# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.06140101
_cell_length_b   12.65846311
_cell_length_c   47.59980461
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.72438059
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10208.3914008
_cell_formula_units_Z   12
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Zr  Zr1  1  0.953778  0.935854  0.300400  1
  Zr  Zr2  1  0.503084  0.105472  0.264146  1
  Zr  Zr3  1  0.445359  0.291288  0.333106  1
  Zr  Zr4  1  0.999261  0.468128  0.294309  1
  Zr  Zr5  1  0.693227  0.224318  0.312491  1
  Zr  Zr6  1  0.236583  0.422758  0.274188  1
  Zr  Zr7  1  0.702060  0.999528  0.324200  1
  Zr  Zr8  1  0.258953  0.183022  0.286501  1
  Zr  Zr9  1  0.734661  0.705947  0.308994  1
  Zr  Zr10  1  0.288192  0.877900  0.273697  1
  Zr  Zr11  1  0.657090  0.523523  0.330030  1
  Zr  Zr12  1  0.208562  0.700631  0.292541  1
  Zr  Zr13  1  0.484191  0.931081  0.314074  1
  Zr  Zr14  1  0.041482  0.108509  0.278644  1
  Zr  Zr15  1  0.910906  0.299237  0.321756  1
  Zr  Zr16  1  0.462264  0.471567  0.283607  1
  Zr  Zr17  1  0.843003  0.590548  0.379580  1
  Zr  Zr18  1  0.398603  0.762711  0.339992  1
  Zr  Zr19  1  0.336067  0.946444  0.412412  1
  Zr  Zr20  1  0.890562  0.119230  0.373265  1
  Zr  Zr21  1  0.584780  0.880017  0.388551  1
  Zr  Zr22  1  0.137431  0.055381  0.348907  1
  Zr  Zr23  1  0.593770  0.658513  0.403100  1
  Zr  Zr24  1  0.147133  0.830235  0.363320  1
  Zr  Zr25  1  0.629256  0.357444  0.385349  1
  Zr  Zr26  1  0.184414  0.531192  0.344958  1
  Zr  Zr27  1  0.548526  0.179738  0.406589  1
  Zr  Zr28  1  0.102155  0.354194  0.367943  1
  Zr  Zr29  1  0.375869  0.586363  0.392591  1
  Zr  Zr30  1  0.929679  0.758664  0.352540  1
  Zr  Zr31  1  0.802775  0.951612  0.399116  1
  Zr  Zr32  1  0.355752  0.124629  0.361095  1
  Zr  Zr33  1  0.733531  0.246243  0.457191  1
  Zr  Zr34  1  0.288180  0.418491  0.417915  1
  Zr  Zr35  1  0.226776  0.601777  0.490380  1
  Zr  Zr36  1  0.781579  0.774323  0.451463  1
  Zr  Zr37  1  0.475039  0.535048  0.466804  1
  Zr  Zr38  1  0.030065  0.707428  0.427672  1
  Zr  Zr39  1  0.484717  0.313294  0.481007  1
  Zr  Zr40  1  0.039773  0.485881  0.441972  1
  Zr  Zr41  1  0.520648  0.013098  0.463112  1
  Zr  Zr42  1  0.074954  0.186123  0.424276  1
  Zr  Zr43  1  0.439846  0.835050  0.484485  1
  Zr  Zr44  1  0.994614  0.007446  0.445276  1
  Zr  Zr45  1  0.267111  0.241628  0.470506  1
  Zr  Zr46  1  0.821778  0.413607  0.431469  1
  Zr  Zr47  1  0.693197  0.605966  0.477401  1
  Zr  Zr48  1  0.247863  0.778958  0.438230  1
  Zr  Zr49  1  0.624760  0.900903  0.535199  1
  Zr  Zr50  1  0.179390  0.073506  0.496357  1
  Zr  Zr51  1  0.117986  0.256766  0.568822  1
  Zr  Zr52  1  0.672713  0.429064  0.529472  1
  Zr  Zr53  1  0.366310  0.189599  0.544712  1
  Zr  Zr54  1  0.921506  0.362087  0.505645  1
  Zr  Zr55  1  0.376342  0.967742  0.558926  1
  Zr  Zr56  1  0.931247  0.140346  0.519804  1
  Zr  Zr57  1  0.411694  0.667762  0.541370  1
  Zr  Zr58  1  0.966478  0.840137  0.502152  1
  Zr  Zr59  1  0.331031  0.489170  0.562462  1
  Zr  Zr60  1  0.885629  0.662158  0.523555  1
  Zr  Zr61  1  0.158368  0.896282  0.548479  1
  Zr  Zr62  1  0.713078  0.069312  0.509253  1
  Zr  Zr63  1  0.584406  0.261730  0.555168  1
  Zr  Zr64  1  0.139037  0.433629  0.516222  1
  Zr  Zr65  1  0.515368  0.556148  0.613350  1
  Zr  Zr66  1  0.070243  0.728679  0.574282  1
  Zr  Zr67  1  0.007476  0.912648  0.646719  1
  Zr  Zr68  1  0.563449  0.084529  0.607053  1
  Zr  Zr69  1  0.258854  0.845031  0.623340  1
  Zr  Zr70  1  0.812408  0.016883  0.583387  1
  Zr  Zr71  1  0.268248  0.619937  0.637871  1
  Zr  Zr72  1  0.821592  0.795264  0.598306  1
  Zr  Zr73  1  0.304222  0.320883  0.618639  1
  Zr  Zr74  1  0.857647  0.495607  0.580101  1
  Zr  Zr75  1  0.221693  0.144060  0.641659  1
  Zr  Zr76  1  0.776912  0.317816  0.601305  1
  Zr  Zr77  1  0.050291  0.550517  0.625752  1
  Zr  Zr78  1  0.603585  0.723762  0.587596  1
  Zr  Zr79  1  0.476226  0.916685  0.634015  1
  Zr  Zr80  1  0.030333  0.089112  0.594082  1
  Zr  Zr81  1  0.406965  0.207274  0.692257  1
  Zr  Zr82  1  0.960152  0.384679  0.653836  1
  Zr  Zr83  1  0.903112  0.565690  0.721905  1
  Zr  Zr84  1  0.452066  0.739428  0.686179  1
  Zr  Zr85  1  0.144871  0.493798  0.700633  1
  Zr  Zr86  1  0.703915  0.677123  0.662787  1
  Zr  Zr87  1  0.171191  0.250852  0.712375  1
  Zr  Zr88  1  0.712357  0.451598  0.674021  1
  Zr  Zr89  1  0.198024  0.974605  0.693965  1
  Zr  Zr90  1  0.749062  0.151473  0.656608  1
  Zr  Zr91  1  0.117225  0.796980  0.713026  1
  Zr  Zr92  1  0.671180  0.968532  0.677909  1
  Zr  Zr93  1  0.943631  0.203576  0.703082  1
  Zr  Zr94  1  0.495113  0.376098  0.664858  1
  Zr  Zr95  1  0.364776  0.566920  0.707938  1
  Zr  Zr96  1  0.921700  0.744324  0.672152  1
  Ni  Ni97  1  0.518200  0.881501  0.257643  1
  Ni  Ni98  1  0.970639  0.701139  0.295940  1
  Ni  Ni99  1  0.832660  0.828975  0.305749  1
  Ni  Ni100  1  0.383322  1.002844  0.269073  1
  Ni  Ni101  1  0.561359  0.396789  0.330317  1
  Ni  Ni102  1  0.111213  0.575986  0.292387  1
  Ni  Ni103  1  0.953261  0.315722  0.268445  1
  Ni  Ni104  1  0.398973  0.140387  0.306743  1
  Ni  Ni105  1  0.556265  0.259077  0.290616  1
  Ni  Ni106  1  0.998149  0.086858  0.330158  1
  Ni  Ni107  1  0.803112  0.030313  0.285631  1
  Ni  Ni108  1  0.249707  0.853374  0.323724  1
  Ni  Ni109  1  0.695764  0.552074  0.278610  1
  Ni  Ni110  1  0.146269  0.376951  0.314202  1
  Ni  Ni111  1  0.656718  0.086697  0.271199  1
  Ni  Ni112  1  0.105851  0.911344  0.309748  1
  Ni  Ni113  1  0.628059  0.907683  0.284494  1
  Ni  Ni114  1  0.074807  0.738025  0.324189  1
  Ni  Ni115  1  0.858890  0.662433  0.272942  1
  Ni  Ni116  1  0.316517  0.495869  0.309544  1
  Ni  Ni117  1  0.773805  0.352429  0.296192  1
  Ni  Ni118  1  0.217642  0.184115  0.336444  1
  Ni  Ni119  1  0.732555  0.222631  0.262397  1
  Ni  Ni120  1  0.180290  0.051401  0.297660  1
  Ni  Ni121  1  0.624380  0.412523  0.283144  1
  Ni  Ni122  1  0.069733  0.244981  0.320305  1
  Ni  Ni123  1  0.879231  0.172083  0.275545  1
  Ni  Ni124  1  0.323724  0.994166  0.315713  1
  Ni  Ni125  1  0.558144  0.085578  0.313802  1
  Ni  Ni126  1  0.109223  0.270708  0.274156  1
  Ni  Ni127  1  0.840335  0.144339  0.320840  1
  Ni  Ni128  1  0.389937  0.311825  0.280733  1
  Ni  Ni129  1  0.516113  0.605034  0.309928  1
  Ni  Ni130  1  0.066747  0.782565  0.272618  1
  Ni  Ni131  1  0.882660  0.615187  0.323899  1
  Ni  Ni132  1  0.440176  0.781673  0.283749  1
  Ni  Ni133  1  0.801929  0.493170  0.336931  1
  Ni  Ni134  1  0.358991  0.666280  0.298074  1
  Ni  Ni135  1  0.586605  0.735994  0.297027  1
  Ni  Ni136  1  0.141029  0.910629  0.262183  1
  Ni  Ni137  1  0.842075  0.489777  0.289430  1
  Ni  Ni138  1  0.291251  0.319806  0.325705  1
  Ni  Ni139  1  0.421802  0.527880  0.336885  1
  Ni  Ni140  1  0.866603  0.355349  0.376080  1
  Ni  Ni141  1  0.724330  0.484438  0.383852  1
  Ni  Ni142  1  0.281449  0.656599  0.344337  1
  Ni  Ni143  1  0.454301  0.052931  0.408352  1
  Ni  Ni144  1  0.009625  0.225579  0.369314  1
  Ni  Ni145  1  0.842034  0.972341  0.342534  1
  Ni  Ni146  1  0.286582  0.798924  0.382549  1
  Ni  Ni147  1  0.446283  0.910981  0.369618  1
  Ni  Ni148  1  0.891138  0.739434  0.408676  1
  Ni  Ni149  1  0.695155  0.680083  0.362032  1
  Ni  Ni150  1  0.140702  0.508092  0.400052  1
  Ni  Ni151  1  0.591345  0.201593  0.352792  1
  Ni  Ni152  1  0.038145  0.030730  0.390918  1
  Ni  Ni153  1  0.551724  0.735699  0.347149  1
  Ni  Ni154  1  0.995661  0.564914  0.386829  1
  Ni  Ni155  1  0.526529  0.561336  0.363900  1
  Ni  Ni156  1  0.972396  0.389251  0.402628  1
  Ni  Ni157  1  0.760041  0.322486  0.349417  1
  Ni  Ni158  1  0.203903  0.150767  0.388879  1
  Ni  Ni159  1  0.663317  0.008807  0.375706  1
  Ni  Ni160  1  0.109140  0.836840  0.414695  1
  Ni  Ni161  1  0.623094  0.872004  0.336926  1
  Ni  Ni162  1  0.068759  0.701015  0.376224  1
  Ni  Ni163  1  0.515146  0.066621  0.360026  1
  Ni  Ni164  1  0.962196  0.892711  0.399182  1
  Ni  Ni165  1  0.770715  0.818345  0.353926  1
  Ni  Ni166  1  0.216256  0.645048  0.392198  1
  Ni  Ni167  1  0.448819  0.739833  0.393087  1
  Ni  Ni168  1  1.000357  0.915062  0.352991  1
  Ni  Ni169  1  0.729749  0.797654  0.399544  1
  Ni  Ni170  1  0.281720  0.972274  0.360916  1
  Ni  Ni171  1  0.403294  0.266761  0.388620  1
  Ni  Ni172  1  0.958132  0.439630  0.348868  1
  Ni  Ni173  1  0.775466  0.271069  0.402511  1
  Ni  Ni174  1  0.329975  0.443303  0.362783  1
  Ni  Ni175  1  0.695355  0.144887  0.414490  1
  Ni  Ni176  1  0.249338  0.318420  0.374859  1
  Ni  Ni177  1  0.481763  0.392393  0.377297  1
  Ni  Ni178  1  0.034856  0.566892  0.337719  1
  Ni  Ni179  1  0.737086  0.144225  0.366156  1
  Ni  Ni180  1  0.181735  0.973765  0.405160  1
  Ni  Ni181  1  0.311254  0.183599  0.415335  1
  Ni  Ni182  1  0.757623  0.010295  0.454125  1
  Ni  Ni183  1  0.615352  0.140077  0.461113  1
  Ni  Ni184  1  0.169748  0.313470  0.422086  1
  Ni  Ni185  1  0.345086  0.707963  0.486561  1
  Ni  Ni186  1  0.899908  0.880401  0.447333  1
  Ni  Ni187  1  0.732812  0.626042  0.422200  1
  Ni  Ni188  1  0.178779  0.454106  0.460737  1
  Ni  Ni189  1  0.336171  0.566669  0.447803  1
  Ni  Ni190  1  0.782463  0.393892  0.486839  1
  Ni  Ni191  1  0.585844  0.334569  0.439428  1
  Ni  Ni192  1  0.032193  0.161884  0.478278  1
  Ni  Ni193  1  0.483596  0.858612  0.430245  1
  Ni  Ni194  1  0.928775  0.686220  0.469363  1
  Ni  Ni195  1  0.441474  0.392191  0.425812  1
  Ni  Ni196  1  0.887729  0.219481  0.464489  1
  Ni  Ni197  1  0.418143  0.216315  0.441646  1
  Ni  Ni198  1  0.864434  0.043467  0.480579  1
  Ni  Ni199  1  0.650811  0.976634  0.427953  1
  Ni  Ni200  1  0.096576  0.804121  0.466725  1
  Ni  Ni201  1  0.553984  0.664626  0.454093  1
  Ni  Ni202  1  0.999754  0.492185  0.493012  1
  Ni  Ni203  1  0.514953  0.528725  0.415897  1
  Ni  Ni204  1  0.960772  0.356201  0.454681  1
  Ni  Ni205  1  0.406874  0.721290  0.438558  1
  Ni  Ni206  1  0.852672  0.548412  0.477435  1
  Ni  Ni207  1  0.661885  0.472206  0.431569  1
  Ni  Ni208  1  0.107822  0.299941  0.470342  1
  Ni  Ni209  1  0.339669  0.394857  0.470601  1
  Ni  Ni210  1  0.894908  0.567514  0.431854  1
  Ni  Ni211  1  0.619762  0.453492  0.477082  1
  Ni  Ni212  1  0.175274  0.625763  0.437822  1
  Ni  Ni213  1  0.294375  0.921154  0.466936  1
  Ni  Ni214  1  0.848804  0.094062  0.427782  1
  Ni  Ni215  1  0.666375  0.926903  0.480784  1
  Ni  Ni216  1  0.220585  0.099451  0.441726  1
  Ni  Ni217  1  0.586715  0.799967  0.492677  1
  Ni  Ni218  1  0.141282  0.972617  0.453635  1
  Ni  Ni219  1  0.373752  0.048002  0.454999  1
  Ni  Ni220  1  0.928800  0.220241  0.415931  1
  Ni  Ni221  1  0.627639  0.800819  0.444244  1
  Ni  Ni222  1  0.073209  0.628288  0.483051  1
  Ni  Ni223  1  0.203111  0.837606  0.493355  1
  Ni  Ni224  1  0.648733  0.664983  0.532569  1
  Ni  Ni225  1  0.506506  0.794803  0.539309  1
  Ni  Ni226  1  0.061147  0.967293  0.500117  1
  Ni  Ni227  1  0.236156  0.361949  0.564669  1
  Ni  Ni228  1  0.790907  0.535271  0.525579  1
  Ni  Ni229  1  0.623796  0.281411  0.499821  1
  Ni  Ni230  1  0.070039  0.108588  0.538910  1
  Ni  Ni231  1  0.227353  0.221144  0.525993  1
  Ni  Ni232  1  0.673341  0.049328  0.564411  1
  Ni  Ni233  1  0.477499  0.989047  0.517272  1
  Ni  Ni234  1  0.922725  0.816591  0.556394  1
  Ni  Ni235  1  0.374031  0.513412  0.508416  1
  Ni  Ni236  1  0.820380  0.340830  0.547230  1
  Ni  Ni237  1  0.332980  0.046995  0.503630  1
  Ni  Ni238  1  0.778662  0.874403  0.542430  1
  Ni  Ni239  1  0.309680  0.871047  0.519952  1
  Ni  Ni240  1  0.755538  0.698735  0.558797  1
  Ni  Ni241  1  0.541923  0.631785  0.506059  1
  Ni  Ni242  1  0.988049  0.459007  0.545048  1
  Ni  Ni243  1  0.445360  0.319201  0.531965  1
  Ni  Ni244  1  0.891344  0.146667  0.570676  1
  Ni  Ni245  1  0.406467  0.183139  0.493685  1
  Ni  Ni246  1  0.852385  0.010602  0.532491  1
  Ni  Ni247  1  0.298265  0.375443  0.516381  1
  Ni  Ni248  1  0.744288  0.203244  0.555072  1
  Ni  Ni249  1  0.553581  0.126918  0.509232  1
  Ni  Ni250  1  0.999344  0.954018  0.548092  1
  Ni  Ni251  1  0.231125  0.049289  0.548892  1
  Ni  Ni252  1  0.786534  0.221743  0.509576  1
  Ni  Ni253  1  0.511250  0.107790  0.554784  1
  Ni  Ni254  1  0.066479  0.280420  0.516130  1
  Ni  Ni255  1  0.185543  0.575773  0.545023  1
  Ni  Ni256  1  0.739982  0.748274  0.505895  1
  Ni  Ni257  1  0.557504  0.581245  0.558882  1
  Ni  Ni258  1  0.111839  0.754117  0.519767  1
  Ni  Ni259  1  0.477308  0.455079  0.570673  1
  Ni  Ni260  1  0.032491  0.627257  0.531702  1
  Ni  Ni261  1  0.264931  0.702603  0.533099  1
  Ni  Ni262  1  0.819620  0.875265  0.493990  1
  Ni  Ni263  1  0.518556  0.455841  0.522136  1
  Ni  Ni264  1  0.964719  0.283194  0.560858  1
  Ni  Ni265  1  0.094834  0.491731  0.571454  1
  Ni  Ni266  1  0.539618  0.320043  0.610573  1
  Ni  Ni267  1  0.396483  0.449687  0.617313  1
  Ni  Ni268  1  0.951871  0.622369  0.578334  1
  Ni  Ni269  1  0.124524  0.018767  0.642353  1
  Ni  Ni270  1  0.681832  0.190835  0.602788  1
  Ni  Ni271  1  0.515234  0.935742  0.577955  1
  Ni  Ni272  1  0.960488  0.763918  0.617008  1
  Ni  Ni273  1  0.119397  0.876269  0.604171  1
  Ni  Ni274  1  0.564180  0.702843  0.644114  1
  Ni  Ni275  1  0.367790  0.644568  0.595761  1
  Ni  Ni276  1  0.814460  0.473821  0.633800  1
  Ni  Ni277  1  0.265549  0.167130  0.586628  1
  Ni  Ni278  1  0.711215  0.995163  0.624849  1
  Ni  Ni279  1  0.224303  0.701521  0.581574  1
  Ni  Ni280  1  0.668837  0.531246  0.620467  1
  Ni  Ni281  1  0.202111  0.524611  0.597990  1
  Ni  Ni282  1  0.646128  0.352814  0.637251  1
  Ni  Ni283  1  0.433973  0.285997  0.584010  1
  Ni  Ni284  1  0.879693  0.114380  0.622647  1
  Ni  Ni285  1  0.337321  0.974265  0.610329  1
  Ni  Ni286  1  0.782970  0.803941  0.649855  1
  Ni  Ni287  1  0.297148  0.838369  0.571984  1
  Ni  Ni288  1  0.742783  0.666567  0.611131  1
  Ni  Ni289  1  0.189815  0.030213  0.594476  1
  Ni  Ni290  1  0.635288  0.857219  0.632778  1
  Ni  Ni291  1  0.444075  0.782415  0.587424  1
  Ni  Ni292  1  0.891131  0.608620  0.626652  1
  Ni  Ni293  1  0.123710  0.703221  0.626002  1
  Ni  Ni294  1  0.676669  0.877752  0.587172  1
  Ni  Ni295  1  0.405676  0.760230  0.633586  1
  Ni  Ni296  1  0.957402  0.935455  0.593577  1
  Ni  Ni297  1  0.075934  0.232440  0.624014  1
  Ni  Ni298  1  0.630678  0.404287  0.584155  1
  Ni  Ni299  1  0.448294  0.235315  0.637724  1
  Ni  Ni300  1  1.002779  0.408636  0.598129  1
  Ni  Ni301  1  0.371285  0.108526  0.648834  1
  Ni  Ni302  1  0.924414  0.283138  0.609388  1
  Ni  Ni303  1  0.156878  0.356902  0.611939  1
  Ni  Ni304  1  0.710935  0.530452  0.572200  1
  Ni  Ni305  1  0.410792  0.110171  0.599732  1
  Ni  Ni306  1  0.855249  0.939517  0.638920  1
  Ni  Ni307  1  0.984278  0.147857  0.649824  1
  Ni  Ni308  1  0.435289  0.974348  0.690678  1
  Ni  Ni309  1  0.295466  0.098940  0.694134  1
  Ni  Ni310  1  0.844575  0.278743  0.656325  1
  Ni  Ni311  1  0.016991  0.676487  0.717887  1
  Ni  Ni312  1  0.572386  0.846486  0.680899  1
  Ni  Ni313  1  0.407618  0.588487  0.656396  1
  Ni  Ni314  1  0.848647  0.416410  0.696022  1
  Ni  Ni315  1  1.006245  0.535890  0.679825  1
  Ni  Ni316  1  0.452512  0.359695  0.718143  1
  Ni  Ni317  1  0.259746  0.298594  0.672376  1
  Ni  Ni318  1  0.710193  0.122649  0.708058  1
  Ni  Ni319  1  0.156296  0.821811  0.663093  1
  Ni  Ni320  1  0.602559  0.645003  0.701028  1
  Ni  Ni321  1  0.114609  0.355681  0.661150  1
  Ni  Ni322  1  0.564053  0.185282  0.697217  1
  Ni  Ni323  1  0.089582  0.179359  0.677204  1
  Ni  Ni324  1  0.546967  0.012891  0.713774  1
  Ni  Ni325  1  0.331457  0.937122  0.662373  1
  Ni  Ni326  1  0.782696  0.767217  0.702505  1
  Ni  Ni327  1  0.225773  0.623131  0.689116  1
  Ni  Ni328  1  0.674049  0.452777  0.724123  1
  Ni  Ni329  1  0.188088  0.491263  0.650589  1
  Ni  Ni330  1  0.632242  0.322604  0.690431  1
  Ni  Ni331  1  0.081629  0.681517  0.671301  1
  Ni  Ni332  1  0.527130  0.502739  0.711163  1
  Ni  Ni333  1  0.336427  0.430269  0.666277  1
  Ni  Ni334  1  0.781396  0.262556  0.703410  1
  Ni  Ni335  1  0.017577  0.362983  0.705986  1
  Ni  Ni336  1  0.565228  0.531075  0.665804  1
  Ni  Ni337  1  0.295790  0.405868  0.712240  1
  Ni  Ni338  1  0.847477  0.589948  0.672634  1
  Ni  Ni339  1  0.964640  0.894717  0.702508  1
  Ni  Ni340  1  0.523666  0.059686  0.662706  1
  Ni  Ni341  1  0.339372  0.892342  0.714040  1
  Ni  Ni342  1  0.890137  0.070672  0.676494  1
  Ni  Ni343  1  0.264525  0.764586  0.724376  1
  Ni  Ni344  1  0.818238  0.942056  0.687895  1
  Ni  Ni345  1  0.047083  0.008724  0.688648  1
  Ni  Ni346  1  0.604190  0.181972  0.649745  1
  Ni  Ni347  1  0.300151  0.763863  0.676884  1
  Ni  Ni348  1  0.748979  0.590286  0.715441  1
