# generated using pymatgen
data_Zr2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.11147475
_cell_length_b   13.91174887
_cell_length_c   50.76329955
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   130.88818012
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni
_chemical_formula_sum   'Zr160 Ni80'
_cell_volume   9669.42367127
_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  0.036580  0.813555  0.317998  1
  Zr  Zr2  1  0.536580  0.813555  0.317998  1
  Zr  Zr3  1  0.478340  0.197082  0.276438  1
  Zr  Zr4  1  0.978340  0.197082  0.276438  1
  Zr  Zr5  1  0.246868  0.055149  0.290465  1
  Zr  Zr6  1  0.746868  0.055149  0.290465  1
  Zr  Zr7  1  0.809978  0.690758  0.336580  1
  Zr  Zr8  1  0.309978  0.690758  0.336580  1
  Zr  Zr9  1  0.389946  0.190384  0.336604  1
  Zr  Zr10  1  0.889946  0.190384  0.336604  1
  Zr  Zr11  1  0.817543  0.555087  0.290494  1
  Zr  Zr12  1  0.317543  0.555087  0.290494  1
  Zr  Zr13  1  0.161100  0.063062  0.350623  1
  Zr  Zr14  1  0.661100  0.063062  0.350623  1
  Zr  Zr15  1  0.598439  0.437713  0.307321  1
  Zr  Zr16  1  0.098439  0.437713  0.307321  1
  Zr  Zr17  1  0.228340  0.697082  0.276438  1
  Zr  Zr18  1  0.728340  0.697082  0.276438  1
  Zr  Zr19  1  0.786580  0.313555  0.317998  1
  Zr  Zr20  1  0.286580  0.313555  0.317998  1
  Zr  Zr21  1  0.996868  0.555149  0.290465  1
  Zr  Zr22  1  0.496868  0.555149  0.290465  1
  Zr  Zr23  1  0.559978  0.190758  0.336580  1
  Zr  Zr24  1  0.059978  0.190758  0.336580  1
  Zr  Zr25  1  0.139946  0.690384  0.336604  1
  Zr  Zr26  1  0.639946  0.690384  0.336604  1
  Zr  Zr27  1  0.567543  0.055087  0.290494  1
  Zr  Zr28  1  0.067543  0.055087  0.290494  1
  Zr  Zr29  1  0.348439  0.937713  0.307321  1
  Zr  Zr30  1  0.848439  0.937713  0.307321  1
  Zr  Zr31  1  0.911100  0.563062  0.350623  1
  Zr  Zr32  1  0.411100  0.563062  0.350623  1
  Zr  Zr33  1  0.164366  0.068804  0.411677  1
  Zr  Zr34  1  0.664366  0.068804  0.411677  1
  Zr  Zr35  1  0.601563  0.443429  0.367385  1
  Zr  Zr36  1  0.101563  0.443429  0.367385  1
  Zr  Zr37  1  0.371947  0.316124  0.381661  1
  Zr  Zr38  1  0.871947  0.316124  0.381661  1
  Zr  Zr39  1  0.935581  0.940910  0.427664  1
  Zr  Zr40  1  0.435581  0.940910  0.427664  1
  Zr  Zr41  1  0.514836  0.440479  0.427703  1
  Zr  Zr42  1  0.014836  0.440479  0.427703  1
  Zr  Zr43  1  0.953483  0.815720  0.381736  1
  Zr  Zr44  1  0.453483  0.815720  0.381736  1
  Zr  Zr45  1  0.286742  0.313910  0.442834  1
  Zr  Zr46  1  0.786742  0.313910  0.442834  1
  Zr  Zr47  1  0.724193  0.689049  0.397593  1
  Zr  Zr48  1  0.224193  0.689049  0.397593  1
  Zr  Zr49  1  0.351563  0.943429  0.367385  1
  Zr  Zr50  1  0.851563  0.943429  0.367385  1
  Zr  Zr51  1  0.914366  0.568804  0.411677  1
  Zr  Zr52  1  0.414366  0.568804  0.411677  1
  Zr  Zr53  1  0.121947  0.816124  0.381661  1
  Zr  Zr54  1  0.621947  0.816124  0.381661  1
  Zr  Zr55  1  0.685581  0.440910  0.427664  1
  Zr  Zr56  1  0.185581  0.440910  0.427664  1
  Zr  Zr57  1  0.264836  0.940479  0.427703  1
  Zr  Zr58  1  0.764836  0.940479  0.427703  1
  Zr  Zr59  1  0.703483  0.315720  0.381736  1
  Zr  Zr60  1  0.203483  0.315720  0.381736  1
  Zr  Zr61  1  0.474193  0.189049  0.397593  1
  Zr  Zr62  1  0.974193  0.189049  0.397593  1
  Zr  Zr63  1  0.036742  0.813910  0.442834  1
  Zr  Zr64  1  0.536742  0.813910  0.442834  1
  Zr  Zr65  1  0.289699  0.318970  0.503007  1
  Zr  Zr66  1  0.789699  0.318970  0.503007  1
  Zr  Zr67  1  0.726686  0.693220  0.457674  1
  Zr  Zr68  1  0.226686  0.693220  0.457674  1
  Zr  Zr69  1  0.498176  0.566678  0.472959  1
  Zr  Zr70  1  0.998176  0.566678  0.472959  1
  Zr  Zr71  1  0.060575  0.191255  0.518592  1
  Zr  Zr72  1  0.560575  0.191255  0.518592  1
  Zr  Zr73  1  0.640694  0.690835  0.518650  1
  Zr  Zr74  1  0.140694  0.690835  0.518650  1
  Zr  Zr75  1  0.078294  0.066258  0.473018  1
  Zr  Zr76  1  0.578294  0.066258  0.473018  1
  Zr  Zr77  1  0.412183  0.564293  0.533935  1
  Zr  Zr78  1  0.912183  0.564293  0.533935  1
  Zr  Zr79  1  0.849171  0.938543  0.488602  1
  Zr  Zr80  1  0.349171  0.938543  0.488602  1
  Zr  Zr81  1  0.476686  0.193220  0.457674  1
  Zr  Zr82  1  0.976686  0.193220  0.457674  1
  Zr  Zr83  1  0.039699  0.818970  0.503007  1
  Zr  Zr84  1  0.539699  0.818970  0.503007  1
  Zr  Zr85  1  0.248176  0.066678  0.472959  1
  Zr  Zr86  1  0.748176  0.066678  0.472959  1
  Zr  Zr87  1  0.810575  0.691255  0.518592  1
  Zr  Zr88  1  0.310575  0.691255  0.518592  1
  Zr  Zr89  1  0.390694  0.190835  0.518650  1
  Zr  Zr90  1  0.890694  0.190835  0.518650  1
  Zr  Zr91  1  0.828294  0.566258  0.473018  1
  Zr  Zr92  1  0.328294  0.566258  0.473018  1
  Zr  Zr93  1  0.599171  0.438543  0.488602  1
  Zr  Zr94  1  0.099171  0.438543  0.488602  1
  Zr  Zr95  1  0.162183  0.064293  0.533935  1
  Zr  Zr96  1  0.662183  0.064293  0.533935  1
  Zr  Zr97  1  0.414676  0.568464  0.594017  1
  Zr  Zr98  1  0.914676  0.568464  0.594017  1
  Zr  Zr99  1  0.852128  0.943603  0.548776  1
  Zr  Zr100  1  0.352128  0.943603  0.548776  1
  Zr  Zr101  1  0.624034  0.817034  0.563906  1
  Zr  Zr102  1  0.124034  0.817034  0.563906  1
  Zr  Zr103  1  0.185386  0.441793  0.609874  1
  Zr  Zr104  1  0.685386  0.441793  0.609874  1
  Zr  Zr105  1  0.766922  0.941389  0.609949  1
  Zr  Zr106  1  0.266922  0.941389  0.609949  1
  Zr  Zr107  1  0.203289  0.316602  0.563946  1
  Zr  Zr108  1  0.703289  0.316602  0.563946  1
  Zr  Zr109  1  0.537306  0.814084  0.624224  1
  Zr  Zr110  1  0.037306  0.814084  0.624224  1
  Zr  Zr111  1  0.974504  0.188708  0.579933  1
  Zr  Zr112  1  0.474504  0.188708  0.579933  1
  Zr  Zr113  1  0.602128  0.443603  0.548776  1
  Zr  Zr114  1  0.102128  0.443603  0.548776  1
  Zr  Zr115  1  0.164676  0.068464  0.594017  1
  Zr  Zr116  1  0.664676  0.068464  0.594017  1
  Zr  Zr117  1  0.374034  0.317034  0.563906  1
  Zr  Zr118  1  0.874034  0.317034  0.563906  1
  Zr  Zr119  1  0.935386  0.941793  0.609874  1
  Zr  Zr120  1  0.435386  0.941793  0.609874  1
  Zr  Zr121  1  0.516922  0.441389  0.609949  1
  Zr  Zr122  1  0.016922  0.441389  0.609949  1
  Zr  Zr123  1  0.953289  0.816602  0.563946  1
  Zr  Zr124  1  0.453289  0.816602  0.563946  1
  Zr  Zr125  1  0.724504  0.688708  0.579933  1
  Zr  Zr126  1  0.224504  0.688708  0.579933  1
  Zr  Zr127  1  0.287306  0.314084  0.624224  1
  Zr  Zr128  1  0.787306  0.314084  0.624224  1
  Zr  Zr129  1  0.540430  0.819800  0.684288  1
  Zr  Zr130  1  0.040430  0.819800  0.684288  1
  Zr  Zr131  1  0.977770  0.194450  0.640987  1
  Zr  Zr132  1  0.477770  0.194450  0.640987  1
  Zr  Zr133  1  0.748924  0.067128  0.655006  1
  Zr  Zr134  1  0.248924  0.067128  0.655006  1
  Zr  Zr135  1  0.321326  0.702426  0.701116  1
  Zr  Zr136  1  0.821326  0.702426  0.701116  1
  Zr  Zr137  1  0.892001  0.202363  0.701144  1
  Zr  Zr138  1  0.392001  0.202363  0.701144  1
  Zr  Zr139  1  0.328891  0.566755  0.655029  1
  Zr  Zr140  1  0.828891  0.566755  0.655029  1
  Zr  Zr141  1  0.660529  0.060431  0.715172  1
  Zr  Zr142  1  0.160529  0.060431  0.715172  1
  Zr  Zr143  1  0.102289  0.443957  0.673611  1
  Zr  Zr144  1  0.602289  0.443957  0.673611  1
  Zr  Zr145  1  0.727770  0.694450  0.640987  1
  Zr  Zr146  1  0.227770  0.694450  0.640987  1
  Zr  Zr147  1  0.290430  0.319800  0.684288  1
  Zr  Zr148  1  0.790430  0.319800  0.684288  1
  Zr  Zr149  1  0.498924  0.567128  0.655006  1
  Zr  Zr150  1  0.998924  0.567128  0.655006  1
  Zr  Zr151  1  0.071326  0.202426  0.701116  1
  Zr  Zr152  1  0.571326  0.202426  0.701116  1
  Zr  Zr153  1  0.642001  0.702363  0.701144  1
  Zr  Zr154  1  0.142001  0.702363  0.701144  1
  Zr  Zr155  1  0.078891  0.066755  0.655029  1
  Zr  Zr156  1  0.578891  0.066755  0.655029  1
  Zr  Zr157  1  0.852289  0.943957  0.673611  1
  Zr  Zr158  1  0.352289  0.943957  0.673611  1
  Zr  Zr159  1  0.410529  0.560431  0.715172  1
  Zr  Zr160  1  0.910529  0.560431  0.715172  1
  Ni  Ni161  1  0.161101  0.809842  0.292887  1
  Ni  Ni162  1  0.661101  0.809842  0.292887  1
  Ni  Ni163  1  0.725600  0.440414  0.337189  1
  Ni  Ni164  1  0.225600  0.440414  0.337189  1
  Ni  Ni165  1  0.224087  0.940361  0.337167  1
  Ni  Ni166  1  0.724087  0.940361  0.337167  1
  Ni  Ni167  1  0.658289  0.309996  0.292931  1
  Ni  Ni168  1  0.158289  0.309996  0.292931  1
  Ni  Ni169  1  0.411101  0.309842  0.292887  1
  Ni  Ni170  1  0.911101  0.309842  0.292887  1
  Ni  Ni171  1  0.975600  0.940414  0.337189  1
  Ni  Ni172  1  0.475600  0.940414  0.337189  1
  Ni  Ni173  1  0.474087  0.440361  0.337167  1
  Ni  Ni174  1  0.974087  0.440361  0.337167  1
  Ni  Ni175  1  0.908289  0.809996  0.292931  1
  Ni  Ni176  1  0.408289  0.809996  0.292931  1
  Ni  Ni177  1  0.287735  0.066572  0.382679  1
  Ni  Ni178  1  0.787735  0.066572  0.382679  1
  Ni  Ni179  1  0.850664  0.691579  0.427760  1
  Ni  Ni180  1  0.350664  0.691579  0.427760  1
  Ni  Ni181  1  0.350630  0.191556  0.427748  1
  Ni  Ni182  1  0.850630  0.191556  0.427748  1
  Ni  Ni183  1  0.788354  0.566519  0.382701  1
  Ni  Ni184  1  0.288354  0.566519  0.382701  1
  Ni  Ni185  1  0.537735  0.566572  0.382679  1
  Ni  Ni186  1  0.037735  0.566572  0.382679  1
  Ni  Ni187  1  0.100664  0.191579  0.427760  1
  Ni  Ni188  1  0.600664  0.191579  0.427760  1
  Ni  Ni189  1  0.600630  0.691556  0.427748  1
  Ni  Ni190  1  0.100630  0.691556  0.427748  1
  Ni  Ni191  1  0.038354  0.066519  0.382701  1
  Ni  Ni192  1  0.538354  0.066519  0.382701  1
  Ni  Ni193  1  0.413081  0.316226  0.473143  1
  Ni  Ni194  1  0.913081  0.316226  0.473143  1
  Ni  Ni195  1  0.975731  0.941292  0.518463  1
  Ni  Ni196  1  0.475731  0.941292  0.518463  1
  Ni  Ni197  1  0.475788  0.441287  0.518467  1
  Ni  Ni198  1  0.975788  0.441287  0.518467  1
  Ni  Ni199  1  0.913139  0.816220  0.473147  1
  Ni  Ni200  1  0.413139  0.816220  0.473147  1
  Ni  Ni201  1  0.663081  0.816226  0.473143  1
  Ni  Ni202  1  0.163081  0.816226  0.473143  1
  Ni  Ni203  1  0.225731  0.441292  0.518463  1
  Ni  Ni204  1  0.725731  0.441292  0.518463  1
  Ni  Ni205  1  0.725788  0.941287  0.518467  1
  Ni  Ni206  1  0.225788  0.941287  0.518467  1
  Ni  Ni207  1  0.163139  0.316220  0.473147  1
  Ni  Ni208  1  0.663139  0.316220  0.473147  1
  Ni  Ni209  1  0.538239  0.565956  0.563861  1
  Ni  Ni210  1  0.038239  0.565956  0.563861  1
  Ni  Ni211  1  0.100515  0.190993  0.608908  1
  Ni  Ni212  1  0.600515  0.190993  0.608908  1
  Ni  Ni213  1  0.601135  0.690940  0.608930  1
  Ni  Ni214  1  0.101135  0.690940  0.608930  1
  Ni  Ni215  1  0.038205  0.065934  0.563849  1
  Ni  Ni216  1  0.538205  0.065934  0.563849  1
  Ni  Ni217  1  0.788239  0.065956  0.563861  1
  Ni  Ni218  1  0.288239  0.065956  0.563861  1
  Ni  Ni219  1  0.350515  0.690993  0.608908  1
  Ni  Ni220  1  0.850515  0.690993  0.608908  1
  Ni  Ni221  1  0.851135  0.190940  0.608930  1
  Ni  Ni222  1  0.351135  0.190940  0.608930  1
  Ni  Ni223  1  0.288205  0.565934  0.563849  1
  Ni  Ni224  1  0.788205  0.565934  0.563849  1
  Ni  Ni225  1  0.664782  0.817152  0.654443  1
  Ni  Ni226  1  0.164782  0.817152  0.654443  1
  Ni  Ni227  1  0.230581  0.447516  0.698678  1
  Ni  Ni228  1  0.730581  0.447516  0.698678  1
  Ni  Ni229  1  0.727768  0.947670  0.698722  1
  Ni  Ni230  1  0.227768  0.947670  0.698722  1
  Ni  Ni231  1  0.163269  0.317099  0.654421  1
  Ni  Ni232  1  0.663269  0.317099  0.654421  1
  Ni  Ni233  1  0.914782  0.317152  0.654443  1
  Ni  Ni234  1  0.414782  0.317152  0.654443  1
  Ni  Ni235  1  0.480581  0.947516  0.698678  1
  Ni  Ni236  1  0.980581  0.947516  0.698678  1
  Ni  Ni237  1  0.977768  0.447670  0.698722  1
  Ni  Ni238  1  0.477768  0.447670  0.698722  1
  Ni  Ni239  1  0.413269  0.817099  0.654421  1
  Ni  Ni240  1  0.913269  0.817099  0.654421  1
