0    2    6    0.2903    0.3484    0.3053    0.3413    0.0166    1    0.1154    0.0899
   23   -2    2    4    0.0286    0.2746    0.0347    0.2716    0.0067    1    0.1045    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    1   -2   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -2    1    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    0   -2    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1   -1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -2    0    0   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    1   -2    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    2   -1    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -2   -1   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1    0    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -1    2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -2   -2   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    2    1    3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    2    0    4    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -1   -2   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1    1    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1    0    3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1   -1    4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    1    2    3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    1    1    4    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    0    1    3    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1    1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.46                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8746    0.8786    1.3890   90.4119   90.1082  110.4521      0.4271
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8689    0.8660    1.4092   90.2412   89.6908  109.4205      0.3575         0.6166    0.6145    2.4302    2.4222    3.9416
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0360    0.0514    0.1805   12.3445   21.2122    6.5112      0.1260         0.0543    0.1139    0.8624    0.8657    1.4780
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.3128    0.9871    0.6457)
 a2 = (   -0.7911    0.9015   -0.1927)
 a3 = (   -0.4036   -0.2282    0.5508)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.3294    0.9860    0.6393) (    0.0370    0.1058    0.1810)
 a2 = (   -0.8075    0.8996   -0.1943) (    0.0880    0.0974    0.0558)
 a3 = (   -0.3892   -0.2287    0.5475) (    0.0434    0.0261    0.1551)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  123.9701   39.1707  -59.4652    4.2284   10.9470    0.7933
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            123            115
# Figure of merit at the beginning and the end of the refinement
         4.9485         9.5962
# Chi-squares at the beginning and the end of the refinement
    0.2798    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0802    0.0702
    2    2    1   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1197    0.0995
    3   -1   -2    1   -0.0255    0.0890   -0.0262    0.0895    0.0008    1    0.1169    0.0967
    4    2    0    0   -0.1884   -0.5944   -0.1957   -0.5833    0.0133    1    0.1246    0.1078
    5    1    1    0    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0774    0.0654
    6    0   -2    0   -0.1060    0.1208   -0.1085    0.1216    0.0026    1    0.0915    0.0778
    7    2    1    1    0.1280   -0.5955    0.1201   -0.5973    0.0081    1    0.1599    0.1302
    8    1    2    1    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1245    0.1017
    9    1   -2   -1   -0.1961    0.0502   -0.1952    0.0486    0.0018    1    0.0925    0.0726
   10    0    1    1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0556    0.0467
   11    1    1    2    0.5396   -0.6012    0.5303   -0.6130    0.0150    1    0.1503    0.1248
   12    2   -2   -2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1191    0.0984
   13   -1    2    3    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1211    0.0927
   14    0    2    4    0.5278   -0.1470    0.5293   -0.1451    0.0024    1    0.1811    0.1473
   15    2   -1   -1   -0.3394   -0.2425   -0.3362   -0.2357    0.0075    1    0.1045    0.0881
   16   -1    1    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0748    0.0679
   17    0    1    3    0.7208   -0.0781    0.7293   -0.0807    0.0090    1    0.1395    0.1198
   18    1    1    4    1.0427   -0.4862    1.0696   -0.4972    0.0290    1    0.3023    0.2483
   19   -2    1    3    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1166    0.0994
   20   -1    1    4    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1439    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0521    0.0568
   22   -1    0    3    0.2998    0.3290    0.3053    0.3413    0.0135    1    0.1090    0.0899
   23   -1   -1    2    0.0380    0.2713    0.0347    0.2716    0.0034    1    0.0969    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    2    1   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -1   -2    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    2    0    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    1    1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    0   -2    0   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    2    1    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    1    2    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1   -2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    1    2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2   -2   -2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -1    2    3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    0    2    4    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    2   -1   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    0    1    3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    1    1    4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -2    1    3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1    1    4    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    0   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1    0    3    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1   -1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.47                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8764    0.8767    1.3857   90.2856   90.5860  110.0568      0.3911
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8660    0.8689    1.4092   89.6904   90.2414  109.4206      0.3575         0.6145    0.6166    2.4222    2.4302    3.9416
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0349    0.1204    0.3167   21.2125   12.3446    6.5114      0.1602         0.1139    0.0543    1.0900    1.1401    1.9762
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.7983   -0.8948    0.1939)
 a2 = (   -0.3083   -0.9806   -0.6466)
 a3 = (    0.4046    0.2288   -0.5522)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.8075   -0.8996    0.1943) (    0.0149    0.0145    0.0744)
 a2 = (   -0.3294   -0.9860   -0.6393) (    0.0135    0.0184    0.2431)
 a3 = (    0.3892    0.2287   -0.5475) (    0.0129    0.0090    0.2081)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  165.4495  140.8294  120.5348    2.2579   10.9471    0.7933
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            123            115
# Figure of merit at the beginning and the end of the refinement
         6.2262         9.5962
# Chi-squares at the beginning and the end of the refinement
    0.1843    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0736    0.0702
    2   -1   -2    1   -0.0127   -0.1764   -0.0130   -0.1762    0.0004    1    0.1090    0.0995
    3    2    1   -1   -0.0265    0.0900   -0.0262    0.0895    0.0007    1    0.1066    0.0967
    4    0   -2    0   -0.1887   -0.6000   -0.1957   -0.5833    0.0181    1    0.1140    0.1078
    5   -1   -1    0    0.0590   -0.2259    0.0560   -0.2234    0.0040    1    0.0706    0.0654
    6    2    0    0   -0.1076    0.1207   -0.1085    0.1216    0.0012    1    0.0838    0.0778
    7   -1   -2   -1    0.1336   -0.5988    0.1201   -0.5973    0.0135    1    0.1464    0.1302
    8   -2   -1   -1    0.1472   -0.2210    0.1454   -0.2240    0.0035    1    0.1138    0.1017
    9    2   -1    1   -0.1964    0.0493   -0.1952    0.0486    0.0014    1    0.0850    0.0726
   10   -1    0   -1    0.2280   -0.1262    0.2251   -0.1274    0.0031    1    0.0510    0.0467
   11   -1   -1   -2    0.5470   -0.5970    0.5303   -0.6130    0.0231    1    0.1379    0.1248
   12    2   -2    2   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1093    0.0984
   13   -2    1   -3    0.1992   -0.0078    0.1990   -0.0092    0.0013    1    0.1113    0.0927
   14   -2    0   -4    0.5274   -0.1435    0.5293   -0.1451    0.0025    1    0.1662    0.1473
   15    1   -2    1   -0.3410   -0.2427   -0.3362   -0.2357    0.0085    1    0.0957    0.0881
   16   -1    1   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0687    0.0679
   17   -1    0   -3    0.7193   -0.0745    0.7293   -0.0807    0.0118    1    0.1279    0.1198
   18   -1   -1   -4    1.0455   -0.4762    1.0696   -0.4972    0.0319    1    0.2767    0.2483
   19   -1    2   -3    0.0446    0.0298    0.0442    0.0295    0.0005    1    0.1067    0.0994
   20   -1    1   -4    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1320    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0475    0.0568
   22    0    1   -3    0.3017    0.3304    0.3053    0.3413    0.0115    1    0.0998    0.0899
   23    1    1   -2    0.0375    0.2742    0.0347    0.2716    0.0038    1    0.0884    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1   -2    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    2    1   -1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    0   -2    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5   -1   -1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    2    0    0   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1   -2   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2   -1   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    2   -1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1   -1   -2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    2   -2    2   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -2    1   -3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -2    0   -4    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    1   -2    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    0   -3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -1   -1   -4    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -1    2   -3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1    1   -4    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    0    1   -3    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1    1   -2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.49                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9894    1.0042    1.0073   92.0664   90.3187   90.8309      0.3897
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0053    1.0007    0.9941   90.1762   90.3086   90.1647      0.3535         1.0112    1.0067    2.8436    2.8307    2.8120
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0014    0.0240    0.4728    7.8106   13.3263    1.9191      0.2034         0.4824    0.4977    1.6360    1.6300    2.0991
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2542    0.9516    0.2272)
 a2 = (   -0.9505   -0.2696    0.1309)
 a3 = (    0.1476   -0.1845    0.9649)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.2379    0.9394    0.2248) (    0.0114    0.0260    0.1151)
 a2 = (   -0.9532   -0.2697    0.1312) (    0.0303    0.0112    0.0673)
 a3 = (    0.1818   -0.1810    0.9727) (    0.0224    0.0174    0.4982)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   59.9768   15.1324   45.1185    1.6930    7.7898    1.3974
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0002    0.0002    0.0072      0.0024    0.0024    0.5358

# Number of computed bands
            400            163
# Figure of merit at the beginning and the end of the refinement
         4.1190         9.3466
# Chi-squares at the beginning and the end of the refinement
    0.2340    0.0246
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7550   -0.0585   -0.7310   -0.0567    0.0240    1    0.0728    0.0702
    2    3   -1    0   -0.0106   -0.1756   -0.0130   -0.1762    0.0026    1    0.1098    0.0995
    3   -3    0    1   -0.0256    0.0856   -0.0262    0.0895    0.0039    1    0.1076    0.0967
    4    2   -1    1   -0.1766   -0.5956   -0.1957   -0.5833    0.0227    1    0.1134    0.1078
    5    2    0    0    0.0595   -0.2228    0.0560   -0.2234    0.0036    1    0.0713    0.0654
    6   -2   -1    1   -0.1036    0.1173   -0.1085    0.1216    0.0065    1    0.0843    0.0778
    7    3    0    1    0.1349   -0.5855    0.1201   -0.5973    0.0189    1    0.1460    0.1302
    8    3    1    0    0.1447   -0.2184    0.1454   -0.2240    0.0057    1    0.1149    0.1017
    9   -1   -2    1   -0.1937    0.0502   -0.1952    0.0486    0.0022    1    0.0845    0.0726
   10    1    1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0511    0.0467
   11    2    1    1    0.5322   -0.5881    0.5303   -0.6130    0.0249    1    0.1363    0.1248
   12    0   -3    1   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.1081    0.0984
   13    1    3    0    0.1992   -0.0092    0.1990   -0.0092    0.0002    1    0.1105    0.0927
   14    2    3    1    0.5222   -0.1479    0.5293   -0.1451    0.0077    1    0.1651    0.1473
   15    1   -2    1   -0.3388   -0.2467   -0.3362   -0.2357    0.0113    1    0.0948    0.0881
   16    0    2    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1    2    1    0.7150   -0.0812    0.7293   -0.0807    0.0143    1    0.1267    0.1198
   18    2    2    2    1.0246   -0.4822    1.0696   -0.4972    0.0474    0    0.2713    0.2483
   19   -1    3    0    0.0437    0.0296    0.0442    0.0295    0.0005    1    0.1056    0.0994
   20    0    3    1    0.4424    0.1625    0.4423    0.1634    0.0009    1    0.1305    0.1178
   21    1   -1    0   -0.0339   -0.0595   -0.0341   -0.0579    0.0016    1    0.0474    0.0568
   22   -1    2    1    0.2965    0.3314    0.3053    0.3413    0.0133    1    0.0987    0.0899
   23   -2    1    1    0.0335    0.2680    0.0347    0.2716    0.0039    1    0.0885    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    1   -0.7314   -0.0574   -0.7310   -0.0567    0.0008    1          0.0670          0.0702
    2    3   -1    0   -0.0132   -0.1739   -0.0130   -0.1762    0.0023    1          0.0992          0.0995
    3   -3    0    1   -0.0268    0.0904   -0.0262    0.0895    0.0011    1          0.0971          0.0967
    4    2   -1    1   -0.1960   -0.5860   -0.1957   -0.5833    0.0027    1          0.1038          0.1078
    5    2    0    0    0.0568   -0.2236    0.0560   -0.2234    0.0008    1          0.0641          0.0654
    6   -2   -1    1   -0.1078    0.1198   -0.1085    0.1216    0.0018    1          0.0766          0.0778
    7    3    0    1    0.1204   -0.5961    0.1201   -0.5973    0.0012    1          0.1329          0.1302
    8    3    1    0    0.1440   -0.2201    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1   -2    1   -0.1948    0.0485   -0.1952    0.0486    0.0004    1          0.0779          0.0726
   10    1    1    0    0.2257   -0.1270    0.2251   -0.1274    0.0007    1          0.0461          0.0467
   11    2    1    1    0.5354   -0.6130    0.5303   -0.6130    0.0050    1          0.1255          0.1248
   12    0   -3    1   -0.1811   -0.0377   -0.1829   -0.0381    0.0018    1          0.1001          0.0984
   13    1    3    0    0.1981   -0.0086    0.1990   -0.0092    0.0011    1          0.1006          0.0927
   14    2    3    1    0.5299   -0.1495    0.5293   -0.1451    0.0044    1          0.1501          0.1473
   15    1   -2    1   -0.3361   -0.2361   -0.3362   -0.2357    0.0004    1          0.0877          0.0881
   16    0    2    0    0.1267    0.0356    0.1275    0.0362    0.0010    1          0.0622          0.0679
   17    1    2    1    0.7297   -0.0816    0.7293   -0.0807    0.0009    1          0.1163          0.1198
   18    2    2    2    1.0591   -0.5128    1.0696   -0.4972    0.0189    1          0.2570          0.2483
   19   -1    3    0    0.0444    0.0292    0.0442    0.0295    0.0004    1          0.0969          0.0994
   20    0    3    1    0.4458    0.1645    0.4423    0.1634    0.0037    1          0.1192          0.1178
   21    1   -1    0   -0.0335   -0.0572   -0.0341   -0.0579    0.0010    1          0.0433          0.0568
   22   -1    2    1    0.3005    0.3350    0.3053    0.3413    0.0079    1          0.0903          0.0899
   23   -2    1    1    0.0350    0.2741    0.0347    0.2716    0.0025    1          0.0804          0.0816

###            No.50                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8599    0.8622    1.4313   89.5968   89.3012   70.4642      0.4899
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8597    0.8658    1.4161   90.7099   90.9385   71.6180      0.3601         0.6071    0.6114    2.3870    2.4040    3.9320
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0515    0.0555    0.0431   12.5431   19.2709   10.9777      0.0984         0.0521    0.0272    0.6674    0.6744    1.0805
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6382    0.7229    0.7699)
 a2 = (   -0.1504   -1.1782    0.3222)
 a3 = (    0.5618    0.0435    0.4132)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6230    0.7079    0.7833) (    0.0958    0.1084    0.1737)
 a2 = (   -0.1493   -1.1618    0.3308) (    0.0274    0.1779    0.0739)
 a3 = (    0.5633    0.0427    0.4240) (    0.0866    0.0105    0.0943)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   52.0361   54.1431   94.4546    6.8440   10.2135    0.6539
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005    0.0201      0.0024    0.0024    0.3669

# Number of computed bands
            159            145
# Figure of merit at the beginning and the end of the refinement
         3.1381         9.3078
# Chi-squares at the beginning and the end of the refinement
    0.7022    0.1707
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0905    0.0702
    2    1   -2    1   -0.0123   -0.1716   -0.0130   -0.1762    0.0046    1    0.1379    0.0995
    3   -1    2    1   -0.0258    0.0871   -0.0262    0.0895    0.0024    1    0.1352    0.0967
    4    1   -1    2   -0.1859   -0.5813   -0.1957   -0.5833    0.0100    1    0.1415    0.1078
    5    1   -1    0    0.0567   -0.2209    0.0560   -0.2234    0.0026    1    0.0892    0.0654
    6   -1    1    2   -0.1036    0.1167   -0.1085    0.1216    0.0069    1    0.1060    0.0778
    7    2   -1    1    0.1238   -0.5851    0.1201   -0.5973    0.0127    1    0.1822    0.1302
    8    2   -1   -1    0.1428   -0.2183    0.1454   -0.2240    0.0062    1    0.1436    0.1017
    9   -1    0    3   -0.1898    0.0484   -0.1952    0.0486    0.0054    1    0.1069    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0640    0.0467
   11    1    0    0    0.5283   -0.5985    0.5303   -0.6130    0.0147    1    0.0851    0.1248
   12   -1   -1    4   -0.1770   -0.0367   -0.1829   -0.0381    0.0060    1    0.1372    0.0984
   13    2    1   -3    0.1996   -0.0088    0.1990   -0.0092    0.0007    1    0.1393    0.0927
   14    3    1   -2    0.5241   -0.1485    0.5293   -0.1451    0.0062    1    0.2069    0.1473
   15    0   -1    3   -0.3313   -0.2362   -0.3362   -0.2357    0.0050    1    0.1196    0.0881
   16    1    1   -2    0.1286    0.0365    0.1275    0.0362    0.0012    1    0.0860    0.0679
   17    2    1   -1    0.7194   -0.0811    0.7293   -0.0807    0.0100    1    0.1589    0.1198
   18    3    1    0    1.0360   -0.4969    1.0696   -0.4972    0.0335    1    0.3440    0.2483
   19    1    2   -3    0.0459    0.0308    0.0442    0.0295    0.0021    1    0.1340    0.0994
   20    1    1   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0819    0.1178
   21    0   -1    1   -0.0324   -0.0556   -0.0341   -0.0579    0.0029    1    0.0599    0.0568
   22    1    2   -1    0.2966    0.3315    0.3053    0.3413    0.0131    1    0.1244    0.0899
   23    0    1    0    0.0343    0.2691    0.0347    0.2716    0.0026    1    0.0556    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7332   -0.0561   -0.7310   -0.0567    0.0023    1          0.0697          0.0702
    2    1   -2    1   -0.0134   -0.1735   -0.0130   -0.1762    0.0027    1          0.1020          0.0995
    3   -1    2    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0999          0.0967
    4    1   -1    2   -0.1957   -0.5870   -0.1957   -0.5833    0.0036    1          0.1076          0.1078
    5    1   -1    0    0.0565   -0.2234    0.0560   -0.2234    0.0006    1          0.0660          0.0654
    6   -1    1    2   -0.1078    0.1198   -0.1085    0.1216    0.0019    1          0.0788          0.0778
    7    2   -1    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1379          0.1302
    8    2   -1   -1    0.1439   -0.2202    0.1454   -0.2240    0.0040    1          0.1062          0.1017
    9   -1    0    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0801          0.0726
   10    1    0   -1    0.2259   -0.1272    0.2251   -0.1274    0.0009    1          0.0475          0.0467
   11    2    0    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1310          0.1248
   12   -1   -1    4   -0.1806   -0.0379   -0.1829   -0.0381    0.0022    1          0.1028          0.0984
   13    2    1   -3    0.1984   -0.0086    0.1990   -0.0092    0.0007    1          0.1036          0.0927
   14    3    1   -2    0.5300   -0.1482    0.5293   -0.1451    0.0032    1          0.1558          0.1473
   15    0   -1    3   -0.3360   -0.2363   -0.3362   -0.2357    0.0006    1          0.0904          0.0881
   16    1    1   -2    0.1272    0.0356    0.1275    0.0362    0.0007    1          0.0640          0.0679
   17    2    1   -1    0.7288   -0.0792    0.7293   -0.0807    0.0017    1          0.1212          0.1198
   18    3    1    0    1.0607   -0.5060    1.0696   -0.4972    0.0125    1          0.2700          0.2483
   19    1    2   -3    0.0450    0.0294    0.0442    0.0295    0.0008    1          0.0996          0.0994
   20    2    2   -2    0.4449    0.1649    0.4423    0.1634    0.0030    1          0.1236          0.1178
   21    0   -1    1   -0.0332   -0.0567   -0.0341   -0.0579    0.0016    1          0.0445          0.0568
   22    1    2   -1    0.2998    0.3343    0.3053    0.3413    0.0089    1          0.0936          0.0899
   23    0    2    0    0.0353    0.2739    0.0347    0.2716    0.0023    1          0.0830          0.0816

###            No.51                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9875    1.0057    1.0070   89.9624   89.9780   89.1504      0.5342
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9998    0.9971    1.0031   90.1106   89.8338   90.2766      0.3573         0.9967    0.9940    2.7980    2.7904    2.8072
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.3593    0.3477    1.5014    9.7485    5.6581      0.0399         0.3455    0.0204    0.3125    1.0527    1.0222
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.2012    0.1799   -0.9761)
 a2 = (    0.9484    0.2690   -0.1306)
 a3 = (    0.2352   -0.9391   -0.2212)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1797    0.1856   -0.9663) (    0.0677    0.0693    0.0254)
 a2 = (    0.9566    0.2715   -0.1307) (    0.3506    0.0997    0.0072)
 a3 = (    0.2390   -0.9419   -0.2224) (    0.0881    0.3452    0.0088)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -97.4134  103.0411   14.1025    2.9181    4.9833    0.4841
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0022      0.0024    0.0024    0.3934

# Number of computed bands
            133            169
# Figure of merit at the beginning and the end of the refinement
         2.7728         9.2965
# Chi-squares at the beginning and the end of the refinement
    3.2120    0.0299
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.1010    0.0702
    2    0    1   -2   -0.0308   -0.1383   -0.0130   -0.1762    0.0418    1    0.1041    0.0995
    3   -1    0    3   -0.0289    0.0955   -0.0262    0.0895    0.0067    1    0.1462    0.0967
    4   -1    1   -2   -0.2019   -0.5849   -0.1957   -0.5833    0.0064    1    0.1557    0.1078
    5    0    0   -1    0.0555   -0.2216    0.0560   -0.2234    0.0018    1    0.0480    0.0654
    6   -1    1    2   -0.1121    0.1238   -0.1085    0.1216    0.0043    1    0.1156    0.0778
    7   -1    0   -3    0.1147   -0.5997    0.1201   -0.5973    0.0059    1    0.1991    0.1302
    8    0   -1   -2    0.1766   -0.2003    0.1454   -0.2240    0.0392    1    0.1093    0.1017
    9   -1    2    1   -0.1992    0.0496   -0.1952    0.0486    0.0041    1    0.1176    0.0726
   10    0   -1   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0688    0.0467
   11   -1   -1   -2    0.5350   -0.6280    0.5303   -0.6130    0.0158    1    0.1884    0.1248
   12   -1    3    0   -0.1840   -0.0379   -0.1829   -0.0381    0.0011    1    0.1507    0.0984
   13    0   -2   -1    0.2186   -0.0411    0.1990   -0.0092    0.0375    1    0.1072    0.0927
   14   -1   -3   -2    0.5373   -0.1538    0.5293   -0.1451    0.0118    1    0.2247    0.1473
   15   -1    2   -1   -0.3384   -0.2356   -0.3362   -0.2357    0.0021    1    0.1321    0.0881
   16    0   -1    0    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0464    0.0679
   17   -1   -2   -1    0.7456   -0.0854    0.7293   -0.0807    0.0169    1    0.1748    0.1198
   18   -1   -1   -1    1.0823   -0.5400    1.0696   -0.4972    0.0447    1    0.1953    0.2483
   19    0   -2    1    0.0135    0.0120    0.0442    0.0295    0.0354    1    0.1022    0.0994
   20   -1   -3    0    0.4541    0.1695    0.4423    0.1634    0.0133    1    0.1784    0.1178
   21    0    1   -1   -0.0328   -0.0556   -0.0341   -0.0579    0.0027    1    0.0648    0.0568
   22   -1   -2    1    0.3042    0.3452    0.3053    0.3413    0.0040    1    0.1354    0.0899
   23   -1   -1    2    0.0335    0.2815    0.0347    0.2716    0.0099    1    0.1209    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    1    0   -0.7326   -0.0559   -0.7310   -0.0567    0.0018    1          0.0666          0.0702
    2    0    1   -3   -0.0132   -0.1731   -0.0130   -0.1762    0.0031    1          0.0995          0.0995
    3   -1    0    3   -0.0271    0.0909   -0.0262    0.0895    0.0017    1          0.0976          0.0967
    4   -1    1   -2   -0.1957   -0.5865   -0.1957   -0.5833    0.0032    1          0.1032          0.1078
    5    0    0   -2    0.0565   -0.2228    0.0560   -0.2234    0.0008    1          0.0643          0.0654
    6   -1    1    2   -0.1081    0.1201   -0.1085    0.1216    0.0015    1          0.0770          0.0778
    7   -1    0   -3    0.1213   -0.5959    0.1201   -0.5973    0.0018    1          0.1322          0.1302
    8    0   -1   -3    0.1436   -0.2196    0.1454   -0.2240    0.0048    1          0.1034          0.1017
    9   -1    2    1   -0.1950    0.0484   -0.1952    0.0486    0.0003    1          0.0782          0.0726
   10    0   -1   -1    0.2253   -0.1268    0.2251   -0.1274    0.0007    1          0.0462          0.0467
   11   -1   -1   -2    0.5372   -0.6112    0.5303   -0.6130    0.0071    1          0.1245          0.1248
   12   -1    3    0   -0.1808   -0.0378   -0.1829   -0.0381    0.0020    1          0.1004          0.0984
   13    0   -3   -1    0.1979   -0.0086    0.1990   -0.0092    0.0012    1          0.1010          0.0927
   14   -1   -3   -2    0.5294   -0.1481    0.5293   -0.1451    0.0030    1          0.1498          0.1473
   15   -1    2   -1   -0.3360   -0.2361   -0.3362   -0.2357    0.0004    1          0.0876          0.0881
   16    0   -2    0    0.1269    0.0355    0.1275    0.0362    0.0009    1          0.0625          0.0679
   17   -1   -2   -1    0.7284   -0.0792    0.7293   -0.0807    0.0017    1          0.1156          0.1198
   18   -2   -2   -2    1.0604   -0.5065    1.0696   -0.4972    0.0131    1          0.2535          0.2483
   19    0   -3    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0974          0.0994
   20   -1   -3    0    0.4448    0.1648    0.4423    0.1634    0.0028    1          0.1192          0.1178
   21    0    1   -1   -0.0331   -0.0566   -0.0341   -0.0579    0.0017    1          0.0435          0.0568
   22   -1   -2    1    0.2998    0.3345    0.3053    0.3413    0.0088    1          0.0904          0.0899
   23   -1   -1    2    0.0352    0.2742    0.0347    0.2716    0.0026    1          0.0808          0.0816

###            No.52                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9976    1.0009    1.0016   90.0451   90.1505   90.5950      0.4428
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0007    0.9965    1.0028   89.8939   89.8626   89.6956      0.3572         0.9979    0.9938    2.8018    2.7901    2.8076
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0002    0.3558    0.3443    1.4797    9.6584    5.5887      0.0387         0.3425    0.0200    0.3033    1.0409    1.0108
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1930   -0.1785    0.9674)
 a2 = (    0.9532    0.2704   -0.1295)
 a3 = (   -0.2364    0.9438    0.2241)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1791   -0.1854    0.9655) (    0.0668    0.0685    0.0251)
 a2 = (    0.9571    0.2717   -0.1309) (    0.3476    0.0988    0.0068)
 a3 = (   -0.2389    0.9422    0.2228) (    0.0873    0.3421    0.0084)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   97.3899   76.9701 -165.8970    2.8723    4.9324    0.4830
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0036      0.0024    0.0024    0.3902

# Number of computed bands
            139            169
# Figure of merit at the beginning and the end of the refinement
         4.5109         9.2914
# Chi-squares at the beginning and the end of the refinement
    0.3352    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7263   -0.0582   -0.7310   -0.0567    0.0050    1    0.0829    0.0702
    2    0    1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3    1    0   -3   -0.0270    0.0900   -0.0262    0.0895    0.0010    1    0.1213    0.0967
    4    1    1    2   -0.1981   -0.5822   -0.1957   -0.5833    0.0026    1    0.1289    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1    0.0957    0.0778
    7    1    0    3    0.1159   -0.5955    0.1201   -0.5973    0.0047    1    0.1650    0.1302
    8    0   -1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9    1    2   -1   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0973    0.0726
   10    0   -1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11    1   -1    2    0.5306   -0.6191    0.5303   -0.6130    0.0062    1    0.1552    0.1248
   12    1    3    0   -0.1818   -0.0377   -0.1829   -0.0381    0.0011    1    0.1250    0.0984
   13    0   -3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14    1   -3    2    0.5312   -0.1520    0.5293   -0.1451    0.0071    1    0.1859    0.1473
   15    1    2    1   -0.3355   -0.2352   -0.3362   -0.2357    0.0008    1    0.1094    0.0881
   16    0   -2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0773    0.0679
   17    1   -2    1    0.7342   -0.0846    0.7293   -0.0807    0.0062    1    0.1438    0.1198
   18    2   -2    2    1.0632   -0.5281    1.0696   -0.4972    0.0316    1    0.3191    0.2483
   19    0   -3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1207    0.0994
   20    1   -3    0    0.4470    0.1659    0.4423    0.1634    0.0052    1    0.1474    0.1178
   21    0    1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22    1   -2   -1    0.2993    0.3370    0.3053    0.3413    0.0074    1    0.1118    0.0899
   23    1   -1   -2    0.0336    0.2735    0.0347    0.2716    0.0022    1    0.1000    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0664          0.0702
    2    0    1    3   -0.0133   -0.1736   -0.0130   -0.1762    0.0026    1          0.0994          0.0995
    3    1    0   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0975          0.0967
    4    1    1    2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1030          0.1078
    5    0    0    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    1    0    3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1320          0.1302
    8    0   -1    3    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1    2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0007    1          0.0780          0.0726
   10    0   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    1   -1    2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1242          0.1248
   12    1    3    0   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    0   -3    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    1   -3    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1496          0.1473
   15    1    2    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0874          0.0881
   16    0   -2    0    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1   -2    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1154          0.1198
   18    2   -2    2    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2527          0.2483
   19    0   -3   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    1   -3    0    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1190          0.1178
   21    0    1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    1   -2   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0903          0.0899
   23    1   -1   -2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.53                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9996    1.0001    1.0003   89.9471   89.9533   89.9836      0.4425
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9960    1.0018    1.0023   90.1821   90.1002   89.7210      0.3575         0.9937    0.9995    2.7859    2.8022    2.8035
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0005    0.3586    0.0198    9.6973    1.4874    5.6111      0.1614         0.0200    0.3445    1.2580    1.6146    1.2672
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.9543    0.2707   -0.1297)
 a2 = (    0.1828   -0.1826    0.9659)
 a3 = (    0.2367   -0.9450   -0.2243)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.9577    0.2719   -0.1307) (    0.0068    0.0084    0.0503)
 a2 = (    0.1792   -0.1855    0.9643) (    0.0186    0.0159    0.3700)
 a3 = (    0.2391   -0.9428   -0.2225) (    0.0097    0.0157    0.0854)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   -7.6810  103.0525   14.1030    2.8235    4.9596    0.4830
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0054      0.0024    0.0024    0.3924

# Number of computed bands
            151            169
# Figure of merit at the beginning and the end of the refinement
         4.4219         9.2660
# Chi-squares at the beginning and the end of the refinement
    0.3103    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0827    0.0702
    2    1    0   -3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1241    0.0995
    3    0    1    3   -0.0264    0.0893   -0.0262    0.0895    0.0003    1    0.1214    0.0967
    4    1    1   -2   -0.1959   -0.5838   -0.1957   -0.5833    0.0005    1    0.1287    0.1078
    5    0    0   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0801    0.0654
    6    1    1    2   -0.1069    0.1196   -0.1085    0.1216    0.0025    1    0.0955    0.0778
    7    0    1   -3    0.1182   -0.5944    0.1201   -0.5973    0.0035    1    0.1648    0.1302
    8   -1    0   -3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1287    0.1017
    9    2    1    1   -0.1948    0.0490   -0.1952    0.0486    0.0006    1    0.0969    0.0726
   10   -1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1   -2    0.5320   -0.6139    0.5303   -0.6130    0.0019    1    0.1549    0.1248
   12    3    1    0   -0.1816   -0.0375   -0.1829   -0.0381    0.0013    1    0.1246    0.0984
   13   -3    0   -1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -3    1   -2    0.5293   -0.1503    0.5293   -0.1451    0.0051    1    0.1860    0.1473
   15    2    1   -1   -0.3359   -0.2361   -0.3362   -0.2357    0.0005    1    0.1090    0.0881
   16   -2    0    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -2    1   -1    0.7294   -0.0821    0.7293   -0.0807    0.0014    1    0.1436    0.1198
   18   -2    2   -2    1.0576   -0.5158    1.0696   -0.4972    0.0222    1    0.3166    0.2483
   19   -3    0    1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -3    1    0    0.4444    0.1649    0.4423    0.1634    0.0025    1    0.1476    0.1178
   21    1    0   -1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -2    1    1    0.2980    0.3339    0.3053    0.3413    0.0104    1    0.1120    0.0899
   23   -1    1    2    0.0346    0.2717    0.0347    0.2716    0.0001    1    0.1002    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    1    0   -3   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    0    1    3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1    1   -2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5    0    0   -2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    1    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0    1   -3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -1    0   -3    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    2    1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10   -1    0   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    1   -2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    3    1    0   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -3    0   -1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -3    1   -2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    2    1   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -2    0    0    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2    1   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -2    2   -2    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -3    0    1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -3    1    0    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    0   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -2    1    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1    1    2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.54                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9963    1.0016    1.0022   89.9524   89.8587   89.8456      0.3967
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0018    1.0023    0.9960   90.1001   89.7214   90.1828      0.3575         1.0059    1.0063    2.8022    2.8034    2.7858
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.3454    0.3569    1.4875    5.6113    9.6978      0.0392         0.3605    0.0203    0.3072    1.0137    1.0440
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1809   -0.1822    0.9704)
 a2 = (    0.2364   -0.9438   -0.2241)
 a3 = (    0.9519    0.2700   -0.1293)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1792   -0.1855    0.9643) (    0.0671    0.0688    0.0253)
 a2 = (    0.2391   -0.9428   -0.2225) (    0.0877    0.3436    0.0085)
 a3 = (    0.9577    0.2719   -0.1307) (    0.3491    0.0992    0.0068)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  103.1711   97.1874  105.8820    4.9232    2.9216    0.6567
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            147            169
# Figure of merit at the beginning and the end of the refinement
         6.6485         9.2654
# Chi-squares at the beginning and the end of the refinement
    0.1044    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7380   -0.0572   -0.7310   -0.0567    0.0070    1    0.0746    0.0702
    2    0   -3    1   -0.0136   -0.1740   -0.0130   -0.1762    0.0023    1    0.1110    0.0995
    3    1    3    0   -0.0269    0.0910   -0.0262    0.0895    0.0017    1    0.1087    0.0967
    4    1   -2    1   -0.1961   -0.5871   -0.1957   -0.5833    0.0038    1    0.1156    0.1078
    5    0   -2    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0717    0.0654
    6    1    2    1   -0.1085    0.1216   -0.1085    0.1216    0.0000    1    0.0856    0.0778
    7    1   -3    0    0.1189   -0.5963    0.1201   -0.5973    0.0016    1    0.1479    0.1302
    8    0   -3   -1    0.1428   -0.2203    0.1454   -0.2240    0.0045    1    0.1151    0.1017
    9    1    1    2   -0.1975    0.0499   -0.1952    0.0486    0.0026    1    0.0868    0.0726
   10    0   -1   -1    0.2250   -0.1276    0.2251   -0.1274    0.0002    1    0.0513    0.0467
   11    1   -2   -1    0.5336   -0.6159    0.5303   -0.6130    0.0044    1    0.1392    0.1248
   12    1    0    3   -0.1839   -0.0380   -0.1829   -0.0381    0.0011    1    0.1115    0.0984
   13    0   -1   -3    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1119    0.0927
   14    1   -2   -3    0.5309   -0.1511    0.5293   -0.1451    0.0062    1    0.1667    0.1473
   15    1   -1    2   -0.3385   -0.2384   -0.3362   -0.2357    0.0035    1    0.0978    0.0881
   16    0    0   -2    0.1257    0.0357    0.1275    0.0362    0.0018    1    0.0692    0.0679
   17    1   -1   -2    0.7323   -0.0828    0.7293   -0.0807    0.0036    1    0.1290    0.1198
   18    2   -2   -2    1.0613   -0.5180    1.0696   -0.4972    0.0224    1    0.2849    0.2483
   19    0    1   -3    0.0432    0.0289    0.0442    0.0295    0.0012    1    0.1080    0.0994
   20    1    0   -3    0.4464    0.1656    0.4423    0.1634    0.0046    1    0.1323    0.1178
   21    0   -1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0483    0.0568
   22    1    1   -2    0.2997    0.3359    0.3053    0.3413    0.0079    1    0.1004    0.0899
   23    1    2   -1    0.0349    0.2740    0.0347    0.2716    0.0024    1    0.0898    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    0   -3    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1    3    0   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1   -2    1   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    0   -2    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6    1    2    1   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    1   -3    0    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    0   -3   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    1    1    2   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0   -1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -2   -1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    1    0    3   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    0   -1   -3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    1   -2   -3    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    1   -1    2   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    0    0   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1   -1   -2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    2   -2   -2    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    0    1   -3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    1    0   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    1    1   -2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1    2   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.55                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9839    1.0078    1.0085   89.9502   89.6990   89.4065      0.4460
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0018    0.9960    1.0023   90.1001   90.1828   89.7215      0.3575         0.9996    0.9937    2.8022    2.7858    2.8034
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0001    0.3569    0.3454    1.4875    9.6978    5.6113      0.0392         0.3445    0.0200    0.3072    1.0440    1.0137
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.1750    0.1842   -0.9842)
 a2 = (   -0.9466   -0.2685    0.1286)
 a3 = (   -0.2348    0.9373    0.2225)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.1792    0.1855   -0.9643) (    0.0671    0.0688    0.0253)
 a2 = (   -0.9577   -0.2719    0.1307) (    0.3491    0.0992    0.0068)
 a3 = (   -0.2391    0.9428    0.2225) (    0.0877    0.3436    0.0085)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -82.5975   76.9471 -165.8970    2.8867    4.9600    0.4830
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            151            169
# Figure of merit at the beginning and the end of the refinement
         4.0522         9.2654
# Chi-squares at the beginning and the end of the refinement
    0.4304    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7585   -0.0570   -0.7310   -0.0567    0.0275    1    0.0855    0.0702
    2    0   -1    3   -0.0137   -0.1739   -0.0130   -0.1762    0.0024    1    0.1240    0.0995
    3   -1    0   -3   -0.0286    0.0973   -0.0262    0.0895    0.0082    1    0.1217    0.0967
    4   -1   -1    2   -0.1989   -0.5977   -0.1957   -0.5833    0.0147    1    0.1308    0.1078
    5    0    0    2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0800    0.0654
    6   -1   -1   -2   -0.1139    0.1281   -0.1085    0.1216    0.0085    1    0.0959    0.0778
    7   -1    0    3    0.1217   -0.6040    0.1201   -0.5973    0.0069    1    0.1669    0.1302
    8    0    1    3    0.1430   -0.2202    0.1454   -0.2240    0.0045    1    0.1286    0.1017
    9   -1   -2   -1   -0.2058    0.0522   -0.1952    0.0486    0.0112    1    0.0973    0.0726
   10    0    1    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0573    0.0467
   11   -1    1    2    0.5428   -0.6218    0.5303   -0.6130    0.0152    1    0.1580    0.1248
   12   -1   -3    0   -0.1904   -0.0392   -0.1829   -0.0381    0.0076    1    0.1249    0.0984
   13    0    3    1    0.1975   -0.0085    0.1990   -0.0092    0.0016    1    0.1251    0.0927
   14   -1    3    2    0.5364   -0.1514    0.5293   -0.1451    0.0095    1    0.1879    0.1473
   15   -1   -2    1   -0.3463   -0.2437   -0.3362   -0.2357    0.0129    1    0.1101    0.0881
   16    0    2    0    0.1258    0.0357    0.1275    0.0362    0.0018    1    0.0774    0.0679
   17   -1    2    1    0.7405   -0.0820    0.7293   -0.0807    0.0113    1    0.1463    0.1198
   18   -2    2    2    1.0771   -0.5187    1.0696   -0.4972    0.0228    1    0.3268    0.2483
   19    0    3   -1    0.0433    0.0290    0.0442    0.0295    0.0010    1    0.1208    0.0994
   20   -1    3    0    0.4518    0.1678    0.4423    0.1634    0.0105    1    0.1493    0.1178
   21    0   -1    1   -0.0341   -0.0577   -0.0341   -0.0579    0.0002    1    0.0540    0.0568
   22   -1    2   -1    0.3053    0.3413    0.3053    0.3413    0.0000    1    0.1136    0.0899
   23   -1    1   -2    0.0366    0.2822    0.0347    0.2716    0.0107    1    0.1012    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1   -1    0   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    0   -1    3   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -1    0   -3   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4   -1   -1    2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    0    0    2    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1   -1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7   -1    0    3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    0    1    3    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1   -2   -1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0    1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -1    1    2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -1   -3    0   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    0    3    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -1    3    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -1   -2    1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    0    2    0    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1    2    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18   -2    2    2    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    0    3   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -1    3    0    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1    2   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -1    1   -2    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.57                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8664    0.8693    1.4109   89.8164   89.8176   70.2181      0.5436
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8648    0.8643    1.4160   89.8915   89.6854   70.8858      0.3569         0.6107    0.6104    2.4233    2.4220    3.9680
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0619    0.0507    0.0354   13.3039   20.1147   11.5897      0.1087         0.0547    0.0283    0.7581    0.7511    1.2124
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.6234    0.7206    0.7723)
 a2 = (   -0.1453   -1.1713    0.3185)
 a3 = (    0.5712    0.0443    0.4172)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.6280    0.7138    0.7708) (    0.0976    0.1104    0.1812)
 a2 = (   -0.1501   -1.1709    0.3253) (    0.0277    0.1810    0.0771)
 a3 = (    0.5682    0.0432    0.4172) (    0.0883    0.0106    0.0984)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   51.5830   53.4912   94.4662    7.0280   10.6990    0.6538
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0040      0.0024    0.0024    0.3911

# Number of computed bands
            141            157
# Figure of merit at the beginning and the end of the refinement
         2.5209         9.2167
# Chi-squares at the beginning and the end of the refinement
    1.1926    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7261   -0.0563   -0.7310   -0.0567    0.0049    1    0.0507    0.0702
    2    1   -2    1   -0.0136   -0.1768   -0.0130   -0.1762    0.0008    1    0.1529    0.0995
    3   -1    2    1   -0.0257    0.0857   -0.0262    0.0895    0.0038    1    0.1493    0.0967
    4    1   -1    2   -0.1961   -0.5848   -0.1957   -0.5833    0.0015    1    0.1586    0.1078
    5    1   -1    0    0.0570   -0.2255    0.0560   -0.2234    0.0024    1    0.0987    0.0654
    6   -1    1    2   -0.1049    0.1168   -0.1085    0.1216    0.0059    1    0.1176    0.0778
    7    2   -1    1    0.1188   -0.5949    0.1201   -0.5973    0.0028    1    0.2033    0.1302
    8    2   -1   -1    0.1440   -0.2212    0.1454   -0.2240    0.0031    1    0.1588    0.1017
    9   -1    0    3   -0.1929    0.0485   -0.1952    0.0486    0.0023    1    0.1195    0.0726
   10    1    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0707    0.0467
   11    1    0    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.0950    0.1248
   12   -1   -1    4   -0.1817   -0.0373   -0.1829   -0.0381    0.0014    1    0.1536    0.0984
   13    2    1   -3    0.1965   -0.0087    0.1990   -0.0092    0.0025    1    0.1541    0.0927
   14    3    1   -2    0.5273   -0.1506    0.5293   -0.1451    0.0058    1    0.2289    0.1473
   15    0   -1    3   -0.3365   -0.2360   -0.3362   -0.2357    0.0004    1    0.1343    0.0881
   16    1    1   -2    0.1242    0.0351    0.1275    0.0362    0.0034    1    0.0951    0.0679
   17    2    1   -1    0.7269   -0.0835    0.7293   -0.0807    0.0038    1    0.1761    0.1198
   18    3    1    0    1.0532   -0.5176    1.0696   -0.4972    0.0262    1    0.3891    0.2483
   19    1    2   -3    0.0415    0.0277    0.0442    0.0295    0.0033    1    0.1485    0.0994
   20    1    1   -1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0902    0.1178
   21    0   -1    1   -0.0355   -0.0603   -0.0341   -0.0579    0.0028    1    0.0664    0.0568
   22    1    2   -1    0.2957    0.3318    0.3053    0.3413    0.0135    1    0.1369    0.0899
   23    0    1    0    0.0332    0.2678    0.0347    0.2716    0.0041    1    0.0613    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2    1   -2    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3   -1    2    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0973          0.0967
    4    1   -1    2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5    1   -1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6   -1    1    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7    2   -1    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    2   -1   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1031          0.1017
    9   -1    0    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10    1    0   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    2    0    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12   -1   -1    4   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13    2    1   -3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14    3    1   -2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0   -1    3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    1    1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    2    1   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18    3    1    0    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2523          0.2483
   19    1    2   -3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    2    2   -2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22    1    2   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0    2    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.58                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8667    0.8683    1.4101   89.8717   89.9422   70.4579      0.5606
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8648    0.8643    1.4160   90.1089   90.3152   70.8854      0.3569         0.6107    0.6104    2.4232    2.4220    3.9680
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0619    0.0507    0.0354   13.3043   20.1151   11.5900      0.1087         0.0547    0.0283    0.7581    0.7512    1.2125
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6223   -0.7193   -0.7710)
 a2 = (    0.1450    1.1692   -0.3246)
 a3 = (    0.5702    0.0442    0.4193)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6280   -0.7138   -0.7707) (    0.0976    0.1104    0.1812)
 a2 = (    0.1501    1.1709   -0.3253) (    0.0277    0.1810    0.0771)
 a3 = (    0.5682    0.0432    0.4172) (    0.0883    0.0106    0.0984)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -128.4172   53.4909   94.4662    7.0281   10.6992    0.6538
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0040      0.0024    0.0024    0.3911

# Number of computed bands
            141            157
# Figure of merit at the beginning and the end of the refinement
         2.3593         9.2167
# Chi-squares at the beginning and the end of the refinement
    1.3723    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0525    0.0702
    2   -1    2    1   -0.0133   -0.1734   -0.0130   -0.1762    0.0028    1    0.1571    0.0995
    3    1   -2    1   -0.0271    0.0906   -0.0262    0.0895    0.0015    1    0.1540    0.0967
    4   -1    1    2   -0.1960   -0.5843   -0.1957   -0.5833    0.0010    1    0.1632    0.1078
    5   -1    1    0    0.0561   -0.2222    0.0560   -0.2234    0.0012    1    0.1014    0.0654
    6    1   -1    2   -0.1083    0.1206   -0.1085    0.1216    0.0010    1    0.1214    0.0778
    7   -2    1    1    0.1185   -0.5935    0.1201   -0.5973    0.0042    1    0.2090    0.1302
    8   -2    1   -1    0.1424   -0.2186    0.1454   -0.2240    0.0062    1    0.1631    0.1017
    9    1    0    3   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1232    0.0726
   10   -1    0   -1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0726    0.0467
   11   -1    0    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.0978    0.1248
   12    1    1    4   -0.1831   -0.0376   -0.1829   -0.0381    0.0005    1    0.1582    0.0984
   13   -2   -1   -3    0.1959   -0.0086    0.1990   -0.0092    0.0031    1    0.1586    0.0927
   14   -3   -1   -2    0.5276   -0.1507    0.5293   -0.1451    0.0058    1    0.2358    0.1473
   15    0    1    3   -0.3371   -0.2365   -0.3362   -0.2357    0.0012    1    0.1384    0.0881
   16   -1   -1   -2    0.1248    0.0352    0.1275    0.0362    0.0029    1    0.0980    0.0679
   17   -2   -1   -1    0.7288   -0.0838    0.7293   -0.0807    0.0031    1    0.1819    0.1198
   18   -3   -1    0    1.0559   -0.5189    1.0696   -0.4972    0.0257    1    0.4026    0.2483
   19   -1   -2   -3    0.0428    0.0286    0.0442    0.0295    0.0017    1    0.1529    0.0994
   20   -1   -1   -1    0.4449    0.1643    0.4423    0.1634    0.0027    1    0.0932    0.1178
   21    0    1    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0683    0.0568
   22   -1   -2   -1    0.2989    0.3353    0.3053    0.3413    0.0088    1    0.1417    0.0899
   23    0   -1    0    0.0339    0.2734    0.0347    0.2716    0.0019    1    0.0633    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0    2   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2   -1    2    1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3    1   -2    1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0973          0.0967
    4   -1    1    2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5   -1    1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6    1   -1    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -2    1    1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2    1   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1031          0.1017
    9    1    0    3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    0   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -2    0    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12    1    1    4   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13   -2   -1   -3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14   -3   -1   -2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0    1    3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1   -1   -2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2   -1   -1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18   -3   -1    0    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2523          0.2483
   19   -1   -2   -3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2   -2   -2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0    1    1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1   -2   -1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0   -2    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.59                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8645    0.8684    1.4141   90.3003   90.0886  109.6013      0.5219
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8648    0.8643    1.4160   90.1090   89.6847  109.1146      0.3569         0.6107    0.6104    2.4232    2.4220    3.9680
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0619    0.0507    0.0354   13.3043   20.1151   11.5900      0.1087         0.0547    0.0283    0.7581    0.7512    1.2125
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.6241   -0.7214   -0.7732)
 a2 = (   -0.1494   -1.1703    0.3200)
 a3 = (   -0.5679   -0.0466   -0.4189)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.6280   -0.7138   -0.7707) (    0.0976    0.1104    0.1812)
 a2 = (   -0.1501   -1.1709    0.3253) (    0.0277    0.1810    0.0771)
 a3 = (   -0.5682   -0.0432   -0.4172) (    0.0883    0.0106    0.0984)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -51.5828  126.5091  -85.5338    7.0281   10.6992    0.6538
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0040      0.0024    0.0024    0.3911

# Number of computed bands
            147            157
# Figure of merit at the beginning and the end of the refinement
         2.7487         9.2167
# Chi-squares at the beginning and the end of the refinement
    0.9580    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7327   -0.0601   -0.7310   -0.0567    0.0038    1    0.0488    0.0702
    2   -1   -2   -1   -0.0138   -0.1765   -0.0130   -0.1762    0.0008    1    0.1468    0.0995
    3    1    2   -1   -0.0258    0.0871   -0.0262    0.0895    0.0024    1    0.1431    0.0967
    4   -1   -1   -2   -0.1950   -0.5855   -0.1957   -0.5833    0.0023    1    0.1525    0.1078
    5   -1   -1    0    0.0566   -0.2254    0.0560   -0.2234    0.0021    1    0.0947    0.0654
    6    1    1   -2   -0.1063    0.1187   -0.1085    0.1216    0.0036    1    0.1125    0.0778
    7   -2   -1   -1    0.1188   -0.5949    0.1201   -0.5973    0.0028    1    0.1954    0.1302
    8   -2   -1    1    0.1437   -0.2213    0.1454   -0.2240    0.0032    1    0.1522    0.1017
    9    1    0   -3   -0.1955    0.0489   -0.1952    0.0486    0.0004    1    0.1143    0.0726
   10   -1    0    1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0677    0.0467
   11   -1    0    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.0913    0.1248
   12    1   -1   -4   -0.1833   -0.0382   -0.1829   -0.0381    0.0004    1    0.1472    0.0984
   13   -2    1    3    0.1963   -0.0084    0.1990   -0.0092    0.0028    1    0.1477    0.0927
   14   -3    1    2    0.5277   -0.1505    0.5293   -0.1451    0.0056    1    0.2197    0.1473
   15    0   -1   -3   -0.3370   -0.2383   -0.3362   -0.2357    0.0027    1    0.1290    0.0881
   16   -1    1    2    0.1238    0.0352    0.1275    0.0362    0.0038    1    0.0913    0.0679
   17   -2    1    1    0.7269   -0.0835    0.7293   -0.0807    0.0038    1    0.1692    0.1198
   18   -3    1    0    1.0515   -0.5169    1.0696   -0.4972    0.0268    1    0.3733    0.2483
   19   -1    2    3    0.0412    0.0276    0.0442    0.0295    0.0036    1    0.1426    0.0994
   20   -1    1    1    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.0867    0.1178
   21    0   -1   -1   -0.0355   -0.0603   -0.0341   -0.0579    0.0028    1    0.0638    0.0568
   22   -1    2    1    0.2966    0.3315    0.3053    0.3413    0.0131    1    0.1316    0.0899
   23    0    1    0    0.0343    0.2691    0.0347    0.2716    0.0026    1    0.0588    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2   -1   -2   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0993          0.0995
    3    1    2   -1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0973          0.0967
    4   -1   -1   -2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5   -1   -1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0641          0.0654
    6    1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0767          0.0778
    7   -2   -1   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8   -2   -1    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1031          0.1017
    9    1    0   -3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0779          0.0726
   10   -1    0    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11   -2    0    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12    1   -1   -4   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1001          0.0984
   13   -2    1    3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1008          0.0927
   14   -3    1    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    0   -1   -3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1    1    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -2    1    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18   -3    1    0    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2523          0.2483
   19   -1    2    3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20   -2    2    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    0   -1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0433          0.0568
   22   -1    2    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    0    2    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.61                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8640    0.8688    1.4137   89.9695   89.8642   70.4579      0.5964
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8643    0.8649    1.4161   89.6448   89.8644   70.8626      0.3574         0.6103    0.6108    2.4182    2.4201    3.9621
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0608    0.1719    0.1599   20.1301   13.3209   11.6027      0.1536         0.0284    0.0548    1.0528    1.1457    1.7602
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1501    1.1754   -0.3231)
 a2 = (    0.6208   -0.7175   -0.7691)
 a3 = (   -0.5688   -0.0441   -0.4183)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1501    1.1712   -0.3252) (    0.0153    0.0322    0.1180)
 a2 = (    0.6282   -0.7140   -0.7704) (    0.0234    0.0243    0.2788)
 a3 = (   -0.5683   -0.0432   -0.4170) (    0.0216    0.0086    0.1511)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -160.7059  126.5307  -85.5339    4.5133   10.7085    0.6538
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0048      0.0024    0.0024    0.3916

# Number of computed bands
            133            157
# Figure of merit at the beginning and the end of the refinement
         2.1132         9.2120
# Chi-squares at the beginning and the end of the refinement
    2.1651    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -1   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0557    0.0702
    2    2   -1   -1   -0.0138   -0.1728   -0.0130   -0.1762    0.0035    1    0.1678    0.0995
    3   -2    1   -1   -0.0264    0.0899   -0.0262    0.0895    0.0005    1    0.1642    0.0967
    4    1   -1   -2   -0.1957   -0.5815   -0.1957   -0.5833    0.0018    1    0.1735    0.1078
    5    1   -1    0    0.0552   -0.2219    0.0560   -0.2234    0.0017    1    0.1080    0.0654
    6   -1    1   -2   -0.1075    0.1206   -0.1085    0.1216    0.0013    1    0.1290    0.0778
    7    1   -2   -1    0.1166   -0.5923    0.1201   -0.5973    0.0061    1    0.2222    0.1302
    8    1   -2    1    0.1416   -0.2189    0.1454   -0.2240    0.0064    1    0.1734    0.1017
    9    0    1   -3   -0.1963    0.0494   -0.1952    0.0486    0.0014    1    0.1308    0.0726
   10    0   -1    1    0.2233   -0.1264    0.2251   -0.1274    0.0021    1    0.0771    0.0467
   11    0   -1    0    0.5303   -0.6130    0.5303   -0.6130    0.0000    1    0.1038    0.1248
   12    1    1   -4   -0.1828   -0.0381   -0.1829   -0.0381    0.0000    1    0.1684    0.0984
   13   -1   -2    3    0.1954   -0.0080    0.1990   -0.0092    0.0037    1    0.1686    0.0927
   14   -1   -3    2    0.5274   -0.1489    0.5293   -0.1451    0.0042    1    0.2504    0.1473
   15    1    0   -3   -0.3355   -0.2363   -0.3362   -0.2357    0.0010    1    0.1473    0.0881
   16   -1   -1    2    0.1238    0.0354    0.1275    0.0362    0.0038    1    0.1044    0.0679
   17   -1   -2    1    0.7273   -0.0800    0.7293   -0.0807    0.0022    1    0.1930    0.1198
   18   -1   -3    0    1.0577   -0.5136    1.0696   -0.4972    0.0203    1    0.4277    0.2483
   19    1   -1    1    0.0064   -0.0114    0.0442    0.0295    0.0557    1    0.1088    0.0994
   20   -1   -1    1    0.4411    0.1653    0.4423    0.1634    0.0023    1    0.0991    0.1178
   21    1    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0731    0.0568
   22   -2   -1    1    0.2951    0.3323    0.3053    0.3413    0.0136    1    0.1510    0.0899
   23   -1    0    0    0.0345    0.2705    0.0347    0.2716    0.0012    1    0.0676    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0663          0.0702
    2    2   -1   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -2    1   -1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    1   -1   -2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5    1   -1    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1    1   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    1   -2   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1319          0.1302
    8    1   -2    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9    0    1   -3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    0   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0462          0.0467
   11    0   -2    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1240          0.1248
   12    1    1   -4   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13   -1   -2    3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14   -1   -3    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1494          0.1473
   15    1    0   -3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16   -1   -1    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17   -1   -2    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18   -1   -3    0    1.0606   -0.5064    1.0696   -0.4972    0.0129    1          0.2522          0.2483
   19   -2   -1    3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20   -2   -2    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    0   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -2   -1    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -2    0    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.66                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8737    0.8751    1.4353  107.2161  106.5990   90.1256      0.4073
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8701    0.8756    1.4497  107.7183  107.1665   90.1002      0.3123         0.6002    0.6040    2.7859    2.8036    4.6418
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0083    0.0161    0.5251    3.2724    1.5034    1.4873      0.1391         0.2214    0.2145    1.2410    1.2497    2.6648
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.1546   -0.2404   -0.2203)
 a2 = (   -0.3360    1.1484   -0.1119)
 a3 = (   -0.1256    0.1387   -0.7413)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.1646   -0.2404   -0.2183) (    0.0150    0.0107    0.0828)
 a2 = (   -0.3420    1.1500   -0.1133) (    0.0137    0.0272    0.0435)
 a3 = (   -0.1368    0.1416   -0.7359) (    0.0134    0.0125    0.2777)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -112.8832  168.6978   78.3760    1.7943    4.3147    1.7646
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0054      0.0024    0.0024    0.3924

# Number of computed bands
            235            313
# Figure of merit at the beginning and the end of the refinement
         2.8598         5.5491
# Chi-squares at the beginning and the end of the refinement
    0.3912    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7464   -0.0593   -0.7310   -0.0567    0.0156    1    0.0877    0.0702
    2   -1    3   -1   -0.0135   -0.1755   -0.0130   -0.1762    0.0008    1    0.1305    0.0995
    3    0   -2    0   -0.0263    0.0897   -0.0262    0.0895    0.0003    1    0.0849    0.0967
    4   -1    2   -2   -0.1923   -0.5922   -0.1957   -0.5833    0.0095    1    0.1361    0.1078
    5    0    2   -1    0.0571   -0.2254    0.0560   -0.2234    0.0023    1    0.0843    0.0654
    6   -1   -2    0   -0.1072    0.1207   -0.1085    0.1216    0.0015    1    0.1001    0.0778
    7    0    2   -2    0.1245   -0.5974    0.1201   -0.5973    0.0044    1    0.1162    0.1302
    8    1    3   -2    0.1449   -0.2219    0.1454   -0.2240    0.0021    1    0.1357    0.1017
    9   -2   -1    0   -0.1963    0.0496   -0.1952    0.0486    0.0015    1    0.1015    0.0726
   10    1    1   -1    0.2275   -0.1282    0.2251   -0.1274    0.0025    1    0.0605    0.0467
   11    1    2   -3    0.5384   -0.6092    0.5303   -0.6130    0.0090    1    0.1644    0.1248
   12   -2    0    0   -0.1829   -0.0381   -0.1829   -0.0381    0.0000    1    0.0869    0.0984
   13    3    1   -2    0.1997   -0.0084    0.1990   -0.0092    0.0010    1    0.1320    0.0927
   14    3    2   -4    0.5307   -0.1491    0.5293   -0.1451    0.0043    1    0.1975    0.1473
   15   -2    1   -1   -0.3389   -0.2407   -0.3362   -0.2357    0.0056    1    0.1145    0.0881
   16    2    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0816    0.0679
   17    2    1   -3    0.7279   -0.0808    0.7293   -0.0807    0.0014    1    0.1524    0.1198
   18    2    2   -5    1.0531   -0.5024    1.0696   -0.4972    0.0173    1    0.3340    0.2483
   19    3   -1   -1    0.0443    0.0296    0.0442    0.0295    0.0001    1    0.1271    0.0994
   20    2    0   -2    0.4459    0.1642    0.4423    0.1634    0.0036    1    0.1042    0.1178
   21   -1    1    0   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    2   -1   -2    0.3011    0.3334    0.3053    0.3413    0.0090    1    0.1186    0.0899
   23    1   -2   -1    0.0365    0.2735    0.0347    0.2716    0.0026    1    0.1056    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0   -1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1    3   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1   -4    0   -0.0020    0.0482   -0.0262    0.0895    0.0479    1          0.1300          0.0967
    4   -1    2   -2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5    0    2   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1   -2    0   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0    3   -3    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    1    3   -2    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -2   -1    0   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1    1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1    2   -3    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -4    1    0   -0.1427   -0.0704   -0.1829   -0.0381    0.0515    1          0.1333          0.0984
   13    3    1   -2    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    3    2   -4    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -2    1   -1   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    2    0   -1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    2    1   -3    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    2    2   -5    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    3   -1   -1    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    3    0   -3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1    1    0   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    2   -1   -2    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1   -2   -1    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.68                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8724    0.8750    1.4456   72.3990   72.8015   89.9620      0.4295
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8700    0.8755    1.4477   72.5445   72.7450   89.9003      0.3124         0.6010    0.6048    2.7851    2.8027    4.6344
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0083    0.0161    0.3862   14.3252    1.1870    1.4879      0.1392         0.1643    0.1569    1.2412    1.2498    2.4066
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.1613   -0.2363   -0.2214)
 a2 = (    0.2029   -1.0087   -0.6269)
 a3 = (    0.1342   -0.1431    0.7377)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.1647   -0.2404   -0.2183) (    0.0150    0.0107    0.0828)
 a2 = (    0.2053   -1.0085   -0.6226) (    0.0126    0.0217    0.2349)
 a3 = (    0.1368   -0.1416    0.7358) (    0.0134    0.0125    0.2777)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -160.2430   32.2804   -5.2277    2.1365   10.0962    0.6866
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0056      0.0024    0.0024    0.3926

# Number of computed bands
            237            313
# Figure of merit at the beginning and the end of the refinement
         2.5120         5.5485
# Chi-squares at the beginning and the end of the refinement
    0.5428    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7365   -0.0530   -0.7310   -0.0567    0.0066    1    0.0921    0.0702
    2   -1   -3   -2   -0.0141   -0.1754   -0.0130   -0.1762    0.0013    1    0.1378    0.0995
    3    0    2    2   -0.0259    0.0887   -0.0262    0.0895    0.0008    1    0.0898    0.0967
    4   -1   -2    0   -0.1973   -0.5884   -0.1957   -0.5833    0.0053    1    0.1433    0.1078
    5    0   -2   -1    0.0562   -0.2248    0.0560   -0.2234    0.0014    1    0.0889    0.0654
    6   -1    2    2   -0.1064    0.1199   -0.1085    0.1216    0.0027    1    0.1061    0.0778
    7    0   -2    0    0.1201   -0.5973    0.1201   -0.5973    0.0000    1    0.1221    0.1302
    8    1   -3   -1    0.1435   -0.2210    0.1454   -0.2240    0.0035    1    0.1430    0.1017
    9   -2    1    1   -0.1954    0.0499   -0.1952    0.0486    0.0013    1    0.1077    0.0726
   10    1   -1    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0638    0.0467
   11    1   -2    1    0.5356   -0.6122    0.5303   -0.6130    0.0053    1    0.1725    0.1248
   12   -2    0    0   -0.1830   -0.0373   -0.1829   -0.0381    0.0008    1    0.0921    0.0984
   13    3   -1    1    0.1968   -0.0087    0.1990   -0.0092    0.0022    1    0.1392    0.0927
   14    3   -2    2    0.5282   -0.1491    0.5293   -0.1451    0.0041    1    0.2071    0.1473
   15   -2   -1    0   -0.3390   -0.2369   -0.3362   -0.2357    0.0030    1    0.1211    0.0881
   16    2    0    1    0.1249    0.0351    0.1275    0.0362    0.0028    1    0.0861    0.0679
   17    2   -1    2    0.7263   -0.0804    0.7293   -0.0807    0.0030    1    0.1596    0.1198
   18    2   -2    3    1.0571   -0.5069    1.0696   -0.4972    0.0158    1    0.3517    0.2483
   19    3    1    2    0.0425    0.0282    0.0442    0.0295    0.0022    1    0.1343    0.0994
   20    2    0    2    0.4423    0.1634    0.4423    0.1634    0.0000    1    0.1093    0.1178
   21   -1   -1   -1   -0.0350   -0.0589   -0.0341   -0.0579    0.0012    1    0.0600    0.0568
   22    2    1    3    0.2976    0.3311    0.3053    0.3413    0.0128    1    0.1245    0.0899
   23    1    2    3    0.0356    0.2704    0.0347    0.2716    0.0015    1    0.1113    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1   -1    0    1   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2   -1   -3   -2   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3    1    4    4   -0.0020    0.0482   -0.0262    0.0895    0.0479    1          0.1300          0.0967
    4   -1   -2    0   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1029          0.1078
    5    0   -2   -1    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -1    2    2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    0   -3    0    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    1   -3   -1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -2    1    1   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1   -1    0    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    1   -2    1    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12   -4   -1   -1   -0.1427   -0.0704   -0.1829   -0.0381    0.0515    1          0.1333          0.0984
   13    3   -1    1    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    3   -2    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15   -2   -1    0   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    2    0    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    2   -1    2    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    2   -2    3    1.0606   -0.5064    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19    3    1    2    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0973          0.0994
   20    3    0    3    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21   -1   -1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22    2    1    3    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23    1    2    3    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0806          0.0816

###            No.69                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.7893    1.1166    1.1348   89.2690   89.9292   89.9637      0.2976
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.7955    1.1185    1.1239   89.6606   90.2007   90.0605      0.2838         0.7078    0.9952    2.8032    3.9414    3.9606
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0004    0.2408    0.1359   20.5385    6.0236    7.8367      0.1246         0.0852    0.0975    1.2305    1.9270    1.8033
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.3000    1.1977    0.2843)
 a2 = (    0.4974    0.2871   -0.6873)
 a3 = (   -0.7086   -0.0549   -0.5211)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.3012    1.1879    0.2803) (    0.0131    0.0232    0.1040)
 a2 = (    0.4904    0.2881   -0.6898) (    0.0165    0.0123    0.2558)
 a3 = (   -0.7162   -0.0544   -0.5251) (    0.0218    0.0106    0.1949)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  163.8848  126.5505  -85.5339    3.8571   10.7275    0.6538
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005   -0.0055      0.0024    0.0024    0.3925

# Number of computed bands
            183            183
# Figure of merit at the beginning and the end of the refinement
         3.6665         3.8351
# Chi-squares at the beginning and the end of the refinement
    0.0834    0.0284
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7310   -0.0567   -0.7310   -0.0567    0.0000    1    0.0693    0.0702
    2    3    1   -1   -0.0135   -0.1735   -0.0130   -0.1762    0.0027    1    0.1056    0.0995
    3   -3   -1   -1   -0.0249    0.0857   -0.0262    0.0895    0.0040    1    0.1032    0.0967
    4    2    0   -2   -0.1896   -0.5812   -0.1957   -0.5833    0.0065    1    0.1086    0.1078
    5    2    0    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0682    0.0654
    6   -2    0   -2   -0.1028    0.1165   -0.1085    0.1216    0.0076    1    0.0808    0.0778
    7    3   -1   -1    0.1206   -0.5886    0.1201   -0.5973    0.0087    1    0.1395    0.1302
    8    3   -1    1    0.1430   -0.2208    0.1454   -0.2240    0.0040    1    0.1096    0.1017
    9   -1    1   -3   -0.1901    0.0485   -0.1952    0.0486    0.0051    1    0.0817    0.0726
   10    1   -1    1    0.2261   -0.1285    0.2251   -0.1274    0.0014    1    0.0489    0.0467
   11    2   -2    0    0.5288   -0.6039    0.5303   -0.6130    0.0092    1    0.1307    0.1248
   12    0    2   -4   -0.1778   -0.0369   -0.1829   -0.0381    0.0052    1    0.1051    0.0984
   13    1   -3    3    0.1994   -0.0087    0.1990   -0.0092    0.0006    1    0.1064    0.0927
   14    2   -4    2    0.5256   -0.1491    0.5293   -0.1451    0.0055    1    0.1580    0.1473
   15    1    1   -3   -0.3321   -0.2358   -0.3362   -0.2357    0.0041    1    0.0918    0.0881
   16    0   -2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0658    0.0679
   17    1   -3    1    0.7206   -0.0811    0.7293   -0.0807    0.0087    1    0.1214    0.1198
   18    2   -4    0    1.0401   -0.5008    1.0696   -0.4972    0.0297    1    0.2632    0.2483
   19   -1   -3    3    0.0445    0.0298    0.0442    0.0295    0.0004    1    0.1027    0.0994
   20    0   -4    2    0.4408    0.1628    0.4423    0.1634    0.0016    1    0.1255    0.1178
   21    1    1   -1   -0.0336   -0.0570   -0.0341   -0.0579    0.0011    1    0.0460    0.0568
   22   -1   -3    1    0.2955    0.3286    0.3053    0.3413    0.0161    1    0.0951    0.0899
   23   -2   -2    0    0.0354    0.2667    0.0347    0.2716    0.0051    1    0.0851    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    0   -2   -0.7329   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    3    1   -1   -0.0133   -0.1736   -0.0130   -0.1762    0.0027    1          0.0994          0.0995
    3   -3   -1   -1   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0974          0.0967
    4    2    0   -2   -0.1958   -0.5870   -0.1957   -0.5833    0.0037    1          0.1028          0.1078
    5    2    0    0    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0642          0.0654
    6   -2    0   -2   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0768          0.0778
    7    3   -1   -1    0.1214   -0.5966    0.1201   -0.5973    0.0015    1          0.1318          0.1302
    8    3   -1    1    0.1440   -0.2202    0.1454   -0.2240    0.0041    1          0.1032          0.1017
    9   -1    1   -3   -0.1947    0.0483   -0.1952    0.0486    0.0006    1          0.0780          0.0726
   10    1   -1    1    0.2259   -0.1271    0.2251   -0.1274    0.0009    1          0.0461          0.0467
   11    2   -2    0    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1239          0.1248
   12    0    2   -4   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.1002          0.0984
   13    1   -3    3    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.1009          0.0927
   14    2   -4    2    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1493          0.1473
   15    1    1   -3   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0873          0.0881
   16    0   -2    2    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0624          0.0679
   17    1   -3    1    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1151          0.1198
   18    2   -4    0    1.0606   -0.5064    1.0696   -0.4972    0.0129    1          0.2519          0.2483
   19   -1   -3    3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0972          0.0994
   20    0   -4    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1189          0.1178
   21    1    1   -1   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0434          0.0568
   22   -1   -3    1    0.2999    0.3343    0.3053    0.3413    0.0088    1          0.0902          0.0899
   23   -2   -2    0    0.0353    0.2739    0.0347    0.2716    0.0024    1          0.0805          0.0816

###            No.70                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.6918    1.3083    1.3143  117.2730   99.7246   99.7359      0.7377
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.6844    1.3139    1.3228  116.9587  100.5572   99.4506      0.2776         0.5174    0.9933    2.4651    4.7324    4.7643
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0582    0.1201    0.1715    2.2305    6.6215   21.5264      0.0856         0.1107    0.2171    0.7881    1.5213    1.5929
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -1.2156    0.1450    0.9148)
 a2 = (   -0.7215   -0.0559   -0.5286)
 a3 = (   -0.4519   -0.7667   -0.0598)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -1.2390    0.1340    0.9202) (    0.1674    0.0230    0.2281)
 a2 = (   -0.7132   -0.0541   -0.5296) (    0.0971    0.0127    0.1317)
 a3 = (   -0.4507   -0.7618   -0.0583) (    0.0612    0.1031    0.0154)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  143.2346   82.9357   -0.9238   10.3594    2.8056    0.4604
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0001    0.0005    0.0074      0.0024    0.0024    0.3799

# Number of computed bands
            302            287
# Figure of merit at the beginning and the end of the refinement
         1.0640         3.7993
# Chi-squares at the beginning and the end of the refinement
   13.4837    0.0248
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -1    0   -0.7283   -0.0565   -0.7310   -0.0567    0.0028    1    0.0871    0.0702
    2    1    1   -3    0.0544   -0.2235   -0.0130   -0.1762    0.0824    1    0.1689    0.0995
    3   -1   -2    1   -0.0331    0.0120   -0.0262    0.0895    0.0778    1    0.1494    0.0967
    4    1   -1   -3   -0.1998   -0.5800   -0.1957   -0.5833    0.0053    1    0.2730    0.1078
    5    1    1   -3    0.0544   -0.2235    0.0560   -0.2234    0.0016    1    0.1689    0.0654
    6   -1   -3    3   -0.1072    0.1206   -0.1085    0.1216    0.0017    1    0.2016    0.0778
    7    1    0   -2    0.1107   -0.5958    0.1201   -0.5973    0.0096    1    0.1735    0.1302
    8    1    1   -2    0.1413   -0.2218    0.1454   -0.2240    0.0047    1    0.1350    0.1017
    9   -1   -3    1   -0.1961    0.0498   -0.1952    0.0486    0.0015    1    0.2043    0.0726
   10    1    1   -1    0.2255   -0.1299    0.2251   -0.1274    0.0025    1    0.1200    0.0467
   11    1    0   -1    0.5262   -0.6282    0.5303   -0.6130    0.0158    1    0.1633    0.1248
   12   -1   -3    0   -0.1985   -0.0013   -0.1829   -0.0381    0.0399    1    0.2284    0.0984
   13    1    1    0    0.1990   -0.0092    0.1990   -0.0092    0.0000    1    0.1305    0.0927
   14    2    1   -1    0.4430   -0.1642    0.5293   -0.1451    0.0884    1    0.2487    0.1473
   15    0   -1   -1   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1149    0.0881
   16    1    1    1    0.1264    0.0359    0.1275    0.0362    0.0011    1    0.1619    0.0679
   17    1    0    0    0.7420   -0.0885    0.7293   -0.0807    0.0149    1    0.1513    0.1198
   18    2    0   -1    0.7429   -0.3966    1.0696   -0.4972    0.3418    0    0.3210    0.2483
   19   -1   -2    2   -0.0072    0.0064    0.0442    0.0295    0.0563    1    0.1495    0.0994
   20    1    0    1    0.4501    0.1678    0.4423    0.1634    0.0090    1    0.1544    0.1178
   21    0    0   -1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0568    0.0568
   22    1   -1    3    0.2986    0.3389    0.3053    0.3413    0.0071    1    0.2358    0.0899
   23    0   -1    2    0.0336    0.2726    0.0347    0.2716    0.0014    1    0.1053    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7328   -0.0562   -0.7310   -0.0567    0.0019    1          0.0662          0.0702
    2    1    1   -5   -0.0133   -0.1736   -0.0130   -0.1762    0.0026    1          0.0981          0.0995
    3   -1   -3    5   -0.0270    0.0905   -0.0262    0.0895    0.0013    1          0.0962          0.0967
    4    1   -1   -3   -0.1959   -0.5870   -0.1957   -0.5833    0.0037    1          0.1026          0.1078
    5    1    1   -3    0.0566   -0.2235    0.0560   -0.2234    0.0007    1          0.0634          0.0654
    6   -1   -3    3   -0.1079    0.1197   -0.1085    0.1216    0.0019    1          0.0758          0.0778
    7    2    0   -4    0.1215   -0.5966    0.1201   -0.5973    0.0015    1          0.1314          0.1302
    8    2    2   -5    0.0952   -0.2292    0.1454   -0.2240    0.0505    1          0.1132          0.1017
    9   -1   -3    1   -0.1946    0.0483   -0.1952    0.0486    0.0007    1          0.0771          0.0726
   10    1    1   -1    0.2259   -0.1271    0.2251   -0.1274    0.0008    1          0.0456          0.0467
   11    2    0   -2    0.5378   -0.6116    0.5303   -0.6130    0.0076    1          0.1242          0.1248
   12   -1   -3   -1   -0.1807   -0.0378   -0.1829   -0.0381    0.0022    1          0.0990          0.0984
   13    2    2    0    0.1983   -0.0086    0.1990   -0.0092    0.0008    1          0.0997          0.0927
   14    3    1   -1    0.5299   -0.1483    0.5293   -0.1451    0.0032    1          0.1487          0.1473
   15    0   -2   -2   -0.3361   -0.2362   -0.3362   -0.2357    0.0005    1          0.0866          0.0881
   16    1    1    1    0.1271    0.0355    0.1275    0.0362    0.0007    1          0.0616          0.0679
   17    2    0    0    0.7288   -0.0793    0.7293   -0.0807    0.0015    1          0.1152          0.1198
   18    3   -1   -1    1.0606   -0.5065    1.0696   -0.4972    0.0129    1          0.2542          0.2483
   19    1    1    3    0.0449    0.0294    0.0442    0.0295    0.0007    1          0.0960          0.0994
   20    2    0    2    0.4450    0.1648    0.4423    0.1634    0.0030    1          0.1181          0.1178
   21    0    0   -3   -0.0332   -0.0568   -0.0341   -0.0579    0.0015    1          0.0642          0.0568
   22    1   -1    3    0.3000    0.3344    0.3053    0.3413    0.0088    1          0.0896          0.0899
   23    0   -2    4    0.0352    0.2740    0.0347    0.2716    0.0024    1          0.0797          0.0816

###            No.71                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8587    0.8655    1.4275   89.4741   89.4529   70.4893      0.5002
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8560    0.8886    1.3654   92.7030   88.4890   74.7447      0.4307         0.6269    0.6508    1.9873    2.0632    3.1700
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0907    0.0385    0.2683    9.0393    7.5445   23.5675      0.1725         0.0574    0.1030    0.8233    0.8311    1.4141
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1768    0.8068   -0.9188)
 a2 = (    0.5295    0.4212    1.0221)
 a3 = (    0.5907   -0.3344   -0.1735)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.1823    0.8286   -0.8654) (    0.0477    0.1920    0.1929)
 a2 = (    0.5567    0.4091    0.9421) (    0.1305    0.0973    0.2101)
 a3 = (    0.6228   -0.3517   -0.1642) (    0.1451    0.0819    0.0367)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  -48.1241  106.4530   60.0598   11.9377    7.0974    0.5795
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0082   -0.1092      0.0024    0.0024    0.5045

# Number of computed bands
            137            161
# Figure of merit at the beginning and the end of the refinement
         3.0554         3.7311
# Chi-squares at the beginning and the end of the refinement
    1.8132    0.8102
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7531   -0.0584   -0.7310   -0.0567    0.0221    1    0.0951    0.0702
    2    1    1   -1   -0.0130   -0.1762   -0.0130   -0.1762    0.0000    1    0.0705    0.0995
    3   -2   -1    3   -0.0262    0.0895   -0.0262    0.0895    0.0000    1    0.1381    0.0967
    4    1    2   -1   -0.1926   -0.5922   -0.1957   -0.5833    0.0094    1    0.1469    0.1078
    5    1    1   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0909    0.0654
    6   -1    0    3   -0.1092    0.1239   -0.1085    0.1216    0.0024    1    0.1081    0.0778
    7    1    2   -3    0.1205   -0.5961    0.1201   -0.5973    0.0012    1    0.1872    0.1302
    8    1    1   -3    0.1087   -0.2276    0.1454   -0.2240    0.0369    1    0.1167    0.1017
    9    0    1    3   -0.2048    0.0518   -0.1952    0.0486    0.0102    1    0.1090    0.0726
   10    0    0   -1    0.2224   -0.1259    0.2251   -0.1274    0.0031    1    0.0321    0.0467
   11    0    1   -3    0.5365   -0.6150    0.5303   -0.6130    0.0065    1    0.1752    0.1248
   12    1    2    3   -0.1922   -0.0413   -0.1829   -0.0381    0.0099    1    0.1402    0.0984
   13   -1   -1   -3    0.1670    0.0151    0.1990   -0.0092    0.0402    1    0.1116    0.0927
   14   -1    0   -5    0.5302   -0.1466    0.5293   -0.1451    0.0017    1    0.2085    0.1473
   15    1    2    1   -0.3433   -0.2471   -0.3362   -0.2357    0.0134    1    0.1240    0.0881
   16   -1   -1   -2    0.1187    0.0352    0.1275    0.0362    0.0088    1    0.0866    0.0679
   17   -1    0   -3    0.7311   -0.0737    0.7293   -0.0807    0.0073    1    0.1613    0.1198
   18   -1    1   -4    1.0707   -0.5071    1.0696   -0.4972    0.0100    1    0.3598    0.2483
   19   -1   -1   -1    0.0367    0.0253    0.0442    0.0295    0.0086    1    0.0679    0.0994
   20   -2   -1   -3    0.4372    0.1699    0.4423    0.1634    0.0083    1    0.1654    0.1178
   21    1    1    0   -0.0363   -0.0632   -0.0341   -0.0579    0.0057    1    0.0614    0.0568
   22   -2   -1   -1    0.2879    0.3322    0.3053    0.3413    0.0197    1    0.1262    0.0899
   23   -2   -1    1    0.0329    0.2669    0.0347    0.2716    0.0050    1    0.1141    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0    1    1   -0.7289   -0.0437   -0.7310   -0.0567    0.0131    1          0.0669          0.0702
    2    1    1   -1   -0.0113   -0.1754   -0.0130   -0.1762    0.0019    1          0.0543          0.0995
    3   -2   -1    3   -0.0283    0.0882   -0.0262    0.0895    0.0025    1          0.1090          0.0967
    4    1    2   -1   -0.1976   -0.5979   -0.1957   -0.5833    0.0147    1          0.1049          0.1078
    5    1    1   -2    0.0575   -0.2249    0.0560   -0.2234    0.0022    1          0.0702          0.0654
    6   -1    0    3   -0.1082    0.1137   -0.1085    0.1216    0.0079    1          0.0861          0.0778
    7    1    2   -3    0.1268   -0.6020    0.1201   -0.5973    0.0081    1          0.1352          0.1302
    8    1    1   -3    0.1101   -0.2298    0.1454   -0.2240    0.0358    1          0.0907          0.1017
    9    0    1    3   -0.1910    0.0430   -0.1952    0.0486    0.0070    1          0.0868          0.0726
   10    0    0   -1    0.2227   -0.1334    0.2251   -0.1274    0.0065    1          0.0255          0.0467
   11    0    1   -3    0.5411   -0.6112    0.5303   -0.6130    0.0109    1          0.1232          0.1248
   12    1    2    3   -0.1773   -0.0415   -0.1829   -0.0381    0.0065    1          0.1106          0.0984
   13   -1   -1   -3    0.1770    0.0042    0.1990   -0.0092    0.0256    1          0.0895          0.0927
   14   -1    0   -5    0.5267   -0.1565    0.5293   -0.1451    0.0117    1          0.1569          0.1473
   15    1    2    1   -0.3385   -0.2373   -0.3362   -0.2357    0.0028    1          0.0925          0.0881
   16   -1   -1   -2    0.1321    0.0272    0.1275    0.0362    0.0101    1          0.0693          0.0679
   17   -1    0   -3    0.7267   -0.0884    0.7293   -0.0807    0.0081    1          0.1169          0.1198
   18   -1    1   -4    1.0616   -0.5030    1.0696   -0.4972    0.0099    1          0.2380          0.2483
   19   -1   -1   -1    0.0510    0.0244    0.0442    0.0295    0.0086    1          0.0538          0.0994
   20   -2   -1   -3    0.4513    0.1551    0.4423    0.1634    0.0122    1          0.1267          0.1178
   21    1    1    0   -0.0293   -0.0588   -0.0341   -0.0579    0.0049    1          0.0477          0.0568
   22   -2   -1   -1    0.3075    0.3323    0.3053    0.3413    0.0093    1          0.0964          0.0899
   23   -2   -1    1    0.0358    0.2740    0.0347    0.2716    0.0026    1          0.0884          0.0816

###            No.72                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.8609    0.8639    1.4244   91.2477   90.2204  109.2184      0.5121
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.8888    0.8559    1.3648   91.5383   92.7384  105.1677      0.4314         0.6512    0.6271    2.0603    1.9840    3.1637
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0903    0.1464    0.3555    7.5881    9.0871   23.6655      0.1472         0.1036    0.0577    0.7333    0.7571    1.3578
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5577    0.4241    1.0112)
 a2 = (   -0.1497   -0.8060    0.9119)
 a3 = (    0.5917   -0.3350   -0.1759)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5570    0.4093    0.9410) (    0.1651    0.1226    0.1505)
 a2 = (   -0.1824   -0.8291    0.8645) (    0.0593    0.2466    0.1386)
 a3 = (    0.6231   -0.3519   -0.1640) (    0.1851    0.1047    0.0265)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   57.1876  106.4801   60.0600   10.9753    7.1330    0.5795
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0009    0.0082   -0.1112      0.0024    0.0024    0.5072

# Number of computed bands
            127            161
# Figure of merit at the beginning and the end of the refinement
         2.9769         3.6987
# Chi-squares at the beginning and the end of the refinement
    1.9154    0.8101
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7224   -0.0560   -0.7310   -0.0567    0.0086    1    0.0956    0.0702
    2    1   -1   -1   -0.0129   -0.1749   -0.0130   -0.1762    0.0013    1    0.0723    0.0995
    3   -1    2    3   -0.0259    0.0859   -0.0262    0.0895    0.0036    1    0.1417    0.0967
    4    2   -1   -1   -0.1964   -0.5802   -0.1957   -0.5833    0.0032    1    0.1493    0.1078
    5    1   -1   -2    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0932    0.0654
    6    0    1    3   -0.1055    0.1175   -0.1085    0.1216    0.0050    1    0.1112    0.0778
    7    2   -1   -3    0.1139   -0.5942    0.1201   -0.5973    0.0069    1    0.1909    0.1302
    8    1   -1   -3    0.1091   -0.2284    0.1454   -0.2240    0.0366    1    0.1198    0.1017
    9    1    0    3   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.1124    0.0726
   10    0    0   -1    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0330    0.0467
   11    1    0   -3    0.5316   -0.6240    0.5303   -0.6130    0.0111    1    0.1791    0.1248
   12    2   -1    3   -0.1834   -0.0392   -0.1829   -0.0381    0.0012    1    0.1444    0.0984
   13   -1    1   -3    0.1711    0.0155    0.1990   -0.0092    0.0372    1    0.1147    0.0927
   14    0    1   -5    0.5345   -0.1494    0.5293   -0.1451    0.0068    1    0.2135    0.1473
   15    2   -1    1   -0.3345   -0.2377   -0.3362   -0.2357    0.0026    1    0.1268    0.0881
   16   -1    1   -2    0.1227    0.0364    0.1275    0.0362    0.0048    1    0.0890    0.0679
   17    0    1   -3    0.7400   -0.0765    0.7293   -0.0807    0.0115    1    0.1653    0.1198
   18    1    1   -4    1.0821   -0.5292    1.0696   -0.4972    0.0344    1    0.3721    0.2483
   19   -1    1   -1    0.0400    0.0275    0.0442    0.0295    0.0047    1    0.0697    0.0994
   20   -1    2   -3    0.4414    0.1729    0.4423    0.1634    0.0096    1    0.1691    0.1178
   21    1   -1    0   -0.0349   -0.0607   -0.0341   -0.0579    0.0028    1    0.0629    0.0568
   22   -1    2   -1    0.2868    0.3368    0.3053    0.3413    0.0190    1    0.1287    0.0899
   23   -1    2    1    0.0297    0.2652    0.0347    0.2716    0.0081    1    0.1165    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7289   -0.0437   -0.7310   -0.0567    0.0131    1          0.0667          0.0702
    2    1   -1   -1   -0.0113   -0.1754   -0.0130   -0.1762    0.0019    1          0.0543          0.0995
    3   -1    2    3   -0.0283    0.0882   -0.0262    0.0895    0.0025    1          0.1090          0.0967
    4    2   -1   -1   -0.1976   -0.5979   -0.1957   -0.5833    0.0147    1          0.1048          0.1078
    5    1   -1   -2    0.0575   -0.2249    0.0560   -0.2234    0.0021    1          0.0702          0.0654
    6    0    1    3   -0.1082    0.1137   -0.1085    0.1216    0.0079    1          0.0861          0.0778
    7    2   -1   -3    0.1268   -0.6020    0.1201   -0.5973    0.0081    1          0.1350          0.1302
    8    1   -1   -3    0.1101   -0.2298    0.1454   -0.2240    0.0358    1          0.0907          0.1017
    9    1    0    3   -0.1910    0.0430   -0.1952    0.0486    0.0070    1          0.0868          0.0726
   10    0    0   -1    0.2227   -0.1334    0.2251   -0.1274    0.0064    1          0.0255          0.0467
   11    1    0   -3    0.5411   -0.6112    0.5303   -0.6130    0.0109    1          0.1229          0.1248
   12    2   -1    3   -0.1773   -0.0415   -0.1829   -0.0381    0.0066    1          0.1105          0.0984
   13   -1    1   -3    0.1771    0.0042    0.1990   -0.0092    0.0256    1          0.0895          0.0927
   14    0    1   -5    0.5267   -0.1565    0.5293   -0.1451    0.0117    1          0.1567          0.1473
   15    2   -1    1   -0.3385   -0.2373   -0.3362   -0.2357    0.0027    1          0.0924          0.0881
   16   -1    1   -2    0.1322    0.0272    0.1275    0.0362    0.0101    1          0.0693          0.0679
   17    0    1   -3    0.7268   -0.0883    0.7293   -0.0807    0.0080    1          0.1167          0.1198
   18    1    1   -4    1.0617   -0.5029    1.0696   -0.4972    0.0098    1          0.2373          0.2483
   19   -1    1   -1    0.0511    0.0245    0.0442    0.0295    0.0086    1          0.0538          0.0994
   20   -1    2   -3    0.4513    0.1551    0.4423    0.1634    0.0122    1          0.1266          0.1178
   21    1   -1    0   -0.0293   -0.0588   -0.0341   -0.0579    0.0049    1          0.0477          0.0568
   22   -1    2   -1    0.3075    0.3323    0.3053    0.3413    0.0093    1          0.0964          0.0899
   23   -1    2    1    0.0358    0.2741    0.0347    0.2716    0.0027    1          0.0884          0.0816

###            No.73                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9848    1.0077    1.0095   89.9048   86.7622   88.7380      0.7829
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0337    1.0073    0.9654   88.2220   93.9786   86.2536      0.3795         1.0708    1.0434    2.7242    2.6545    2.5440
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0041    0.3990    0.3798    2.1958    7.4780    9.8065      0.0526         0.4191    0.0270    0.3778    1.1141    1.0613
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.1277   -0.1801    0.9930)
 a2 = (    0.2350   -0.9383   -0.2227)
 a3 = (    0.9463    0.2684   -0.1303)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.2161   -0.1032    0.9420) (    0.0932    0.0563    0.0261)
 a2 = (    0.2344   -0.9407   -0.2264) (    0.0969    0.3842    0.0090)
 a3 = (    0.9844    0.3122   -0.1149) (    0.4017    0.1309    0.0087)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
   99.4988  100.6920  106.5168    4.4949    4.8682    0.8728
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0022   -0.0100   -0.0321      0.0025    0.0048    0.4488

# Number of computed bands
            270            400
# Figure of merit at the beginning and the end of the refinement
         1.0365         3.3696
# Chi-squares at the beginning and the end of the refinement
    9.1336    0.8018
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.7979   -0.0656   -0.7310   -0.0567    0.0675    0    0.1527    0.0702
    2    0   -2    1   -0.0311   -0.1400   -0.0130   -0.1762    0.0404    1    0.1528    0.0995
    3    0    1   -2    0.0128    0.0114   -0.0262    0.0895    0.0873    1    0.1497    0.0967
    4    1   -2    1   -0.1870   -0.6083   -0.1957   -0.5833    0.0265    0    0.2316    0.1078
    5    0   -1    0    0.0560   -0.2234    0.0560   -0.2234    0.0000    1    0.0703    0.0654
    6    1    2    1   -0.1154    0.1337   -0.1085    0.1216    0.0140    1    0.1669    0.0778
    7    1   -3    0    0.1318   -0.6016    0.1201   -0.5973    0.0125    1    0.2968    0.1302
    8    0   -2   -1    0.1776   -0.2017    0.1454   -0.2240    0.0392    1    0.1605    0.1017
    9    1    1    2   -0.2119    0.0546   -0.1952    0.0486    0.0177    1    0.1686    0.0726
   10    0   -1   -1    0.2262   -0.1283    0.2251   -0.1274    0.0013    1    0.1008    0.0467
   11    1   -2   -1    0.5464   -0.6055    0.5303   -0.6130    0.0177    1    0.2802    0.1248
   12    1    0    3   -0.1943   -0.0409   -0.1829   -0.0381    0.0118    1    0.2173    0.0984
   13    0   -1   -2    0.2194   -0.0414    0.1990   -0.0092    0.0382    1    0.1571    0.0927
   14    1   -2   -3    0.5333   -0.1494    0.5293   -0.1451    0.0058    1    0.3362    0.1473
   15    1   -1    2   -0.3506   -0.2543   -0.3362   -0.2357    0.0235    0    0.1928    0.0881
   16    0    0   -1    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0679    0.0679
   17    1   -1   -2    0.7293   -0.0807    0.7293   -0.0807    0.0000    1    0.2601    0.1198
   18    1   -1   -1    1.0506   -0.4884    1.0696   -0.4972    0.0209    1    0.2819    0.2483
   19    0    1   -2    0.0128    0.0114    0.0442    0.0295    0.0363    1    0.1497    0.0994
   20    1    0   -3    0.4510    0.1639    0.4423    0.1634    0.0086    1    0.2669    0.1178
   21    0   -1    1   -0.0335   -0.0568   -0.0341   -0.0579    0.0013    1    0.0949    0.0568
   22    1    1   -2    0.3105    0.3359    0.3053    0.3413    0.0075    1    0.2025    0.0899
   23    1    2   -1    0.0428    0.2852    0.0347    0.2716    0.0157    1    0.1789    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1    0    1   -0.6880   -0.1101   -0.7310   -0.0567    0.0686    0          0.0679          0.0702
    2    0   -3    1   -0.0144   -0.1743   -0.0130   -0.1762    0.0023    1          0.1042          0.0995
    3    1    3    0   -0.0243    0.0944   -0.0262    0.0895    0.0053    1          0.0979          0.0967
    4    1   -2    1   -0.1949   -0.5529   -0.1957   -0.5833    0.0304    0          0.1078          0.1078
    5    0   -2    0    0.0604   -0.2238    0.0560   -0.2234    0.0045    1          0.0663          0.0654
    6    1    2    1   -0.1133    0.1258   -0.1085    0.1216    0.0064    1          0.0774          0.0778
    7    1   -3    0    0.1090   -0.5862    0.1201   -0.5973    0.0157    1          0.1361          0.1302
    8    0   -3   -1    0.1533   -0.2148    0.1454   -0.2240    0.0121    1          0.1056          0.1017
    9    1    1    2   -0.1991    0.0449   -0.1952    0.0486    0.0053    1          0.0821          0.0726
   10    0   -1   -1    0.2304   -0.1077    0.2251   -0.1274    0.0204    0          0.0473          0.0467
   11    1   -2   -1    0.5260   -0.6108    0.5303   -0.6130    0.0049    1          0.1249          0.1248
   12    1    0    3   -0.1798   -0.0378   -0.1829   -0.0381    0.0031    1          0.1087          0.0984
   13    0   -1   -2    0.2115   -0.0200    0.1990   -0.0092    0.0166    1          0.0747          0.0927
   14    1   -2   -3    0.5261   -0.1275    0.5293   -0.1451    0.0179    1          0.1510          0.1473
   15    1   -1    2   -0.3159   -0.2283   -0.3362   -0.2357    0.0217    0          0.0947          0.0881
   16    0    0   -2    0.1116    0.0447    0.1275    0.0362    0.0180    0          0.0664          0.0679
   17    1   -1   -2    0.7201   -0.0670    0.7293   -0.0807    0.0165    1          0.1148          0.1198
   18    2   -2   -2    1.0386   -0.5330    1.0696   -0.4972    0.0474    0          0.2481          0.2483
   19    0    1   -3    0.0326    0.0310    0.0442    0.0295    0.0117    1          0.1046          0.0994
   20    1    0   -3    0.4262    0.1711    0.4423    0.1634    0.0179    1          0.1206          0.1178
   21    0   -1    1   -0.0383   -0.0576   -0.0341   -0.0579    0.0042    1          0.0465          0.0568
   22    1    1   -2    0.2933    0.3299    0.3053    0.3413    0.0166    1          0.0908          0.0899
   23    1    2   -1    0.0370    0.2769    0.0347    0.2716    0.0058    1          0.0807          0.0816

###            No.74                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    0.9798    0.9806    1.1474  114.8752   90.5837   90.0006      0.2787
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    0.9738    0.9707    1.1601  114.2158   90.6138   90.3503      0.2516         0.8394    0.8367    3.8704    3.8582    4.6110
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.0028    0.0271    0.3044   10.7481    9.5746    1.2084      0.1129         0.2226    0.2392    1.7375    1.7354    2.3976
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.8599   -0.4868   -0.2556)
 a2 = (   -0.5984   -0.7881   -0.5334)
 a3 = (   -0.1634    0.1771   -0.9301)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.8609   -0.4949   -0.2623) (    0.0230    0.0154    0.0981)
 a2 = (   -0.6030   -0.7964   -0.5275) (    0.0207    0.0248    0.1975)
 a3 = (   -0.1605    0.1771   -0.9145) (    0.0183    0.0160    0.3422)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -151.1722  148.0168  175.1298    2.7722   10.3057    0.6957
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
   -0.0021   -0.0025   -0.0156      0.0026    0.0023    0.4066

# Number of computed bands
            400            400
# Figure of merit at the beginning and the end of the refinement
         3.0437         3.2635
# Chi-squares at the beginning and the end of the refinement
    0.7418    0.4865
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7405   -0.0567   -0.7310   -0.0567    0.0095    1    0.0753    0.0702
    2   -2   -4    2   -0.0135   -0.1741   -0.0130   -0.1762    0.0021    1    0.1127    0.0995
    3    4    1   -2   -0.0492    0.0480   -0.0262    0.0895    0.0474    1    0.1068    0.0967
    4   -1   -3    0   -0.1928   -0.5877   -0.1957   -0.5833    0.0053    1    0.1169    0.1078
    5   -2   -2    1    0.0563   -0.2235    0.0560   -0.2234    0.0003    1    0.0728    0.0654
    6    3    1   -2   -0.1068    0.1204   -0.1085    0.1216    0.0020    1    0.0866    0.0778
    7   -3   -3    0    0.1218   -0.5939    0.1201   -0.5973    0.0038    1    0.1499    0.1302
    8   -4   -2    1    0.1432   -0.2202    0.1454   -0.2240    0.0044    1    0.1170    0.1017
    9    3   -1   -1   -0.1958    0.0498   -0.1952    0.0486    0.0013    1    0.0877    0.0726
   10   -2    0    0    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0522    0.0467
   11   -3   -1   -1    0.5338   -0.6082    0.5303   -0.6130    0.0059    1    0.1407    0.1248
   12    3   -3    0   -0.1827   -0.0377   -0.1829   -0.0381    0.0003    1    0.1127    0.0984
   13   -4    2   -1    0.1976   -0.0086    0.1990   -0.0092    0.0015    1    0.1137    0.0927
   14   -4    1   -2    0.6045   -0.1311    0.5293   -0.1451    0.0765    0    0.1482    0.1473
   15    1   -3    0   -0.3377   -0.2388   -0.3362   -0.2357    0.0034    1    0.0988    0.0881
   16   -2    2   -1    0.1259    0.0356    0.1275    0.0362    0.0017    1    0.0703    0.0679
   17   -3    1   -2    0.7252   -0.0809    0.7293   -0.0807    0.0042    1    0.1305    0.1198
   18   -4    0   -3    1.0505   -0.5043    1.0696   -0.4972    0.0204    1    0.2855    0.2483
   19   -3    3   -1    0.0215    0.0055    0.0442    0.0295    0.0330    1    0.1043    0.0994
   20   -3    3   -3    0.4432    0.1637    0.4423    0.1634    0.0009    1    0.1344    0.1178
   21    0   -2    1   -0.0341   -0.0579   -0.0341   -0.0579    0.0000    1    0.0491    0.0568
   22   -1    3   -3    0.2983    0.3319    0.3053    0.3413    0.0117    1    0.1019    0.0899
   23    1    3   -3    0.0357    0.2715    0.0347    0.2716    0.0011    1    0.0911    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    1   -1   -1   -0.7312   -0.0537   -0.7310   -0.0567    0.0030    1          0.0653          0.0702
    2   -2   -4    2   -0.0125   -0.1769   -0.0130   -0.1762    0.0009    1          0.1014          0.0995
    3    4    1   -2   -0.0388    0.0430   -0.0262    0.0895    0.0482    1          0.0952          0.0967
    4   -1   -3    0   -0.1906   -0.5838   -0.1957   -0.5833    0.0051    1          0.1036          0.1078
    5   -2   -2    1    0.0587   -0.2284    0.0560   -0.2234    0.0057    1          0.0655          0.0654
    6    3    1   -2   -0.0961    0.1150   -0.1085    0.1216    0.0139    1          0.0769          0.0778
    7   -3   -3    0    0.1214   -0.5949    0.1201   -0.5973    0.0027    1          0.1335          0.1302
    8   -4   -2    1    0.1484   -0.2262    0.1454   -0.2240    0.0037    1          0.1051          0.1017
    9    3   -1   -1   -0.1843    0.0507   -0.1952    0.0486    0.0111    1          0.0776          0.0726
   10   -2    0    0    0.2347   -0.1313    0.2251   -0.1274    0.0103    1          0.0468          0.0467
   11   -3   -1   -1    0.5344   -0.6132    0.5303   -0.6130    0.0041    1          0.1247          0.1248
   12    3   -3    0   -0.1744   -0.0339   -0.1829   -0.0381    0.0095    1          0.1000          0.0984
   13   -4    2   -1    0.2073   -0.0071    0.1990   -0.0092    0.0086    1          0.1017          0.0927
   14   -4    1   -2    0.6127   -0.1334    0.5293   -0.1451    0.0842    0          0.1318          0.1473
   15    1   -3    0   -0.3319   -0.2345   -0.3362   -0.2357    0.0045    1          0.0874          0.0881
   16   -2    2   -1    0.1327    0.0393    0.1275    0.0362    0.0061    1          0.0628          0.0679
   17   -3    1   -2    0.7326   -0.0827    0.7293   -0.0807    0.0038    1          0.1156          0.1198
   18   -4    0   -3    1.0516   -0.5107    1.0696   -0.4972    0.0225    1          0.2497          0.2483
   19   -3    3   -1    0.0289    0.0093    0.0442    0.0295    0.0253    1          0.0931          0.0994
   20   -3    3   -3    0.4480    0.1662    0.4423    0.1634    0.0063    1          0.1194          0.1178
   21    0   -2    1   -0.0332   -0.0573   -0.0341   -0.0579    0.0012    1          0.0440          0.0568
   22   -1    3   -3    0.2985    0.3310    0.3053    0.3413    0.0123    1          0.0903          0.0899
   23    1    3   -3    0.0380    0.2648    0.0347    0.2716    0.0076    1          0.0810          0.0816

###            No.75                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0885    1.0908    1.0914  109.7058  109.2372  109.2746      0.2998
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0787    1.1192    1.0732  109.9785  107.4372  110.7266      0.2925         1.0051    1.0428    3.6879    3.8265    3.6694
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1094    0.0637    0.2515   20.1380   12.6059    5.9497      0.1408         0.1347    0.1882    1.8138    1.8543    1.9642
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (   -0.5679   -0.9635   -0.0724)
 a2 = (   -0.9013   -0.0665   -0.6644)
 a3 = (    0.0430   -0.6011   -0.9451)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (   -0.5896   -0.9600   -0.0709) (    0.0096    0.0061    0.0304)
 a2 = (   -0.8806   -0.0712   -0.6628) (    0.0196    0.0128    0.2784)
 a3 = (    0.0567   -0.5996   -0.9550) (    0.0150    0.0123    0.4008)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
 -174.5675  138.4707   62.5167    1.1199   11.9868    0.6762
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0086    0.0002    0.0097      0.0024    0.0024    0.4176

# Number of computed bands
            173            193
# Figure of merit at the beginning and the end of the refinement
         3.3422         3.0261
# Chi-squares at the beginning and the end of the refinement
    1.2977    0.8555
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7332   -0.0541   -0.7310   -0.0567    0.0034    1    0.0891    0.0702
    2   -3    2   -2    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3    2   -2    1   -0.0272    0.0917   -0.0262    0.0895    0.0025    1    0.0652    0.0967
    4   -2    0   -2   -0.1961   -0.5845   -0.1957   -0.5833    0.0012    1    0.1381    0.1078
    5   -2    2   -2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    2   -4    2   -0.1080    0.1211   -0.1085    0.1216    0.0007    1    0.1029    0.0778
    7   -1    1   -2    0.1188   -0.5947    0.1201   -0.5973    0.0030    1    0.0883    0.1302
    8   -1    2   -2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    0   -2    1   -0.1953    0.0495   -0.1952    0.0486    0.0010    1    0.0521    0.0726
   10    0    2   -2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    0    2   -4    0.5344   -0.6147    0.5303   -0.6130    0.0044    1    0.1668    0.1248
   12   -1   -2    1   -0.1813   -0.0372   -0.1829   -0.0381    0.0017    1    0.0668    0.0984
   13    1    2   -2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    1    2   -3    0.5313   -0.1502    0.5293   -0.1451    0.0054    1    0.0998    0.1473
   15   -2   -2    0   -0.3362   -0.2357   -0.3362   -0.2357    0.0000    1    0.1169    0.0881
   16    2    2   -2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0832    0.0679
   17    2    2   -4    0.7326   -0.0811    0.7293   -0.0807    0.0033    1    0.1549    0.1198
   18    1    1   -3    1.0639   -0.5147    1.0696   -0.4972    0.0184    1    0.1701    0.2483
   19    3    2   -2    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20    2    1   -2    0.4470    0.1666    0.4423    0.1634    0.0057    1    0.0794    0.1178
   21   -2    0    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22    2    0   -1    0.2997    0.3371    0.3053    0.3413    0.0070    1    0.0603    0.0899
   23    4   -2    0    0.0347    0.2749    0.0347    0.2716    0.0033    1    0.1081    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    0   -2    0   -0.7491   -0.0601   -0.7310   -0.0567    0.0184    1          0.0876          0.0702
    2   -3    2   -2   -0.0032   -0.2006   -0.0130   -0.1762    0.0263    1          0.1062          0.0995
    3    4   -4    2   -0.0325    0.0887   -0.0262    0.0895    0.0063    1          0.1267          0.0967
    4   -2    0   -2   -0.2079   -0.5835   -0.1957   -0.5833    0.0121    1          0.1369          0.1078
    5   -2    2   -2    0.0449   -0.2293    0.0560   -0.2234    0.0125    1          0.0843          0.0654
    6    2   -4    2   -0.1122    0.1194   -0.1085    0.1216    0.0044    1          0.0989          0.0778
    7   -2    2   -4    0.1081   -0.6028    0.1201   -0.5973    0.0132    1          0.1763          0.1302
    8   -1    3   -3    0.1741   -0.2094    0.1454   -0.2240    0.0322    1          0.0961          0.1017
    9    0   -2    1   -0.1984    0.0475   -0.1952    0.0486    0.0034    1          0.0504          0.0726
   10    0    2   -2    0.2257   -0.1323    0.2251   -0.1274    0.0049    1          0.0608          0.0467
   11    0    2   -4    0.5346   -0.6166    0.5303   -0.6130    0.0056    1          0.1678          0.1248
   12   -2   -4    2   -0.1825   -0.0365   -0.1829   -0.0381    0.0016    1          0.1311          0.0984
   13    1    2   -2    0.1975   -0.0083    0.1990   -0.0092    0.0017    1          0.0667          0.0927
   14    2    4   -6    0.5275   -0.1483    0.5293   -0.1451    0.0037    1          0.2011          0.1473
   15   -2   -2    0   -0.3398   -0.2325   -0.3362   -0.2357    0.0048    1          0.1150          0.0881
   16    2    2   -2    0.1244    0.0374    0.1275    0.0362    0.0033    1          0.0829          0.0679
   17    2    2   -4    0.7189   -0.0774    0.7293   -0.0807    0.0110    1          0.1556          0.1198
   18    1    1   -3    1.0471   -0.4942    1.0696   -0.4972    0.0227    1          0.1696          0.2483
   19    3    2   -2    0.0723    0.0402    0.0442    0.0295    0.0301    1          0.1048          0.0994
   20    4    2   -4    0.4361    0.1619    0.4423    0.1634    0.0064    1          0.1602          0.1178
   21   -2    0    0   -0.0412   -0.0533   -0.0341   -0.0579    0.0084    1          0.0575          0.0568
   22    4    0   -2    0.2957    0.3249    0.3053    0.3413    0.0190    1          0.1211          0.0899
   23    4   -2    0    0.0354    0.2718    0.0347    0.2716    0.0007    1          0.1064          0.0816

###            No.76                ###
# Bravais type
       Triclinic
# a : b : c  alpha  beta  gamma (degree) scale_factor (before refinement)
    1.0889    1.0892    1.0931  109.5407  109.3981  109.3105      0.2994
# a : b : c  alpha  beta  gamma (degree) scale_factor, a/c, b/c, a, b, c (after refinement)
    1.0949    1.0730    1.1194  110.0202  109.7778  109.5851      0.2922         0.9781    0.9586    3.7468    3.6721    3.8308
# propagation errors when the errors of the input angles are assumed to be within 1 deg.
    0.1757    0.2510    0.0635   20.1064    7.1767   15.6570      0.1403         0.1043    0.1726    1.8964    1.9608    1.8517
# Buerger-reduced reciprocal_lattice basis (before refinement)
 a1 = (    0.5685    0.9645    0.0725)
 a2 = (    0.6112    0.3544   -0.8726)
 a3 = (   -0.3341    0.8895   -0.5916)
# Buerger-reduced reciprocal_lattice basis, propagation errors
 a1 = (    0.5894    0.9598    0.0709) (    0.0096    0.0061    0.0304)
 a2 = (    0.6461    0.3603   -0.8847) (    0.0160    0.0135    0.3708)
 a3 = (   -0.2909    0.8886   -0.5923) (    0.0187    0.0145    0.2485)
# Euler angles: theta1, theta2, theta3, Error_theta1, Error_theta2, Error_theta3 (deg) (after refinement)
  176.1321  111.3614 -122.9661    1.4492    8.2465    0.5941
# Projection center shifts: Delta_x, Delta_y, Delta_z, Error_Delta_x, Error_Delta_y, Error_Delta_z, 
    0.0086    0.0002    0.0106      0.0024    0.0024    0.4167

# Number of computed bands
            179            193
# Figure of merit at the beginning and the end of the refinement
         3.2809         3.0192
# Chi-squares at the beginning and the end of the refinement
    1.3114    0.8555
# Indexing with the parameters before refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0   -2   -0.7307   -0.0607   -0.7310   -0.0567    0.0041    1    0.0889    0.0702
    2    3   -2    2    0.0092   -0.1962   -0.0130   -0.1762    0.0299    1    0.1082    0.0995
    3   -1    1   -2   -0.0272    0.0916   -0.0262    0.0895    0.0024    1    0.0650    0.0967
    4    4   -2    0   -0.1941   -0.5813   -0.1957   -0.5833    0.0026    1    0.1381    0.1078
    5    2   -2    2    0.0557   -0.2217    0.0560   -0.2234    0.0017    1    0.0859    0.0654
    6    0    2   -4   -0.1084    0.1207   -0.1085    0.1216    0.0009    1    0.1025    0.0778
    7    2   -2    1    0.1177   -0.5920    0.1201   -0.5973    0.0058    1    0.0882    0.1302
    8    1   -2    2    0.1424   -0.2192    0.1454   -0.2240    0.0056    1    0.0690    0.1017
    9    1    1   -2   -0.1952    0.0486   -0.1952    0.0486    0.0000    1    0.0520    0.0726
   10    0   -2    2    0.2251   -0.1274    0.2251   -0.1274    0.0000    1    0.0616    0.0467
   11    2   -4    2    0.5294   -0.6138    0.5303   -0.6130    0.0012    1    0.1664    0.1248
   12    2    1   -2   -0.1806   -0.0377   -0.1829   -0.0381    0.0022    1    0.0668    0.0984
   13   -1   -2    2    0.1987   -0.0085    0.1990   -0.0092    0.0007    1    0.0671    0.0927
   14    0   -3    2    0.5300   -0.1517    0.5293   -0.1451    0.0066    1    0.0998    0.1473
   15    4    0   -2   -0.3339   -0.2359   -0.3362   -0.2357    0.0023    1    0.1170    0.0881
   16   -2   -2    2    0.1275    0.0362    0.1275    0.0362    0.0000    1    0.0831    0.0679
   17    0   -4    2    0.7313   -0.0849    0.7293   -0.0807    0.0046    1    0.1547    0.1198
   18    1   -3    1    1.0544   -0.5215    1.0696   -0.4972    0.0287    1    0.1693    0.2483
   19   -3   -2    2    0.0762    0.0386    0.0442    0.0295    0.0333    1    0.1050    0.0994
   20   -1   -2    1    0.4478    0.1652    0.4423    0.1634    0.0058    1    0.0793    0.1178
   21    2    0    0   -0.0329   -0.0557   -0.0341   -0.0579    0.0025    1    0.0580    0.0568
   22   -1   -1    0    0.3015    0.3370    0.3053    0.3413    0.0058    1    0.0602    0.0899
   23   -2    0   -2    0.0348    0.2756    0.0347    0.2716    0.0040    1    0.1076    0.0816

# Indexing with the parameters after refinement
# Band_number, Miller_index, X_cal, Y_cal, X_obs, Y_obs, distance, good_fit?, band_width_cal, band_width_obs
    1    2    0   -2   -0.7491   -0.0601   -0.7310   -0.0567    0.0184    1          0.0877          0.0702
    2    3   -2    2   -0.0032   -0.2006   -0.0130   -0.1762    0.0263    1          0.1062          0.0995
    3   -2    2   -4   -0.0325    0.0887   -0.0262    0.0895    0.0063    1          0.1267          0.0967
    4    4   -2    0   -0.2079   -0.5835   -0.1957   -0.5833    0.0121    1          0.1370          0.1078
    5    2   -2    2    0.0449   -0.2293    0.0560   -0.2234    0.0125    1          0.0842          0.0654
    6    0    2   -4   -0.1122    0.1194   -0.1085    0.1216    0.0044    1          0.0989          0.0778
    7    4   -4    2    0.1081   -0.6028    0.1201   -0.5973    0.0132    1          0.1764          0.1302
    8    1   -3    3    0.1741   -0.2094    0.1454   -0.2240    0.0322    1          0.0961          0.1017
    9    1    1   -2   -0.1984    0.0475   -0.1952    0.0486    0.0034    1          0.0504          0.0726
   10    0   -2    2    0.2257   -0.1323    0.2251   -0.1274    0.0049    1          0.0607          0.0467
   11    2   -4    2    0.5346   -0.6166    0.5303   -0.6130    0.0056    1          0.1679          0.1248
   12    4    2   -4   -0.1825   -0.0365   -0.1829   -0.0381    0.0016    1          0.1311          0.0984
   13   -1   -2    2    0.1975   -0.0083    0.1990   -0.0092    0.0017    1          0.0667          0.0927
   14    0   -6    4    0.5275   -0.1483    0.5293   -0.1451    0.0037    1          0.2011          0.1473
   15    4    0   -2   -0.3398   -0.2325   -0.3362   -0.2357    0.0048    1          0.1150          0.0881
   16   -2   -2    2    0.1244    0.0374    0.1275    0.0362    0.0033    1          0.0829          0.0679
   17    0   -4    2    0.7189   -0.0774    0.7293   -0.0807    0.0110    1          0.1557          0.1198
   18    1   -3    1    1.0471   -0.4942    1.0696   -0.4972    0.0227    1          0.1698          0.2483
   19   -3   -2    2    0.0723    0.0402    0.0442    0.0295    0.0301    1          0.1047          0.0994
   20   -2   -4    2    0.4361    0.1619    0.4423    0.1634    0.0064    1          0.1603          0.1178
   21    2    0    0   -0.0412   -0.0533   -0.0341   -0.0579    0.0084    1          0.0575          0.0568
   22   -2   -2    0    0.2957    0.3249    0.3053    0.3413    0.0190    1          0.1212          0.0899
   23   -2    0   -2    0.0354    0.2718    0.0347    0.2716    0.0007    1          0.1064          0.0816

