# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.61174445
_cell_length_b   23.98608351
_cell_length_c   51.27942489
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.80865587
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   9296.36187281
_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  0.493813  0.111576  0.254762  1
  Zr  Zr2  1  0.966369  0.453882  0.289059  1
  Zr  Zr3  1  0.385974  0.800398  0.332358  1
  Zr  Zr4  1  0.897089  0.283268  0.282867  1
  Zr  Zr5  1  0.216443  0.626421  0.329849  1
  Zr  Zr6  1  0.646303  0.970797  0.370245  1
  Zr  Zr7  1  0.418403  0.346029  0.312863  1
  Zr  Zr8  1  0.722646  0.685395  0.358004  1
  Zr  Zr9  1  0.970074  0.010877  0.271547  1
  Zr  Zr10  1  0.319507  0.084047  0.346441  1
  Zr  Zr11  1  0.454351  0.391885  0.261350  1
  Zr  Zr12  1  0.878961  0.740493  0.305332  1
  Zr  Zr13  1  0.361312  0.195599  0.296534  1
  Zr  Zr14  1  0.676930  0.535728  0.340307  1
  Zr  Zr15  1  0.909168  0.846133  0.259480  1
  Zr  Zr16  1  0.371975  0.235588  0.360446  1
  Zr  Zr17  1  0.498839  0.543737  0.279965  1
  Zr  Zr18  1  0.924888  0.889258  0.320965  1
  Zr  Zr19  1  0.840824  0.104729  0.308986  1
  Zr  Zr20  1  0.144442  0.450312  0.350171  1
  Zr  Zr21  1  0.386699  0.762059  0.269331  1
  Zr  Zr22  1  0.903507  0.321507  0.347527  1
  Zr  Zr23  1  0.027163  0.633207  0.270994  1
  Zr  Zr24  1  0.454876  0.977675  0.309372  1
  Zr  Zr25  1  0.832362  0.145194  0.372632  1
  Zr  Zr26  1  0.147144  0.483815  0.416301  1
  Zr  Zr27  1  0.572064  0.829046  0.457261  1
  Zr  Zr28  1  0.081637  0.317720  0.408820  1
  Zr  Zr29  1  0.405822  0.657720  0.454930  1
  Zr  Zr30  1  0.835055  0.002104  0.494764  1
  Zr  Zr31  1  0.600267  0.378319  0.438683  1
  Zr  Zr32  1  0.911887  0.716417  0.482811  1
  Zr  Zr33  1  0.153896  0.030193  0.398428  1
  Zr  Zr34  1  0.502751  0.115729  0.469121  1
  Zr  Zr35  1  0.629530  0.423250  0.386209  1
  Zr  Zr36  1  0.065820  0.769286  0.429371  1
  Zr  Zr37  1  0.541510  0.226562  0.421387  1
  Zr  Zr38  1  0.863794  0.567026  0.465860  1
  Zr  Zr39  1  0.104757  0.881072  0.382181  1
  Zr  Zr40  1  0.553016  0.265787  0.485570  1
  Zr  Zr41  1  0.687301  0.574527  0.404797  1
  Zr  Zr42  1  0.114608  0.919692  0.445423  1
  Zr  Zr43  1  0.015091  0.137475  0.432757  1
  Zr  Zr44  1  0.330278  0.481706  0.476546  1
  Zr  Zr45  1  0.574739  0.791604  0.392958  1
  Zr  Zr46  1  0.086400  0.351266  0.474634  1
  Zr  Zr47  1  0.215109  0.663483  0.394052  1
  Zr  Zr48  1  0.644587  0.008090  0.434582  1
  Zr  Zr49  1  0.010914  0.174785  0.496704  1
  Zr  Zr50  1  0.335055  0.515337  0.542300  1
  Zr  Zr51  1  0.760009  0.860180  0.582079  1
  Zr  Zr52  1  0.269248  0.348895  0.534774  1
  Zr  Zr53  1  0.591885  0.688690  0.580369  1
  Zr  Zr54  1  0.018232  0.032612  0.618549  1
  Zr  Zr55  1  0.787221  0.409292  0.564533  1
  Zr  Zr56  1  0.098037  0.747509  0.608351  1
  Zr  Zr57  1  0.343021  0.062349  0.522353  1
  Zr  Zr58  1  0.690689  0.147626  0.593285  1
  Zr  Zr59  1  0.816762  0.454719  0.512469  1
  Zr  Zr60  1  0.253939  0.800443  0.554430  1
  Zr  Zr61  1  0.728265  0.257766  0.546479  1
  Zr  Zr62  1  0.050063  0.597962  0.591648  1
  Zr  Zr63  1  0.293274  0.911747  0.506705  1
  Zr  Zr64  1  0.740300  0.296657  0.610897  1
  Zr  Zr65  1  0.874895  0.605861  0.530414  1
  Zr  Zr66  1  0.302514  0.950771  0.569823  1
  Zr  Zr67  1  0.200639  0.169448  0.557149  1
  Zr  Zr68  1  0.517263  0.512293  0.602703  1
  Zr  Zr69  1  0.763301  0.822751  0.517823  1
  Zr  Zr70  1  0.274184  0.382257  0.600561  1
  Zr  Zr71  1  0.402390  0.694685  0.519359  1
  Zr  Zr72  1  0.831824  0.039823  0.558731  1
  Zr  Zr73  1  0.197981  0.206001  0.621598  1
  Zr  Zr74  1  0.522658  0.546201  0.668238  1
  Zr  Zr75  1  0.948445  0.894652  0.707333  1
  Zr  Zr76  1  0.457071  0.378381  0.660859  1
  Zr  Zr77  1  0.763138  0.714572  0.705543  1
  Zr  Zr78  1  0.350224  0.064810  0.736714  1
  Zr  Zr79  1  0.977496  0.439784  0.690552  1
  Zr  Zr80  1  0.279879  0.779743  0.730310  1
  Zr  Zr81  1  0.529579  0.094322  0.645270  1
  Zr  Zr82  1  0.876323  0.165910  0.720335  1
  Zr  Zr83  1  1.003310  0.484945  0.637908  1
  Zr  Zr84  1  0.444749  0.833439  0.679410  1
  Zr  Zr85  1  0.919177  0.288559  0.671662  1
  Zr  Zr86  1  0.232235  0.629081  0.716421  1
  Zr  Zr87  1  0.479596  0.942803  0.631097  1
  Zr  Zr88  1  0.932164  0.329910  0.734287  1
  Zr  Zr89  1  0.061037  0.637317  0.655942  1
  Zr  Zr90  1  0.486307  0.981896  0.694304  1
  Zr  Zr91  1  0.391010  0.200273  0.682532  1
  Zr  Zr92  1  0.697321  0.541633  0.727432  1
  Zr  Zr93  1  0.949513  0.854554  0.642813  1
  Zr  Zr94  1  0.462762  0.410983  0.725933  1
  Zr  Zr95  1  0.588316  0.726402  0.644678  1
  Zr  Zr96  1  0.009421  0.072405  0.682293  1
  Ni  Ni97  1  0.870026  0.215224  0.327394  1
  Ni  Ni98  1  0.999042  0.529857  0.249047  1
  Ni  Ni99  1  0.423281  0.873980  0.287352  1
  Ni  Ni100  1  0.578662  0.163931  0.335907  1
  Ni  Ni101  1  0.696505  0.477433  0.253687  1
  Ni  Ni102  1  0.136594  0.819957  0.294778  1
  Ni  Ni103  1  0.158199  0.266348  0.321184  1
  Ni  Ni104  1  0.469797  0.606872  0.367027  1
  Ni  Ni105  1  0.730098  0.924797  0.282887  1
  Ni  Ni106  1  0.636548  0.060576  0.346263  1
  Ni  Ni107  1  0.781647  0.376206  0.257857  1
  Ni  Ni108  1  0.194957  0.716191  0.305031  1
  Ni  Ni109  1  0.098136  0.365399  0.309956  1
  Ni  Ni110  1  0.407844  0.709957  0.356669  1
  Ni  Ni111  1  0.649072  0.026648  0.274086  1
  Ni  Ni112  1  0.158960  0.117631  0.256820  1
  Ni  Ni113  1  0.628109  0.454949  0.300007  1
  Ni  Ni114  1  0.052912  0.805753  0.343054  1
  Ni  Ni115  1  0.238471  0.286799  0.273754  1
  Ni  Ni116  1  0.549545  0.620549  0.319123  1
  Ni  Ni117  1  0.977694  0.965107  0.359569  1
  Ni  Ni118  1  0.833918  0.116908  0.258867  1
  Ni  Ni119  1  0.303572  0.451324  0.299529  1
  Ni  Ni120  1  0.717171  0.794492  0.343006  1
  Ni  Ni121  1  0.117316  0.163580  0.335191  1
  Ni  Ni122  1  0.258154  0.476366  0.253284  1
  Ni  Ni123  1  0.665997  0.819161  0.295473  1
  Ni  Ni124  1  0.613494  0.265045  0.320298  1
  Ni  Ni125  1  0.930303  0.607453  0.366612  1
  Ni  Ni126  1  0.148181  0.924726  0.282618  1
  Ni  Ni127  1  0.586414  0.338412  0.355657  1
  Ni  Ni128  1  0.697385  0.648957  0.278831  1
  Ni  Ni129  1  0.126312  0.997010  0.317580  1
  Ni  Ni130  1  0.172170  0.092134  0.300308  1
  Ni  Ni131  1  0.461944  0.432960  0.343191  1
  Ni  Ni132  1  0.710542  0.743768  0.261506  1
  Ni  Ni133  1  0.248951  0.340255  0.358058  1
  Ni  Ni134  1  0.369112  0.647157  0.280322  1
  Ni  Ni135  1  0.799182  0.992873  0.319186  1
  Ni  Ni136  1  0.496039  0.090185  0.301916  1
  Ni  Ni137  1  0.797937  0.430577  0.340077  1
  Ni  Ni138  1  0.043936  0.743136  0.260649  1
  Ni  Ni139  1  0.979683  0.062416  0.351612  1
  Ni  Ni140  1  0.116877  0.376776  0.263782  1
  Ni  Ni141  1  0.539196  0.717840  0.309932  1
  Ni  Ni142  1  0.744778  0.362445  0.304153  1
  Ni  Ni143  1  0.062469  0.708217  0.351888  1
  Ni  Ni144  1  0.301284  0.023747  0.271669  1
  Ni  Ni145  1  0.698822  0.212345  0.245148  1
  Ni  Ni146  1  0.177064  0.549013  0.289905  1
  Ni  Ni147  1  0.601764  0.895220  0.330080  1
  Ni  Ni148  1  0.685020  0.184903  0.288294  1
  Ni  Ni149  1  0.999171  0.532362  0.330349  1
  Ni  Ni150  1  0.428442  0.876950  0.371585  1
  Ni  Ni151  1  0.366837  0.209784  0.247504  1
  Ni  Ni152  1  0.829010  0.549918  0.289603  1
  Ni  Ni153  1  0.256624  0.895808  0.329655  1
  Ni  Ni154  1  0.032932  0.190138  0.285449  1
  Ni  Ni155  1  0.346399  0.531114  0.330559  1
  Ni  Ni156  1  0.772604  0.874636  0.372185  1
  Ni  Ni157  1  0.567246  0.287862  0.272438  1
  Ni  Ni158  1  0.882460  0.630934  0.319017  1
  Ni  Ni159  1  0.308678  0.974794  0.359476  1
  Ni  Ni160  1  0.049973  0.246321  0.452754  1
  Ni  Ni161  1  0.178889  0.554840  0.373058  1
  Ni  Ni162  1  0.609684  0.899788  0.413672  1
  Ni  Ni163  1  0.758349  0.194495  0.459346  1
  Ni  Ni164  1  0.886839  0.503585  0.378351  1
  Ni  Ni165  1  0.319873  0.849011  0.419799  1
  Ni  Ni166  1  0.342674  0.297532  0.447028  1
  Ni  Ni167  1  0.658288  0.638108  0.492320  1
  Ni  Ni168  1  0.898685  0.951181  0.407666  1
  Ni  Ni169  1  0.817125  0.091827  0.469842  1
  Ni  Ni170  1  0.950332  0.403891  0.386103  1
  Ni  Ni171  1  0.380710  0.746332  0.429947  1
  Ni  Ni172  1  0.279635  0.397728  0.438819  1
  Ni  Ni173  1  0.597041  0.740369  0.482178  1
  Ni  Ni174  1  0.838692  0.054039  0.397271  1
  Ni  Ni175  1  0.500106  0.150603  0.383128  1
  Ni  Ni176  1  0.812377  0.485487  0.426611  1
  Ni  Ni177  1  0.238532  0.835521  0.467748  1
  Ni  Ni178  1  0.417590  0.316291  0.398820  1
  Ni  Ni179  1  0.739747  0.651351  0.444185  1
  Ni  Ni180  1  0.167257  0.995854  0.484383  1
  Ni  Ni181  1  0.168039  0.141858  0.383000  1
  Ni  Ni182  1  0.485894  0.482512  0.426285  1
  Ni  Ni183  1  0.906335  0.824402  0.467842  1
  Ni  Ni184  1  0.298573  0.193904  0.459784  1
  Ni  Ni185  1  0.434393  0.505226  0.378733  1
  Ni  Ni186  1  0.859593  0.847584  0.420278  1
  Ni  Ni187  1  0.794687  0.296213  0.446630  1
  Ni  Ni188  1  0.117773  0.638587  0.491940  1
  Ni  Ni189  1  0.361227  0.952492  0.407185  1
  Ni  Ni190  1  0.769900  0.369327  0.481594  1
  Ni  Ni191  1  0.888078  0.679805  0.402876  1
  Ni  Ni192  1  0.318284  0.025472  0.443255  1
  Ni  Ni193  1  0.341943  0.120426  0.423809  1
  Ni  Ni194  1  0.646674  0.463644  0.469598  1
  Ni  Ni195  1  0.902303  0.775514  0.383986  1
  Ni  Ni196  1  0.433085  0.370803  0.484171  1
  Ni  Ni197  1  0.555573  0.677064  0.404684  1
  Ni  Ni198  1  0.985389  0.022354  0.444781  1
  Ni  Ni199  1  0.673785  0.123260  0.422730  1
  Ni  Ni200  1  0.983718  0.462110  0.466981  1
  Ni  Ni201  1  0.234512  0.778355  0.382556  1
  Ni  Ni202  1  0.163173  0.093276  0.475172  1
  Ni  Ni203  1  0.302669  0.408856  0.392040  1
  Ni  Ni204  1  0.726562  0.747699  0.435358  1
  Ni  Ni205  1  0.926598  0.392922  0.433067  1
  Ni  Ni206  1  0.250815  0.738704  0.476746  1
  Ni  Ni207  1  0.495437  0.052632  0.392427  1
  Ni  Ni208  1  0.047495  0.240119  0.369807  1
  Ni  Ni209  1  0.360936  0.579433  0.415097  1
  Ni  Ni210  1  0.790548  0.923172  0.455650  1
  Ni  Ni211  1  0.868119  0.221534  0.411249  1
  Ni  Ni212  1  0.186537  0.563545  0.456133  1
  Ni  Ni213  1  0.617252  0.907707  0.496504  1
  Ni  Ni214  1  0.703891  0.240743  0.369385  1
  Ni  Ni215  1  0.015651  0.579658  0.414487  1
  Ni  Ni216  1  0.445663  0.925415  0.455260  1
  Ni  Ni217  1  0.213066  0.222160  0.411751  1
  Ni  Ni218  1  0.532600  0.562356  0.456437  1
  Ni  Ni219  1  0.962044  0.905416  0.496909  1
  Ni  Ni220  1  0.744570  0.319252  0.398967  1
  Ni  Ni221  1  0.071625  0.661063  0.443991  1
  Ni  Ni222  1  0.499503  0.006587  0.484255  1
  Ni  Ni223  1  0.236776  0.277510  0.578204  1
  Ni  Ni224  1  0.366786  0.586548  0.498750  1
  Ni  Ni225  1  0.797887  0.931165  0.538342  1
  Ni  Ni226  1  0.945320  0.225566  0.584411  1
  Ni  Ni227  1  0.074390  0.535340  0.504371  1
  Ni  Ni228  1  0.508205  0.880133  0.544532  1
  Ni  Ni229  1  0.529462  0.328686  0.572651  1
  Ni  Ni230  1  0.844419  0.669152  0.617901  1
  Ni  Ni231  1  0.087483  0.982310  0.532154  1
  Ni  Ni232  1  1.005738  0.123110  0.594112  1
  Ni  Ni233  1  0.136862  0.435123  0.512376  1
  Ni  Ni234  1  0.569005  0.777362  0.555058  1
  Ni  Ni235  1  0.467047  0.428995  0.564754  1
  Ni  Ni236  1  0.783704  0.771469  0.607223  1
  Ni  Ni237  1  0.028234  0.085283  0.521753  1
  Ni  Ni238  1  0.678630  0.181001  0.507270  1
  Ni  Ni239  1  1.000152  0.516866  0.552526  1
  Ni  Ni240  1  0.426368  0.866693  0.592587  1
  Ni  Ni241  1  0.604046  0.347211  0.524535  1
  Ni  Ni242  1  0.925509  0.682434  0.569679  1
  Ni  Ni243  1  0.351389  0.026669  0.608156  1
  Ni  Ni244  1  0.346931  0.171874  0.507517  1
  Ni  Ni245  1  0.673197  0.513891  0.552241  1
  Ni  Ni246  1  0.094409  0.855329  0.592711  1
  Ni  Ni247  1  0.484731  0.225243  0.584828  1
  Ni  Ni248  1  0.621987  0.536669  0.504661  1
  Ni  Ni249  1  0.047483  0.878649  0.545061  1
  Ni  Ni250  1  0.981784  0.327234  0.572296  1
  Ni  Ni251  1  0.304157  0.669689  0.617463  1
  Ni  Ni252  1  0.548302  0.983831  0.531656  1
  Ni  Ni253  1  0.957807  0.399929  0.607410  1
  Ni  Ni254  1  0.074898  0.710884  0.528238  1
  Ni  Ni255  1  0.505487  0.057054  0.567535  1
  Ni  Ni256  1  0.526719  0.152374  0.548429  1
  Ni  Ni257  1  0.833709  0.494468  0.595403  1
  Ni  Ni258  1  0.090759  0.806235  0.509035  1
  Ni  Ni259  1  0.621005  0.401701  0.610133  1
  Ni  Ni260  1  0.743424  0.708345  0.529850  1
  Ni  Ni261  1  0.173157  0.054015  0.568722  1
  Ni  Ni262  1  0.859456  0.154977  0.546881  1
  Ni  Ni263  1  0.171462  0.493154  0.592886  1
  Ni  Ni264  1  0.422276  0.809134  0.507470  1
  Ni  Ni265  1  0.349954  0.124602  0.599269  1
  Ni  Ni266  1  0.490305  0.440012  0.517979  1
  Ni  Ni267  1  0.914634  0.778763  0.560453  1
  Ni  Ni268  1  0.113798  0.424005  0.559123  1
  Ni  Ni269  1  0.437166  0.769849  0.601798  1
  Ni  Ni270  1  0.682967  0.084062  0.516419  1
  Ni  Ni271  1  0.229755  0.269231  0.495240  1
  Ni  Ni272  1  0.548744  0.611107  0.540706  1
  Ni  Ni273  1  0.978412  0.954459  0.580070  1
  Ni  Ni274  1  0.054572  0.253108  0.536210  1
  Ni  Ni275  1  0.373261  0.594370  0.581903  1
  Ni  Ni276  1  0.803135  0.938172  0.621107  1
  Ni  Ni277  1  0.884024  0.270443  0.494846  1
  Ni  Ni278  1  0.203337  0.611138  0.540137  1
  Ni  Ni279  1  0.633845  0.956674  0.579669  1
  Ni  Ni280  1  0.400255  0.253131  0.536840  1
  Ni  Ni281  1  0.718925  0.593273  0.582264  1
  Ni  Ni282  1  0.147508  0.936239  0.621421  1
  Ni  Ni283  1  0.930562  0.350089  0.524805  1
  Ni  Ni284  1  0.257279  0.692104  0.569499  1
  Ni  Ni285  1  0.683623  0.037374  0.608456  1
  Ni  Ni286  1  0.427203  0.303917  0.704731  1
  Ni  Ni287  1  0.552890  0.617605  0.624340  1
  Ni  Ni288  1  0.981215  0.962294  0.663181  1
  Ni  Ni289  1  0.116258  0.251885  0.709641  1
  Ni  Ni290  1  0.260572  0.566236  0.630131  1
  Ni  Ni291  1  0.696187  0.911042  0.669953  1
  Ni  Ni292  1  0.717383  0.358737  0.698411  1
  Ni  Ni293  1  0.030823  0.697178  0.741226  1
  Ni  Ni294  1  0.270674  0.013591  0.655173  1
  Ni  Ni295  1  0.197208  0.149787  0.717478  1
  Ni  Ni296  1  0.323327  0.465643  0.638738  1
  Ni  Ni297  1  0.767664  0.809202  0.681790  1
  Ni  Ni298  1  0.651338  0.459919  0.691768  1
  Ni  Ni299  1  0.955861  0.795072  0.726282  1
  Ni  Ni300  1  0.212174  0.117120  0.645607  1
  Ni  Ni301  1  0.866183  0.212003  0.632588  1
  Ni  Ni302  1  0.186849  0.547012  0.678591  1
  Ni  Ni303  1  0.609451  0.896453  0.718132  1
  Ni  Ni304  1  0.792381  0.377366  0.650183  1
  Ni  Ni305  1  0.099969  0.715165  0.695505  1
  Ni  Ni306  1  0.684906  0.058291  0.734760  1
  Ni  Ni307  1  0.536360  0.203600  0.632796  1
  Ni  Ni308  1  0.860616  0.542950  0.678338  1
  Ni  Ni309  1  0.277078  0.890199  0.718013  1
  Ni  Ni310  1  0.698090  0.252602  0.709639  1
  Ni  Ni311  1  0.808462  0.567186  0.630624  1
  Ni  Ni312  1  0.234685  0.911510  0.670107  1
  Ni  Ni313  1  0.175520  0.356471  0.698653  1
  Ni  Ni314  1  0.480385  0.699449  0.740462  1
  Ni  Ni315  1  0.733257  0.014389  0.655952  1
  Ni  Ni316  1  0.146986  0.434462  0.732661  1
  Ni  Ni317  1  0.258896  0.742189  0.653781  1
  Ni  Ni318  1  0.678392  0.084796  0.691298  1
  Ni  Ni319  1  0.719580  0.180568  0.674496  1
  Ni  Ni320  1  0.024268  0.528016  0.721787  1
  Ni  Ni321  1  0.277702  0.837422  0.634208  1
  Ni  Ni322  1  0.810473  0.436426  0.734177  1
  Ni  Ni323  1  0.926870  0.739737  0.655477  1
  Ni  Ni324  1  0.353338  0.086923  0.689635  1
  Ni  Ni325  1  0.046496  0.184789  0.672766  1
  Ni  Ni326  1  0.355391  0.524045  0.718438  1
  Ni  Ni327  1  0.609764  0.840457  0.632283  1
  Ni  Ni328  1  0.545297  0.152648  0.719963  1
  Ni  Ni329  1  0.676865  0.469956  0.644476  1
  Ni  Ni330  1  0.108755  0.812604  0.684347  1
  Ni  Ni331  1  0.306779  0.454053  0.685874  1
  Ni  Ni332  1  0.621511  0.798628  0.724679  1
  Ni  Ni333  1  0.869520  0.115311  0.639990  1
  Ni  Ni334  1  0.417509  0.299972  0.621010  1
  Ni  Ni335  1  0.734003  0.641415  0.665862  1
  Ni  Ni336  1  0.163813  0.991545  0.702833  1
  Ni  Ni337  1  0.243716  0.282361  0.662457  1
  Ni  Ni338  1  0.552632  0.622730  0.706817  1
  Ni  Ni339  1  0.140829  0.964617  0.746095  1
  Ni  Ni340  1  0.072084  0.301318  0.620423  1
  Ni  Ni341  1  0.389438  0.641493  0.665713  1
  Ni  Ni342  1  0.816285  0.988102  0.705288  1
  Ni  Ni343  1  0.590907  0.283312  0.662928  1
  Ni  Ni344  1  0.901010  0.622331  0.706835  1
  Ni  Ni345  1  0.470610  0.967427  0.744216  1
  Ni  Ni346  1  0.119987  0.380263  0.650912  1
  Ni  Ni347  1  0.430374  0.721747  0.694580  1
  Ni  Ni348  1  0.010762  0.059503  0.732353  1
