# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   22.44658619
_cell_length_b   12.81725347
_cell_length_c   50.30383489
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   49.37513933
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr96 Ni252'
_cell_volume   10984.5374047
_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  0.933833  0.074977  0.336397  1
  Zr  Zr2  1  0.433833  0.074977  0.336397  1
  Zr  Zr3  1  0.809273  0.822821  0.407488  1
  Zr  Zr4  1  0.309273  0.822821  0.407488  1
  Zr  Zr5  1  0.332993  0.433433  0.379079  1
  Zr  Zr6  1  0.832993  0.433433  0.379079  1
  Zr  Zr7  1  0.456248  0.687925  0.309519  1
  Zr  Zr8  1  0.956248  0.687925  0.309519  1
  Zr  Zr9  1  0.060138  0.115034  0.421626  1
  Zr  Zr10  1  0.560138  0.115034  0.421626  1
  Zr  Zr11  1  0.180478  0.371921  0.350773  1
  Zr  Zr12  1  0.680478  0.371921  0.350773  1
  Zr  Zr13  1  0.194698  0.403573  0.293439  1
  Zr  Zr14  1  0.694698  0.403573  0.293439  1
  Zr  Zr15  1  0.083683  0.139744  0.362855  1
  Zr  Zr16  1  0.583683  0.139744  0.362855  1
  Zr  Zr17  1  0.074534  0.733802  0.373572  1
  Zr  Zr18  1  0.574534  0.733802  0.373572  1
  Zr  Zr19  1  0.192589  0.992704  0.303517  1
  Zr  Zr20  1  0.692589  0.992704  0.303517  1
  Zr  Zr21  1  0.187354  0.781018  0.340642  1
  Zr  Zr22  1  0.687354  0.781018  0.340642  1
  Zr  Zr23  1  0.067099  0.523564  0.413257  1
  Zr  Zr24  1  0.567099  0.523564  0.413257  1
  Zr  Zr25  1  0.436052  0.282027  0.295794  1
  Zr  Zr26  1  0.936052  0.282027  0.295794  1
  Zr  Zr27  1  0.316105  0.026604  0.366439  1
  Zr  Zr28  1  0.816105  0.026604  0.366439  1
  Zr  Zr29  1  0.827010  0.230696  0.420214  1
  Zr  Zr30  1  0.327010  0.230696  0.420214  1
  Zr  Zr31  1  0.947657  0.485862  0.348289  1
  Zr  Zr32  1  0.447657  0.485862  0.348289  1
  Zr  Zr33  1  0.687543  0.569611  0.479432  1
  Zr  Zr34  1  0.187543  0.569611  0.479432  1
  Zr  Zr35  1  0.565461  0.316764  0.551040  1
  Zr  Zr36  1  0.065461  0.316764  0.551040  1
  Zr  Zr37  1  0.089142  0.926070  0.522486  1
  Zr  Zr38  1  0.589142  0.926070  0.522486  1
  Zr  Zr39  1  0.211070  0.179447  0.450799  1
  Zr  Zr40  1  0.711070  0.179447  0.450799  1
  Zr  Zr41  1  0.815942  0.607396  0.565870  1
  Zr  Zr42  1  0.315942  0.607396  0.565870  1
  Zr  Zr43  1  0.937889  0.860239  0.494178  1
  Zr  Zr44  1  0.437889  0.860239  0.494178  1
  Zr  Zr45  1  0.960610  0.888902  0.436000  1
  Zr  Zr46  1  0.460610  0.888902  0.436000  1
  Zr  Zr47  1  0.838802  0.635740  0.507620  1
  Zr  Zr48  1  0.338802  0.635740  0.507620  1
  Zr  Zr49  1  0.830932  0.226539  0.517053  1
  Zr  Zr50  1  0.330932  0.226539  0.517053  1
  Zr  Zr51  1  0.952676  0.480067  0.445183  1
  Zr  Zr52  1  0.452676  0.480067  0.445183  1
  Zr  Zr53  1  0.945596  0.269555  0.484743  1
  Zr  Zr54  1  0.445596  0.269555  0.484743  1
  Zr  Zr55  1  0.823909  0.015878  0.556696  1
  Zr  Zr56  1  0.323909  0.015878  0.556696  1
  Zr  Zr57  1  0.193407  0.771997  0.438099  1
  Zr  Zr58  1  0.693407  0.771997  0.438099  1
  Zr  Zr59  1  0.072332  0.517833  0.510074  1
  Zr  Zr60  1  0.572332  0.517833  0.510074  1
  Zr  Zr61  1  0.583333  0.723864  0.563869  1
  Zr  Zr62  1  0.083333  0.723864  0.563869  1
  Zr  Zr63  1  0.704235  0.978069  0.491774  1
  Zr  Zr64  1  0.204235  0.978069  0.491774  1
  Zr  Zr65  1  0.443543  0.063369  0.622812  1
  Zr  Zr66  1  0.943543  0.063369  0.622812  1
  Zr  Zr67  1  0.318632  0.807812  0.692234  1
  Zr  Zr68  1  0.818632  0.807812  0.692234  1
  Zr  Zr69  1  0.843762  0.420701  0.665423  1
  Zr  Zr70  1  0.343762  0.420701  0.665423  1
  Zr  Zr71  1  0.967113  0.673989  0.594377  1
  Zr  Zr72  1  0.467113  0.673989  0.594377  1
  Zr  Zr73  1  0.581162  0.094055  0.708397  1
  Zr  Zr74  1  0.081162  0.094055  0.708397  1
  Zr  Zr75  1  0.692889  0.357175  0.639622  1
  Zr  Zr76  1  0.192889  0.357175  0.639622  1
  Zr  Zr77  1  0.716061  0.380681  0.580398  1
  Zr  Zr78  1  0.216061  0.380681  0.580398  1
  Zr  Zr79  1  0.595607  0.125994  0.650975  1
  Zr  Zr80  1  0.095607  0.125994  0.650975  1
  Zr  Zr81  1  0.590420  0.714180  0.660575  1
  Zr  Zr82  1  0.090420  0.714180  0.660575  1
  Zr  Zr83  1  0.709582  0.972405  0.588689  1
  Zr  Zr84  1  0.209582  0.972405  0.588689  1
  Zr  Zr85  1  0.702369  0.761213  0.628201  1
  Zr  Zr86  1  0.202369  0.761213  0.628201  1
  Zr  Zr87  1  0.584980  0.501454  0.698125  1
  Zr  Zr88  1  0.084980  0.501454  0.698125  1
  Zr  Zr89  1  0.949539  0.265546  0.581401  1
  Zr  Zr90  1  0.449539  0.265546  0.581401  1
  Zr  Zr91  1  0.828334  0.012191  0.654115  1
  Zr  Zr92  1  0.328334  0.012191  0.654115  1
  Zr  Zr93  1  0.347545  0.198917  0.704571  1
  Zr  Zr94  1  0.847545  0.198917  0.704571  1
  Zr  Zr95  1  0.460153  0.470508  0.635350  1
  Zr  Zr96  1  0.960153  0.470508  0.635350  1
  Ni  Ni97  1  0.496968  0.010937  0.284669  1
  Ni  Ni98  1  0.996968  0.010937  0.284669  1
  Ni  Ni99  1  0.380265  0.756227  0.356107  1
  Ni  Ni100  1  0.880265  0.756227  0.356107  1
  Ni  Ni101  1  0.944138  0.783965  0.393231  1
  Ni  Ni102  1  0.444138  0.783965  0.393231  1
  Ni  Ni103  1  0.062006  0.042082  0.319713  1
  Ni  Ni104  1  0.562006  0.042082  0.319713  1
  Ni  Ni105  1  0.317496  0.729256  0.318715  1
  Ni  Ni106  1  0.817496  0.729256  0.318715  1
  Ni  Ni107  1  0.196824  0.472783  0.393509  1
  Ni  Ni108  1  0.696824  0.472783  0.393509  1
  Ni  Ni109  1  0.823062  0.012400  0.418403  1
  Ni  Ni110  1  0.323062  0.012400  0.418403  1
  Ni  Ni111  1  0.944705  0.269637  0.345606  1
  Ni  Ni112  1  0.444705  0.269637  0.345606  1
  Ni  Ni113  1  0.442477  0.488458  0.298229  1
  Ni  Ni114  1  0.942477  0.488458  0.298229  1
  Ni  Ni115  1  0.318916  0.243745  0.368742  1
  Ni  Ni116  1  0.818916  0.243745  0.368742  1
  Ni  Ni117  1  0.056504  0.962481  0.366243  1
  Ni  Ni118  1  0.556504  0.962481  0.366243  1
  Ni  Ni119  1  0.183058  0.209037  0.296227  1
  Ni  Ni120  1  0.683058  0.209037  0.296227  1
  Ni  Ni121  1  0.209883  0.546928  0.348729  1
  Ni  Ni122  1  0.709883  0.546928  0.348729  1
  Ni  Ni123  1  0.087266  0.292069  0.420024  1
  Ni  Ni124  1  0.587266  0.292069  0.420024  1
  Ni  Ni125  1  0.175612  0.892632  0.391746  1
  Ni  Ni126  1  0.675612  0.892632  0.391746  1
  Ni  Ni127  1  0.296819  0.156043  0.320199  1
  Ni  Ni128  1  0.796819  0.156043  0.320199  1
  Ni  Ni129  1  0.114002  0.670205  0.426273  1
  Ni  Ni130  1  0.614002  0.670205  0.426273  1
  Ni  Ni131  1  0.236731  0.923172  0.354161  1
  Ni  Ni132  1  0.736731  0.923172  0.354161  1
  Ni  Ni133  1  0.148932  0.843789  0.289410  1
  Ni  Ni134  1  0.648932  0.843789  0.289410  1
  Ni  Ni135  1  0.026323  0.589281  0.360023  1
  Ni  Ni136  1  0.526323  0.589281  0.360023  1
  Ni  Ni137  1  0.201407  0.602194  0.303637  1
  Ni  Ni138  1  0.701407  0.602194  0.303637  1
  Ni  Ni139  1  0.081913  0.347623  0.374109  1
  Ni  Ni140  1  0.581913  0.347623  0.374109  1
  Ni  Ni141  1  0.060021  0.909703  0.412566  1
  Ni  Ni142  1  0.560021  0.909703  0.412566  1
  Ni  Ni143  1  0.184029  0.162461  0.341335  1
  Ni  Ni144  1  0.684029  0.162461  0.341335  1
  Ni  Ni145  1  0.327144  0.520631  0.326281  1
  Ni  Ni146  1  0.827144  0.520631  0.326281  1
  Ni  Ni147  1  0.206207  0.262531  0.399396  1
  Ni  Ni148  1  0.706207  0.262531  0.399396  1
  Ni  Ni149  1  0.936622  0.993112  0.387234  1
  Ni  Ni150  1  0.436622  0.993112  0.387234  1
  Ni  Ni151  1  0.058338  0.249398  0.315981  1
  Ni  Ni152  1  0.558338  0.249398  0.315981  1
  Ni  Ni153  1  0.312033  0.344567  0.323940  1
  Ni  Ni154  1  0.812033  0.344567  0.323940  1
  Ni  Ni155  1  0.191344  0.089951  0.394737  1
  Ni  Ni156  1  0.691344  0.089951  0.394737  1
  Ni  Ni157  1  0.950837  0.166027  0.391704  1
  Ni  Ni158  1  0.450837  0.166027  0.391704  1
  Ni  Ni159  1  0.073570  0.420220  0.320650  1
  Ni  Ni160  1  0.573570  0.420220  0.320650  1
  Ni  Ni161  1  0.307513  0.673067  0.370293  1
  Ni  Ni162  1  0.807513  0.673067  0.370293  1
  Ni  Ni163  1  0.423404  0.931467  0.301146  1
  Ni  Ni164  1  0.923404  0.931467  0.301146  1
  Ni  Ni165  1  0.954404  0.839798  0.344639  1
  Ni  Ni166  1  0.454404  0.839798  0.344639  1
  Ni  Ni167  1  0.833690  0.584831  0.415283  1
  Ni  Ni168  1  0.333690  0.584831  0.415283  1
  Ni  Ni169  1  0.060701  0.833076  0.319791  1
  Ni  Ni170  1  0.560701  0.833076  0.319791  1
  Ni  Ni171  1  0.941417  0.581380  0.394573  1
  Ni  Ni172  1  0.441417  0.581380  0.394573  1
  Ni  Ni173  1  0.199735  0.677567  0.391487  1
  Ni  Ni174  1  0.699735  0.677567  0.391487  1
  Ni  Ni175  1  0.318066  0.937493  0.319512  1
  Ni  Ni176  1  0.818066  0.937493  0.319512  1
  Ni  Ni177  1  0.089009  0.620715  0.323236  1
  Ni  Ni178  1  0.589009  0.620715  0.323236  1
  Ni  Ni179  1  0.967837  0.363489  0.394413  1
  Ni  Ni180  1  0.467837  0.363489  0.394413  1
  Ni  Ni181  1  0.260375  0.501499  0.429045  1
  Ni  Ni182  1  0.760375  0.501499  0.429045  1
  Ni  Ni183  1  0.138340  0.247867  0.500913  1
  Ni  Ni184  1  0.638340  0.247867  0.500913  1
  Ni  Ni185  1  0.701573  0.276995  0.536962  1
  Ni  Ni186  1  0.201573  0.276995  0.536962  1
  Ni  Ni187  1  0.823192  0.530721  0.464930  1
  Ni  Ni188  1  0.323192  0.530721  0.464930  1
  Ni  Ni189  1  0.075037  0.218892  0.464910  1
  Ni  Ni190  1  0.575037  0.218892  0.464910  1
  Ni  Ni191  1  0.953387  0.965308  0.536902  1
  Ni  Ni192  1  0.453387  0.965308  0.536902  1
  Ni  Ni193  1  0.579278  0.506338  0.561688  1
  Ni  Ni194  1  0.079278  0.506338  0.561688  1
  Ni  Ni195  1  0.701181  0.759213  0.489969  1
  Ni  Ni196  1  0.201181  0.759213  0.489969  1
  Ni  Ni197  1  0.197093  0.989976  0.440148  1
  Ni  Ni198  1  0.697093  0.989976  0.440148  1
  Ni  Ni199  1  0.075441  0.736547  0.511950  1
  Ni  Ni200  1  0.575441  0.736547  0.511950  1
  Ni  Ni201  1  0.810832  0.458486  0.510053  1
  Ni  Ni202  1  0.310832  0.458486  0.510053  1
  Ni  Ni203  1  0.932632  0.711888  0.438401  1
  Ni  Ni204  1  0.432632  0.711888  0.438401  1
  Ni  Ni205  1  0.965728  0.037492  0.491786  1
  Ni  Ni206  1  0.465728  0.037492  0.491786  1
  Ni  Ni207  1  0.843968  0.784384  0.563487  1
  Ni  Ni208  1  0.343968  0.784384  0.563487  1
  Ni  Ni209  1  0.930557  0.385777  0.535191  1
  Ni  Ni210  1  0.430557  0.385777  0.535191  1
  Ni  Ni211  1  0.052979  0.639169  0.463658  1
  Ni  Ni212  1  0.552979  0.639169  0.463658  1
  Ni  Ni213  1  0.869419  0.163270  0.569866  1
  Ni  Ni214  1  0.369419  0.163270  0.569866  1
  Ni  Ni215  1  0.992028  0.416328  0.498055  1
  Ni  Ni216  1  0.492028  0.416328  0.498055  1
  Ni  Ni217  1  0.906863  0.333020  0.431874  1
  Ni  Ni218  1  0.406863  0.333020  0.431874  1
  Ni  Ni219  1  0.784634  0.079576  0.503791  1
  Ni  Ni220  1  0.284634  0.079576  0.503791  1
  Ni  Ni221  1  0.960317  0.094779  0.445906  1
  Ni  Ni222  1  0.460317  0.094779  0.445906  1
  Ni  Ni223  1  0.837891  0.841375  0.517631  1
  Ni  Ni224  1  0.337891  0.841375  0.517631  1
  Ni  Ni225  1  0.815881  0.401672  0.555960  1
  Ni  Ni226  1  0.315881  0.401672  0.555960  1
  Ni  Ni227  1  0.938770  0.654567  0.484199  1
  Ni  Ni228  1  0.438770  0.654567  0.484199  1
  Ni  Ni229  1  0.084419  0.008816  0.470401  1
  Ni  Ni230  1  0.584419  0.008816  0.470401  1
  Ni  Ni231  1  0.962803  0.755420  0.542671  1
  Ni  Ni232  1  0.462803  0.755420  0.542671  1
  Ni  Ni233  1  0.692071  0.487092  0.531561  1
  Ni  Ni234  1  0.192071  0.487092  0.531561  1
  Ni  Ni235  1  0.813895  0.740537  0.459121  1
  Ni  Ni236  1  0.313895  0.740537  0.459121  1
  Ni  Ni237  1  0.069705  0.836697  0.466204  1
  Ni  Ni238  1  0.569705  0.836697  0.466204  1
  Ni  Ni239  1  0.947989  0.583795  0.537832  1
  Ni  Ni240  1  0.447989  0.583795  0.537832  1
  Ni  Ni241  1  0.706932  0.659174  0.535654  1
  Ni  Ni242  1  0.206932  0.659174  0.535654  1
  Ni  Ni243  1  0.828580  0.912243  0.464029  1
  Ni  Ni244  1  0.328580  0.912243  0.464029  1
  Ni  Ni245  1  0.064291  0.165842  0.514713  1
  Ni  Ni246  1  0.564291  0.165842  0.514713  1
  Ni  Ni247  1  0.186418  0.418968  0.442985  1
  Ni  Ni248  1  0.686418  0.418968  0.442985  1
  Ni  Ni249  1  0.712248  0.330165  0.487158  1
  Ni  Ni250  1  0.212248  0.330165  0.487158  1
  Ni  Ni251  1  0.590329  0.076983  0.558870  1
  Ni  Ni252  1  0.090329  0.076983  0.558870  1
  Ni  Ni253  1  0.820583  0.327075  0.466458  1
  Ni  Ni254  1  0.320583  0.327075  0.466458  1
  Ni  Ni255  1  0.698641  0.073289  0.538233  1
  Ni  Ni256  1  0.198641  0.073289  0.538233  1
  Ni  Ni257  1  0.955985  0.168879  0.535292  1
  Ni  Ni258  1  0.455985  0.168879  0.535292  1
  Ni  Ni259  1  0.077987  0.422653  0.463641  1
  Ni  Ni260  1  0.577987  0.422653  0.463641  1
  Ni  Ni261  1  0.845846  0.110474  0.466586  1
  Ni  Ni262  1  0.345846  0.110474  0.466586  1
  Ni  Ni263  1  0.723704  0.856738  0.538202  1
  Ni  Ni264  1  0.223704  0.856738  0.538202  1
  Ni  Ni265  1  0.015930  0.995161  0.572832  1
  Ni  Ni266  1  0.515930  0.995161  0.572832  1
  Ni  Ni267  1  0.895283  0.741879  0.646090  1
  Ni  Ni268  1  0.395283  0.741879  0.646090  1
  Ni  Ni269  1  0.460640  0.765354  0.683503  1
  Ni  Ni270  1  0.960640  0.765354  0.683503  1
  Ni  Ni271  1  0.579987  0.023395  0.608324  1
  Ni  Ni272  1  0.079987  0.023395  0.608324  1
  Ni  Ni273  1  0.832363  0.712718  0.608774  1
  Ni  Ni274  1  0.332363  0.712718  0.608774  1
  Ni  Ni275  1  0.715641  0.455074  0.683860  1
  Ni  Ni276  1  0.215641  0.455074  0.683860  1
  Ni  Ni277  1  0.334902  0.002274  0.704210  1
  Ni  Ni278  1  0.834902  0.002274  0.704210  1
  Ni  Ni279  1  0.457313  0.254216  0.632664  1
  Ni  Ni280  1  0.957313  0.254216  0.632664  1
  Ni  Ni281  1  0.953446  0.484094  0.583455  1
  Ni  Ni282  1  0.453446  0.484094  0.583455  1
  Ni  Ni283  1  0.831420  0.230243  0.655743  1
  Ni  Ni284  1  0.331420  0.230243  0.655743  1
  Ni  Ni285  1  0.566975  0.948545  0.652898  1
  Ni  Ni286  1  0.066975  0.948545  0.652898  1
  Ni  Ni287  1  0.689459  0.203611  0.581866  1
  Ni  Ni288  1  0.189459  0.203611  0.581866  1
  Ni  Ni289  1  0.721958  0.530328  0.636206  1
  Ni  Ni290  1  0.221958  0.530328  0.636206  1
  Ni  Ni291  1  0.594061  0.286847  0.705799  1
  Ni  Ni292  1  0.094061  0.286847  0.705799  1
  Ni  Ni293  1  0.684724  0.875848  0.678552  1
  Ni  Ni294  1  0.184724  0.875848  0.678552  1
  Ni  Ni295  1  0.808819  0.133011  0.607637  1
  Ni  Ni296  1  0.308819  0.133011  0.607637  1
  Ni  Ni297  1  0.608082  0.674583  0.710995  1
  Ni  Ni298  1  0.108082  0.674583  0.710995  1
  Ni  Ni299  1  0.749355  0.907366  0.642011  1
  Ni  Ni300  1  0.249355  0.907366  0.642011  1
  Ni  Ni301  1  0.662589  0.825798  0.575567  1
  Ni  Ni302  1  0.162589  0.825798  0.575567  1
  Ni  Ni303  1  0.539163  0.573792  0.647529  1
  Ni  Ni304  1  0.039163  0.573792  0.647529  1
  Ni  Ni305  1  0.716639  0.586037  0.589577  1
  Ni  Ni306  1  0.216639  0.586037  0.589577  1
  Ni  Ni307  1  0.593118  0.333388  0.660578  1
  Ni  Ni308  1  0.093118  0.333388  0.660578  1
  Ni  Ni309  1  0.566499  0.906157  0.698593  1
  Ni  Ni310  1  0.066499  0.906157  0.698593  1
  Ni  Ni311  1  0.695033  0.148433  0.627745  1
  Ni  Ni312  1  0.195033  0.148433  0.627745  1
  Ni  Ni313  1  0.840044  0.503495  0.614663  1
  Ni  Ni314  1  0.340044  0.503495  0.614663  1
  Ni  Ni315  1  0.719510  0.245837  0.686504  1
  Ni  Ni316  1  0.219510  0.245837  0.686504  1
  Ni  Ni317  1  0.450548  0.972338  0.674511  1
  Ni  Ni318  1  0.950548  0.972338  0.674511  1
  Ni  Ni319  1  0.570264  0.233962  0.602411  1
  Ni  Ni320  1  0.070264  0.233962  0.602411  1
  Ni  Ni321  1  0.825990  0.330843  0.609742  1
  Ni  Ni322  1  0.325990  0.330843  0.609742  1
  Ni  Ni323  1  0.702681  0.076443  0.681312  1
  Ni  Ni324  1  0.202681  0.076443  0.681312  1
  Ni  Ni325  1  0.465010  0.152595  0.676877  1
  Ni  Ni326  1  0.965010  0.152595  0.676877  1
  Ni  Ni327  1  0.585573  0.405991  0.607209  1
  Ni  Ni328  1  0.085573  0.405991  0.607209  1
  Ni  Ni329  1  0.821128  0.656447  0.657308  1
  Ni  Ni330  1  0.321128  0.656447  0.657308  1
  Ni  Ni331  1  0.942877  0.911296  0.586486  1
  Ni  Ni332  1  0.442877  0.911296  0.586486  1
  Ni  Ni333  1  0.468711  0.823829  0.631662  1
  Ni  Ni334  1  0.968711  0.823829  0.631662  1
  Ni  Ni335  1  0.356494  0.561993  0.700393  1
  Ni  Ni336  1  0.856494  0.561993  0.700393  1
  Ni  Ni337  1  0.576540  0.819163  0.610173  1
  Ni  Ni338  1  0.076540  0.819163  0.610173  1
  Ni  Ni339  1  0.459018  0.559023  0.682300  1
  Ni  Ni340  1  0.959018  0.559023  0.682300  1
  Ni  Ni341  1  0.715720  0.661499  0.683950  1
  Ni  Ni342  1  0.215720  0.661499  0.683950  1
  Ni  Ni343  1  0.834905  0.915577  0.607593  1
  Ni  Ni344  1  0.334905  0.915577  0.607593  1
  Ni  Ni345  1  0.601522  0.603126  0.610265  1
  Ni  Ni346  1  0.101522  0.603126  0.610265  1
  Ni  Ni347  1  0.480854  0.339721  0.681427  1
  Ni  Ni348  1  0.980854  0.339721  0.681427  1
