# generated using pymatgen
data_Zr2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.20736049
_cell_length_b   13.98292739
_cell_length_c   50.91757585
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   130.81220021
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni
_chemical_formula_sum   'Zr160 Ni80'
_cell_volume   9811.28779333
_cell_formula_units_Z   80
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  0.232015  0.707959  0.280043  1
  Zr  Zr2  1  0.732015  0.707959  0.280043  1
  Zr  Zr3  1  0.791363  0.326689  0.321648  1
  Zr  Zr4  1  0.291363  0.326689  0.321648  1
  Zr  Zr5  1  0.250625  0.069800  0.294031  1
  Zr  Zr6  1  0.750625  0.069800  0.294031  1
  Zr  Zr7  1  0.815029  0.705555  0.339430  1
  Zr  Zr8  1  0.315029  0.705555  0.339430  1
  Zr  Zr9  1  0.396168  0.205198  0.339453  1
  Zr  Zr10  1  0.896168  0.205198  0.339453  1
  Zr  Zr11  1  0.824866  0.569623  0.294044  1
  Zr  Zr12  1  0.324866  0.569623  0.294044  1
  Zr  Zr13  1  0.353782  0.951946  0.310065  1
  Zr  Zr14  1  0.853782  0.951946  0.310065  1
  Zr  Zr15  1  0.916984  0.578365  0.353950  1
  Zr  Zr16  1  0.416984  0.578365  0.353950  1
  Zr  Zr17  1  0.041363  0.826689  0.321648  1
  Zr  Zr18  1  0.541363  0.826689  0.321648  1
  Zr  Zr19  1  0.482015  0.207959  0.280043  1
  Zr  Zr20  1  0.982015  0.207959  0.280043  1
  Zr  Zr21  1  1.000625  0.569800  0.294031  1
  Zr  Zr22  1  0.500625  0.569800  0.294031  1
  Zr  Zr23  1  0.565029  0.205555  0.339430  1
  Zr  Zr24  1  0.065029  0.205555  0.339430  1
  Zr  Zr25  1  0.146168  0.705198  0.339453  1
  Zr  Zr26  1  0.646168  0.705198  0.339453  1
  Zr  Zr27  1  0.574866  0.069623  0.294044  1
  Zr  Zr28  1  0.074866  0.069623  0.294044  1
  Zr  Zr29  1  0.166984  0.078365  0.353950  1
  Zr  Zr30  1  0.666984  0.078365  0.353950  1
  Zr  Zr31  1  0.603782  0.451946  0.310065  1
  Zr  Zr32  1  0.103782  0.451946  0.310065  1
  Zr  Zr33  1  0.356950  0.957815  0.370130  1
  Zr  Zr34  1  0.856950  0.957815  0.370130  1
  Zr  Zr35  1  0.920374  0.584618  0.414949  1
  Zr  Zr36  1  0.420374  0.584618  0.414949  1
  Zr  Zr37  1  0.377675  0.331944  0.384691  1
  Zr  Zr38  1  0.877675  0.331944  0.384691  1
  Zr  Zr39  1  0.941832  0.958965  0.430563  1
  Zr  Zr40  1  0.441832  0.958965  0.430563  1
  Zr  Zr41  1  0.522842  0.458577  0.430592  1
  Zr  Zr42  1  0.022842  0.458577  0.430592  1
  Zr  Zr43  1  0.959939  0.831577  0.384740  1
  Zr  Zr44  1  0.459939  0.831577  0.384740  1
  Zr  Zr45  1  0.480956  0.206271  0.400391  1
  Zr  Zr46  1  0.980956  0.206271  0.400391  1
  Zr  Zr47  1  0.044456  0.833211  0.445754  1
  Zr  Zr48  1  0.544456  0.833211  0.445754  1
  Zr  Zr49  1  0.170374  0.084618  0.414949  1
  Zr  Zr50  1  0.670374  0.084618  0.414949  1
  Zr  Zr51  1  0.606950  0.457815  0.370130  1
  Zr  Zr52  1  0.106950  0.457815  0.370130  1
  Zr  Zr53  1  0.127675  0.831944  0.384691  1
  Zr  Zr54  1  0.627675  0.831944  0.384691  1
  Zr  Zr55  1  0.691832  0.458965  0.430563  1
  Zr  Zr56  1  0.191832  0.458965  0.430563  1
  Zr  Zr57  1  0.272842  0.958577  0.430592  1
  Zr  Zr58  1  0.772842  0.958577  0.430592  1
  Zr  Zr59  1  0.709939  0.331577  0.384740  1
  Zr  Zr60  1  0.209939  0.331577  0.384740  1
  Zr  Zr61  1  0.294456  0.333211  0.445754  1
  Zr  Zr62  1  0.794456  0.333211  0.445754  1
  Zr  Zr63  1  0.730956  0.706271  0.400391  1
  Zr  Zr64  1  0.230956  0.706271  0.400391  1
  Zr  Zr65  1  0.483915  0.211652  0.460777  1
  Zr  Zr66  1  0.983915  0.211652  0.460777  1
  Zr  Zr67  1  0.047609  0.838970  0.506237  1
  Zr  Zr68  1  0.547609  0.838970  0.506237  1
  Zr  Zr69  1  0.505373  0.586354  0.476004  1
  Zr  Zr70  1  0.005373  0.586354  0.476004  1
  Zr  Zr71  1  0.068845  0.213254  0.521650  1
  Zr  Zr72  1  0.568845  0.213254  0.521650  1
  Zr  Zr73  1  0.650240  0.712877  0.521688  1
  Zr  Zr74  1  0.150240  0.712877  0.521688  1
  Zr  Zr75  1  0.086767  0.085976  0.476042  1
  Zr  Zr76  1  0.586767  0.085976  0.476042  1
  Zr  Zr77  1  0.608004  0.460261  0.491455  1
  Zr  Zr78  1  0.108004  0.460261  0.491455  1
  Zr  Zr79  1  0.171698  0.087579  0.536915  1
  Zr  Zr80  1  0.671698  0.087579  0.536915  1
  Zr  Zr81  1  0.297609  0.338970  0.506237  1
  Zr  Zr82  1  0.797609  0.338970  0.506237  1
  Zr  Zr83  1  0.733915  0.711652  0.460777  1
  Zr  Zr84  1  0.233915  0.711652  0.460777  1
  Zr  Zr85  1  0.255373  0.086354  0.476004  1
  Zr  Zr86  1  0.755373  0.086354  0.476004  1
  Zr  Zr87  1  0.818845  0.713254  0.521650  1
  Zr  Zr88  1  0.318845  0.713254  0.521650  1
  Zr  Zr89  1  0.400240  0.212877  0.521688  1
  Zr  Zr90  1  0.900240  0.212877  0.521688  1
  Zr  Zr91  1  0.836767  0.585976  0.476042  1
  Zr  Zr92  1  0.336767  0.585976  0.476042  1
  Zr  Zr93  1  0.421698  0.587579  0.536915  1
  Zr  Zr94  1  0.921698  0.587579  0.536915  1
  Zr  Zr95  1  0.858004  0.960261  0.491455  1
  Zr  Zr96  1  0.358004  0.960261  0.491455  1
  Zr  Zr97  1  0.611157  0.466020  0.551938  1
  Zr  Zr98  1  0.111157  0.466020  0.551938  1
  Zr  Zr99  1  0.174657  0.092960  0.597301  1
  Zr  Zr100  1  0.674657  0.092960  0.597301  1
  Zr  Zr101  1  0.632771  0.840654  0.567100  1
  Zr  Zr102  1  0.132771  0.840654  0.567100  1
  Zr  Zr103  1  0.195673  0.467654  0.612952  1
  Zr  Zr104  1  0.695673  0.467654  0.612952  1
  Zr  Zr105  1  0.777938  0.967286  0.613001  1
  Zr  Zr106  1  0.277938  0.967286  0.613001  1
  Zr  Zr107  1  0.213780  0.340265  0.567130  1
  Zr  Zr108  1  0.713780  0.340265  0.567130  1
  Zr  Zr109  1  0.735239  0.714613  0.582743  1
  Zr  Zr110  1  0.235239  0.714613  0.582743  1
  Zr  Zr111  1  0.298663  0.341415  0.627562  1
  Zr  Zr112  1  0.798663  0.341415  0.627562  1
  Zr  Zr113  1  0.424657  0.592960  0.597301  1
  Zr  Zr114  1  0.924657  0.592960  0.597301  1
  Zr  Zr115  1  0.861157  0.966020  0.551938  1
  Zr  Zr116  1  0.361157  0.966020  0.551938  1
  Zr  Zr117  1  0.382771  0.340654  0.567100  1
  Zr  Zr118  1  0.882771  0.340654  0.567100  1
  Zr  Zr119  1  0.945673  0.967654  0.612952  1
  Zr  Zr120  1  0.445673  0.967654  0.612952  1
  Zr  Zr121  1  0.527938  0.467286  0.613001  1
  Zr  Zr122  1  0.027938  0.467286  0.613001  1
  Zr  Zr123  1  0.963780  0.840265  0.567130  1
  Zr  Zr124  1  0.463780  0.840265  0.567130  1
  Zr  Zr125  1  0.548663  0.841415  0.627562  1
  Zr  Zr126  1  0.048663  0.841415  0.627562  1
  Zr  Zr127  1  0.985239  0.214613  0.582743  1
  Zr  Zr128  1  0.485239  0.214613  0.582743  1
  Zr  Zr129  1  0.738629  0.720866  0.643742  1
  Zr  Zr130  1  0.238629  0.720866  0.643742  1
  Zr  Zr131  1  0.301831  0.347285  0.687627  1
  Zr  Zr132  1  0.801831  0.347285  0.687627  1
  Zr  Zr133  1  0.759445  0.094033  0.658239  1
  Zr  Zr134  1  0.259445  0.094033  0.658239  1
  Zr  Zr135  1  0.330747  0.729608  0.703648  1
  Zr  Zr136  1  0.830747  0.729608  0.703648  1
  Zr  Zr137  1  0.904988  0.229431  0.703661  1
  Zr  Zr138  1  0.404988  0.229431  0.703661  1
  Zr  Zr139  1  0.340584  0.593675  0.658263  1
  Zr  Zr140  1  0.840584  0.593675  0.658263  1
  Zr  Zr141  1  0.864249  0.972542  0.676044  1
  Zr  Zr142  1  0.364249  0.972542  0.676044  1
  Zr  Zr143  1  0.423597  0.591272  0.717649  1
  Zr  Zr144  1  0.923597  0.591272  0.717649  1
  Zr  Zr145  1  0.551831  0.847285  0.687627  1
  Zr  Zr146  1  0.051831  0.847285  0.687627  1
  Zr  Zr147  1  0.988629  0.220866  0.643742  1
  Zr  Zr148  1  0.488629  0.220866  0.643742  1
  Zr  Zr149  1  0.509445  0.594033  0.658239  1
  Zr  Zr150  1  0.009445  0.594033  0.658239  1
  Zr  Zr151  1  0.080747  0.229608  0.703648  1
  Zr  Zr152  1  0.580747  0.229608  0.703648  1
  Zr  Zr153  1  0.654988  0.729431  0.703661  1
  Zr  Zr154  1  0.154988  0.729431  0.703661  1
  Zr  Zr155  1  0.090584  0.093675  0.658263  1
  Zr  Zr156  1  0.590584  0.093675  0.658263  1
  Zr  Zr157  1  0.673597  0.091272  0.717649  1
  Zr  Zr158  1  0.173597  0.091272  0.717649  1
  Zr  Zr159  1  0.114249  0.472542  0.676044  1
  Zr  Zr160  1  0.614249  0.472542  0.676044  1
  Ni  Ni161  1  0.416402  0.324275  0.295317  1
  Ni  Ni162  1  0.916402  0.324275  0.295317  1
  Ni  Ni163  1  0.980935  0.954376  0.339604  1
  Ni  Ni164  1  0.480935  0.954376  0.339604  1
  Ni  Ni165  1  0.479226  0.454302  0.339604  1
  Ni  Ni166  1  0.979226  0.454302  0.339604  1
  Ni  Ni167  1  0.913812  0.824320  0.295336  1
  Ni  Ni168  1  0.413812  0.824320  0.295336  1
  Ni  Ni169  1  0.166402  0.824275  0.295317  1
  Ni  Ni170  1  0.666402  0.824275  0.295317  1
  Ni  Ni171  1  0.730935  0.454376  0.339604  1
  Ni  Ni172  1  0.230935  0.454376  0.339604  1
  Ni  Ni173  1  0.229226  0.954302  0.339604  1
  Ni  Ni174  1  0.729226  0.954302  0.339604  1
  Ni  Ni175  1  0.663812  0.324320  0.295336  1
  Ni  Ni176  1  0.163812  0.324320  0.295336  1
  Ni  Ni177  1  0.543574  0.581913  0.385165  1
  Ni  Ni178  1  0.043574  0.581913  0.385165  1
  Ni  Ni179  1  0.107645  0.209215  0.430490  1
  Ni  Ni180  1  0.607645  0.209215  0.430490  1
  Ni  Ni181  1  0.607466  0.709193  0.430488  1
  Ni  Ni182  1  0.107466  0.709193  0.430488  1
  Ni  Ni183  1  0.044200  0.081895  0.385174  1
  Ni  Ni184  1  0.544200  0.081895  0.385174  1
  Ni  Ni185  1  0.293574  0.081913  0.385165  1
  Ni  Ni186  1  0.793574  0.081913  0.385165  1
  Ni  Ni187  1  0.857645  0.709215  0.430490  1
  Ni  Ni188  1  0.357645  0.709215  0.430490  1
  Ni  Ni189  1  0.357466  0.209193  0.430488  1
  Ni  Ni190  1  0.857466  0.209193  0.430488  1
  Ni  Ni191  1  0.794200  0.581895  0.385174  1
  Ni  Ni192  1  0.294200  0.581895  0.385174  1
  Ni  Ni193  1  0.670944  0.835997  0.476093  1
  Ni  Ni194  1  0.170944  0.835997  0.476093  1
  Ni  Ni195  1  0.234597  0.463248  0.521596  1
  Ni  Ni196  1  0.734597  0.463248  0.521596  1
  Ni  Ni197  1  0.734668  0.963234  0.521599  1
  Ni  Ni198  1  0.234668  0.963234  0.521599  1
  Ni  Ni199  1  0.171016  0.335982  0.476097  1
  Ni  Ni200  1  0.671016  0.335982  0.476097  1
  Ni  Ni201  1  0.420944  0.335997  0.476093  1
  Ni  Ni202  1  0.920944  0.335997  0.476093  1
  Ni  Ni203  1  0.984597  0.963248  0.521596  1
  Ni  Ni204  1  0.484597  0.963248  0.521596  1
  Ni  Ni205  1  0.484668  0.463234  0.521599  1
  Ni  Ni206  1  0.984668  0.463234  0.521599  1
  Ni  Ni207  1  0.921016  0.835982  0.476097  1
  Ni  Ni208  1  0.421016  0.835982  0.476097  1
  Ni  Ni209  1  0.798146  0.090038  0.567204  1
  Ni  Ni210  1  0.298146  0.090038  0.567204  1
  Ni  Ni211  1  0.361413  0.717335  0.612518  1
  Ni  Ni212  1  0.861413  0.717335  0.612518  1
  Ni  Ni213  1  0.862039  0.217318  0.612527  1
  Ni  Ni214  1  0.362039  0.217318  0.612527  1
  Ni  Ni215  1  0.297968  0.590015  0.567202  1
  Ni  Ni216  1  0.797968  0.590015  0.567202  1
  Ni  Ni217  1  0.548146  0.590038  0.567204  1
  Ni  Ni218  1  0.048146  0.590038  0.567204  1
  Ni  Ni219  1  0.111413  0.217335  0.612518  1
  Ni  Ni220  1  0.611413  0.217335  0.612518  1
  Ni  Ni221  1  0.612039  0.717318  0.612527  1
  Ni  Ni222  1  0.112039  0.717318  0.612527  1
  Ni  Ni223  1  0.047968  0.090015  0.567202  1
  Ni  Ni224  1  0.547968  0.090015  0.567202  1
  Ni  Ni225  1  0.926386  0.344928  0.658088  1
  Ni  Ni226  1  0.426386  0.344928  0.658088  1
  Ni  Ni227  1  0.491801  0.974911  0.702356  1
  Ni  Ni228  1  0.991801  0.974911  0.702356  1
  Ni  Ni229  1  0.989210  0.474956  0.702375  1
  Ni  Ni230  1  0.489210  0.474956  0.702375  1
  Ni  Ni231  1  0.424677  0.844855  0.658088  1
  Ni  Ni232  1  0.924677  0.844855  0.658088  1
  Ni  Ni233  1  0.676386  0.844928  0.658088  1
  Ni  Ni234  1  0.176386  0.844928  0.658088  1
  Ni  Ni235  1  0.241801  0.474911  0.702356  1
  Ni  Ni236  1  0.741801  0.474911  0.702356  1
  Ni  Ni237  1  0.739210  0.974956  0.702375  1
  Ni  Ni238  1  0.239210  0.974956  0.702375  1
  Ni  Ni239  1  0.174677  0.344855  0.658088  1
  Ni  Ni240  1  0.674677  0.344855  0.658088  1
