# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.15659018
_cell_length_b   9.79135732
_cell_length_c   52.34082610
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   54.91925385
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr40 Ni140'
_cell_volume   5098.36079909
_cell_formula_units_Z   20
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  0.889569  0.760877  0.297551  1
  Zr  Zr2  1  0.704367  0.532694  0.336630  1
  Zr  Zr3  1  0.868028  0.192420  0.299540  1
  Zr  Zr4  1  0.689906  0.962331  0.345053  1
  Zr  Zr5  1  0.299273  0.642118  0.318724  1
  Zr  Zr6  1  0.117503  0.414567  0.360577  1
  Zr  Zr7  1  0.463501  0.302639  0.279323  1
  Zr  Zr8  1  0.279212  0.081725  0.321316  1
  Zr  Zr9  1  0.535925  0.296318  0.383926  1
  Zr  Zr10  1  0.365987  0.054777  0.429750  1
  Zr  Zr11  1  0.523368  0.721953  0.389957  1
  Zr  Zr12  1  0.355496  0.483513  0.435370  1
  Zr  Zr13  1  0.951502  0.175960  0.406751  1
  Zr  Zr14  1  0.782458  0.934304  0.452674  1
  Zr  Zr15  1  0.106761  0.843172  0.366690  1
  Zr  Zr16  1  0.938941  0.604440  0.412591  1
  Zr  Zr17  1  0.199987  0.811869  0.475698  1
  Zr  Zr18  1  0.034335  0.568363  0.521896  1
  Zr  Zr19  1  0.191728  0.238484  0.481979  1
  Zr  Zr20  1  0.025730  0.995415  0.528073  1
  Zr  Zr21  1  0.616936  0.690304  0.498707  1
  Zr  Zr22  1  0.451830  0.446410  0.545095  1
  Zr  Zr23  1  0.773856  0.360686  0.458782  1
  Zr  Zr24  1  0.608932  0.116533  0.505201  1
  Zr  Zr25  1  0.869853  0.323884  0.568435  1
  Zr  Zr26  1  0.702318  0.085582  0.614226  1
  Zr  Zr27  1  0.859026  0.752946  0.573895  1
  Zr  Zr28  1  0.688945  0.511834  0.619948  1
  Zr  Zr29  1  0.287094  0.203026  0.591343  1
  Zr  Zr30  1  0.117414  0.965945  0.637069  1
  Zr  Zr31  1  0.442537  0.873156  0.551122  1
  Zr  Zr32  1  0.274440  0.631837  0.597070  1
  Zr  Zr33  1  0.532285  0.846103  0.658672  1
  Zr  Zr34  1  0.359976  0.614356  0.704320  1
  Zr  Zr35  1  0.518950  0.277731  0.667111  1
  Zr  Zr36  1  0.326914  0.054397  0.705961  1
  Zr  Zr37  1  0.944707  0.729090  0.681800  1
  Zr  Zr38  1  0.765432  0.505305  0.724212  1
  Zr  Zr39  1  0.106092  0.395284  0.642674  1
  Zr  Zr40  1  0.923456  0.168465  0.685383  1
  Ni  Ni41  1  0.700067  0.247414  0.339855  1
  Ni  Ni42  1  0.861521  0.488019  0.291908  1
  Ni  Ni43  1  0.295906  0.493981  0.360110  1
  Ni  Ni44  1  0.464200  0.740585  0.311427  1
  Ni  Ni45  1  0.327508  0.836346  0.352713  1
  Ni  Ni46  1  0.497138  0.064728  0.307844  1
  Ni  Ni47  1  0.699152  0.094122  0.301287  1
  Ni  Ni48  1  0.520612  0.870227  0.345916  1
  Ni  Ni49  1  0.494903  0.538276  0.351310  1
  Ni  Ni50  1  0.664856  0.771130  0.306496  1
  Ni  Ni51  1  0.493799  0.306794  0.328714  1
  Ni  Ni52  1  0.643530  0.566591  0.278631  1
  Ni  Ni53  1  0.584147  0.424881  0.304195  1
  Ni  Ni54  1  0.407028  0.188171  0.351850  1
  Ni  Ni55  1  0.282941  0.365625  0.316866  1
  Ni  Ni56  1  0.412342  0.608584  0.272464  1
  Ni  Ni57  1  0.059775  0.852520  0.294450  1
  Ni  Ni58  1  0.879001  0.615756  0.335955  1
  Ni  Ni59  1  0.910725  0.951514  0.331384  1
  Ni  Ni60  1  0.081505  0.190745  0.285723  1
  Ni  Ni61  1  0.105383  0.997913  0.324383  1
  Ni  Ni62  1  0.277907  0.229450  0.277589  1
  Ni  Ni63  1  0.081997  0.650835  0.329161  1
  Ni  Ni64  1  0.242757  0.894400  0.286790  1
  Ni  Ni65  1  0.906279  0.192493  0.351773  1
  Ni  Ni66  1  0.074713  0.438089  0.302389  1
  Ni  Ni67  1  0.189630  0.555732  0.280758  1
  Ni  Ni68  1  0.990405  0.316314  0.327714  1
  Ni  Ni69  1  0.361083  0.767500  0.432763  1
  Ni  Ni70  1  0.528410  0.008985  0.387009  1
  Ni  Ni71  1  0.956474  0.021547  0.450950  1
  Ni  Ni72  1  0.122858  0.264987  0.404890  1
  Ni  Ni73  1  0.989747  0.355112  0.444981  1
  Ni  Ni74  1  0.153197  0.597345  0.398537  1
  Ni  Ni75  1  0.348628  0.637482  0.390499  1
  Ni  Ni76  1  0.183952  0.394243  0.437459  1
  Ni  Ni77  1  0.151129  0.060355  0.443589  1
  Ni  Ni78  1  0.317938  0.301683  0.397584  1
  Ni  Ni79  1  0.152825  0.829129  0.421001  1
  Ni  Ni80  1  0.321743  0.069838  0.375255  1
  Ni  Ni81  1  0.236988  0.950114  0.398191  1
  Ni  Ni82  1  0.070816  0.707327  0.444229  1
  Ni  Ni83  1  0.944791  0.888341  0.409721  1
  Ni  Ni84  1  0.113615  0.132608  0.363408  1
  Ni  Ni85  1  0.709894  0.383466  0.381823  1
  Ni  Ni86  1  0.538898  0.144219  0.427845  1
  Ni  Ni87  1  0.572323  0.475758  0.421713  1
  Ni  Ni88  1  0.738894  0.715651  0.375913  1
  Ni  Ni89  1  0.767520  0.514997  0.414412  1
  Ni  Ni90  1  0.932989  0.754889  0.367746  1
  Ni  Ni91  1  0.735371  0.181739  0.420616  1
  Ni  Ni92  1  0.902159  0.422469  0.374137  1
  Ni  Ni93  1  0.569596  0.707992  0.444112  1
  Ni  Ni94  1  0.736283  0.951295  0.398174  1
  Ni  Ni95  1  0.822170  0.071732  0.375426  1
  Ni  Ni96  1  0.654421  0.828519  0.421321  1
  Ni  Ni97  1  0.030312  0.281881  0.524959  1
  Ni  Ni98  1  0.195537  0.525243  0.478835  1
  Ni  Ni99  1  0.624833  0.534652  0.543192  1
  Ni  Ni100  1  0.790133  0.778875  0.497062  1
  Ni  Ni101  1  0.657987  0.867670  0.537162  1
  Ni  Ni102  1  0.823570  0.111715  0.491055  1
  Ni  Ni103  1  0.018359  0.150396  0.483673  1
  Ni  Ni104  1  0.852947  0.906971  0.529835  1
  Ni  Ni105  1  0.819296  0.573154  0.535905  1
  Ni  Ni106  1  0.984842  0.817510  0.489643  1
  Ni  Ni107  1  0.821674  0.342466  0.513484  1
  Ni  Ni108  1  0.986627  0.586901  0.467161  1
  Ni  Ni109  1  0.904604  0.464443  0.490423  1
  Ni  Ni110  1  0.737949  0.221603  0.536520  1
  Ni  Ni111  1  0.612819  0.403581  0.501902  1
  Ni  Ni112  1  0.778137  0.646678  0.455918  1
  Ni  Ni113  1  0.372890  0.900145  0.473990  1
  Ni  Ni114  1  0.207344  0.656788  0.520119  1
  Ni  Ni115  1  0.240835  0.989635  0.514155  1
  Ni  Ni116  1  0.406604  0.233765  0.467949  1
  Ni  Ni117  1  0.435669  0.028187  0.506839  1
  Ni  Ni118  1  0.600738  0.272369  0.460627  1
  Ni  Ni119  1  0.401996  0.695383  0.512754  1
  Ni  Ni120  1  0.567410  0.939491  0.466684  1
  Ni  Ni121  1  0.239231  0.220249  0.536697  1
  Ni  Ni122  1  0.404082  0.464493  0.490358  1
  Ni  Ni123  1  0.487354  0.585658  0.467277  1
  Ni  Ni124  1  0.321073  0.342774  0.513421  1
  Ni  Ni125  1  0.695949  0.798631  0.616652  1
  Ni  Ni126  1  0.864406  0.040065  0.570983  1
  Ni  Ni127  1  0.290795  0.053569  0.635982  1
  Ni  Ni128  1  0.458738  0.292273  0.589487  1
  Ni  Ni129  1  0.322563  0.386702  0.629445  1
  Ni  Ni130  1  0.490232  0.625591  0.583209  1
  Ni  Ni131  1  0.685743  0.663705  0.575851  1
  Ni  Ni132  1  0.515520  0.424900  0.622068  1
  Ni  Ni133  1  0.485565  0.092562  0.627857  1
  Ni  Ni134  1  0.653265  0.331389  0.582174  1
  Ni  Ni135  1  0.488191  0.857059  0.605490  1
  Ni  Ni136  1  0.656292  0.098951  0.559817  1
  Ni  Ni137  1  0.570754  0.979346  0.582476  1
  Ni  Ni138  1  0.403867  0.735970  0.628503  1
  Ni  Ni139  1  0.280199  0.919128  0.594141  1
  Ni  Ni140  1  0.447594  0.160768  0.547921  1
  Ni  Ni141  1  0.042066  0.412578  0.566404  1
  Ni  Ni142  1  0.875971  0.171061  0.613193  1
  Ni  Ni143  1  0.906257  0.506440  0.605994  1
  Ni  Ni144  1  0.074568  0.747113  0.560168  1
  Ni  Ni145  1  0.101848  0.543927  0.598655  1
  Ni  Ni146  1  0.269020  0.785700  0.552851  1
  Ni  Ni147  1  0.071632  0.210747  0.605239  1
  Ni  Ni148  1  0.236213  0.452175  0.558865  1
  Ni  Ni149  1  0.902682  0.738794  0.628197  1
  Ni  Ni150  1  0.072410  0.978874  0.582734  1
  Ni  Ni151  1  0.154856  0.100063  0.559578  1
  Ni  Ni152  1  0.988338  0.858125  0.605494  1
  Ni  Ni153  1  0.357788  0.323217  0.711832  1
  Ni  Ni154  1  0.524754  0.559573  0.664502  1
  Ni  Ni155  1  0.946842  0.583694  0.725663  1
  Ni  Ni156  1  0.118717  0.812652  0.679212  1
  Ni  Ni157  1  0.969860  0.922744  0.715732  1
  Ni  Ni158  1  0.140175  0.158491  0.674308  1
  Ni  Ni159  1  0.343039  0.195282  0.667311  1
  Ni  Ni160  1  0.162641  0.954719  0.709443  1
  Ni  Ni161  1  0.140634  0.626678  0.717509  1
  Ni  Ni162  1  0.313237  0.857079  0.672569  1
  Ni  Ni163  1  0.146969  0.377768  0.700283  1
  Ni  Ni164  1  0.318118  0.617804  0.651852  1
  Ni  Ni165  1  0.235129  0.494523  0.675768  1
  Ni  Ni166  1  0.043929  0.254715  0.722366  1
  Ni  Ni167  1  0.940845  0.443397  0.686659  1
  Ni  Ni168  1  0.111089  0.676184  0.640161  1
  Ni  Ni169  1  0.702153  0.936987  0.657332  1
  Ni  Ni170  1  0.526643  0.715956  0.702772  1
  Ni  Ni171  1  0.554114  0.037401  0.696513  1
  Ni  Ni172  1  0.729908  0.271298  0.652508  1
  Ni  Ni173  1  0.754356  0.068189  0.690091  1
  Ni  Ni174  1  0.928358  0.313722  0.643722  1
  Ni  Ni175  1  0.728398  0.744803  0.695625  1
  Ni  Ni176  1  0.897766  0.973101  0.650805  1
  Ni  Ni177  1  0.574515  0.240948  0.723427  1
  Ni  Ni178  1  0.729734  0.503703  0.674998  1
  Ni  Ni179  1  0.817453  0.619937  0.651697  1
  Ni  Ni180  1  0.646517  0.378910  0.700228  1
