# generated using pymatgen
data_Zr2Ni7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.61068445
_cell_length_b   6.87834005
_cell_length_c   49.24374191
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   83.16828409
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ni7
_chemical_formula_sum   'Zr40 Ni140'
_cell_volume   5586.34362433
_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  0.749537  0.823295  0.318690  1
  Zr  Zr2  1  0.289336  0.947124  0.355945  1
  Zr  Zr3  1  0.776624  0.367943  0.346483  1
  Zr  Zr4  1  0.250773  0.242551  0.304842  1
  Zr  Zr5  1  0.017123  0.878899  0.333384  1
  Zr  Zr6  1  0.491668  0.756407  0.299430  1
  Zr  Zr7  1  0.041852  0.434023  0.359787  1
  Zr  Zr8  1  0.513847  0.301430  0.325104  1
  Zr  Zr9  1  0.818857  0.077784  0.400386  1
  Zr  Zr10  1  0.350221  0.211710  0.438486  1
  Zr  Zr11  1  0.845304  0.630532  0.426636  1
  Zr  Zr12  1  0.306501  0.500480  0.383049  1
  Zr  Zr13  1  0.081192  0.147212  0.416489  1
  Zr  Zr14  1  0.556180  0.011248  0.378978  1
  Zr  Zr15  1  0.107300  0.699444  0.444376  1
  Zr  Zr16  1  0.575582  0.563976  0.406754  1
  Zr  Zr17  1  0.876167  0.346107  0.482838  1
  Zr  Zr18  1  0.407773  0.482008  0.521984  1
  Zr  Zr19  1  0.903239  0.899295  0.510055  1
  Zr  Zr20  1  0.369020  0.766684  0.466500  1
  Zr  Zr21  1  0.139187  0.416312  0.500639  1
  Zr  Zr22  1  0.615343  0.277536  0.462242  1
  Zr  Zr23  1  0.164462  0.970128  0.528314  1
  Zr  Zr24  1  0.636208  0.831892  0.490688  1
  Zr  Zr25  1  0.932195  0.616707  0.566550  1
  Zr  Zr26  1  0.467865  0.749007  0.605510  1
  Zr  Zr27  1  0.959509  0.168451  0.593436  1
  Zr  Zr28  1  0.426348  0.037097  0.550216  1
  Zr  Zr29  1  0.196634  0.685554  0.584080  1
  Zr  Zr30  1  0.672352  0.547868  0.546635  1
  Zr  Zr31  1  0.220908  0.237828  0.610998  1
  Zr  Zr32  1  0.694231  0.101435  0.574635  1
  Zr  Zr33  1  0.997087  0.879137  0.650011  1
  Zr  Zr34  1  0.519584  0.009758  0.684426  1
  Zr  Zr35  1  0.023600  0.439720  0.676282  1
  Zr  Zr36  1  0.485277  0.302058  0.633092  1
  Zr  Zr37  1  0.260912  0.948553  0.664673  1
  Zr  Zr38  1  0.732130  0.814565  0.631206  1
  Zr  Zr39  1  0.286191  0.488425  0.690217  1
  Zr  Zr40  1  0.752210  0.370469  0.657699  1
  Ni  Ni41  1  0.799086  0.721699  0.371639  1
  Ni  Ni42  1  0.267598  0.588442  0.325358  1
  Ni  Ni43  1  0.897213  0.837483  0.298975  1
  Ni  Ni44  1  0.441781  0.969500  0.340313  1
  Ni  Ni45  1  0.934265  0.253194  0.329061  1
  Ni  Ni46  1  0.410342  0.121989  0.296447  1
  Ni  Ni47  1  0.089116  0.216615  0.318075  1
  Ni  Ni48  1  0.624054  0.347587  0.363383  1
  Ni  Ni49  1  0.126511  0.057430  0.363281  1
  Ni  Ni50  1  0.593300  0.928004  0.327545  1
  Ni  Ni51  1  0.162419  0.687651  0.355891  1
  Ni  Ni52  1  0.642961  0.547908  0.315268  1
  Ni  Ni53  1  0.837119  0.498343  0.297499  1
  Ni  Ni54  1  0.399370  0.620140  0.338113  1
  Ni  Ni55  1  0.991584  0.524468  0.303493  1
  Ni  Ni56  1  0.535629  0.648736  0.348928  1
  Ni  Ni57  1  0.178770  0.908104  0.316607  1
  Ni  Ni58  1  0.706993  0.034650  0.361614  1
  Ni  Ni59  1  0.201432  0.325813  0.351797  1
  Ni  Ni60  1  0.672586  0.191409  0.317875  1
  Ni  Ni61  1  0.815512  0.151287  0.303077  1
  Ni  Ni62  1  0.358550  0.284315  0.340588  1
  Ni  Ni63  1  0.857850  0.991810  0.346502  1
  Ni  Ni64  1  0.331774  0.859306  0.304426  1
  Ni  Ni65  1  0.895486  0.615951  0.337466  1
  Ni  Ni66  1  0.380430  0.478822  0.294156  1
  Ni  Ni67  1  0.129672  0.554170  0.312810  1
  Ni  Ni68  1  0.665318  0.685697  0.360703  1
  Ni  Ni69  1  0.860917  0.986716  0.454707  1
  Ni  Ni70  1  0.329611  0.855878  0.411283  1
  Ni  Ni71  1  0.970850  0.100581  0.377103  1
  Ni  Ni72  1  0.505992  0.232401  0.421965  1
  Ni  Ni73  1  1.004068  0.519507  0.414130  1
  Ni  Ni74  1  0.469549  0.388998  0.375769  1
  Ni  Ni75  1  0.153340  0.477856  0.399736  1
  Ni  Ni76  1  0.688153  0.609461  0.446628  1
  Ni  Ni77  1  0.186211  0.325217  0.446802  1
  Ni  Ni78  1  0.659455  0.189342  0.409468  1
  Ni  Ni79  1  0.224169  0.957638  0.441171  1
  Ni  Ni80  1  0.698408  0.817938  0.403402  1
  Ni  Ni81  1  0.932369  0.753762  0.379188  1
  Ni  Ni82  1  0.462974  0.886072  0.422718  1
  Ni  Ni83  1  0.063941  0.792218  0.388904  1
  Ni  Ni84  1  0.595738  0.919591  0.434463  1
  Ni  Ni85  1  0.238114  0.168263  0.398850  1
  Ni  Ni86  1  0.768534  0.299286  0.443921  1
  Ni  Ni87  1  0.265812  0.587217  0.435202  1
  Ni  Ni88  1  0.737341  0.454757  0.398035  1
  Ni  Ni89  1  0.892714  0.409670  0.382222  1
  Ni  Ni90  1  0.419272  0.541828  0.423152  1
  Ni  Ni91  1  0.921400  0.259551  0.429273  1
  Ni  Ni92  1  0.394696  0.123469  0.386937  1
  Ni  Ni93  1  0.962473  0.888853  0.421455  1
  Ni  Ni94  1  0.433749  0.750577  0.380570  1
  Ni  Ni95  1  0.196973  0.820928  0.398869  1
  Ni  Ni96  1  0.727730  0.952992  0.445425  1
  Ni  Ni97  1  0.917340  0.257008  0.537925  1
  Ni  Ni98  1  0.388431  0.126027  0.494736  1
  Ni  Ni99  1  0.030850  0.367295  0.461160  1
  Ni  Ni100  1  0.563902  0.501284  0.505721  1
  Ni  Ni101  1  0.063095  0.787742  0.497982  1
  Ni  Ni102  1  0.531940  0.653602  0.459272  1
  Ni  Ni103  1  0.215176  0.747004  0.484434  1
  Ni  Ni104  1  0.746778  0.879260  0.530709  1
  Ni  Ni105  1  0.243739  0.596547  0.531087  1
  Ni  Ni106  1  0.716516  0.457749  0.493413  1
  Ni  Ni107  1  0.282868  0.228262  0.524869  1
  Ni  Ni108  1  0.759152  0.086710  0.487022  1
  Ni  Ni109  1  0.993025  0.022526  0.463227  1
  Ni  Ni110  1  0.521251  0.156911  0.506559  1
  Ni  Ni111  1  0.123816  0.060688  0.473252  1
  Ni  Ni112  1  0.654186  0.186995  0.517735  1
  Ni  Ni113  1  0.296478  0.435931  0.481788  1
  Ni  Ni114  1  0.825112  0.568314  0.526954  1
  Ni  Ni115  1  0.324596  0.857531  0.518996  1
  Ni  Ni116  1  0.799217  0.717621  0.480026  1
  Ni  Ni117  1  0.954286  0.677632  0.465602  1
  Ni  Ni118  1  0.479036  0.812419  0.507130  1
  Ni  Ni119  1  0.978112  0.528710  0.512701  1
  Ni  Ni120  1  0.453368  0.390429  0.469630  1
  Ni  Ni121  1  0.020126  0.158615  0.505290  1
  Ni  Ni122  1  0.492470  0.021951  0.464638  1
  Ni  Ni123  1  0.256848  0.091820  0.482813  1
  Ni  Ni124  1  0.784844  0.223669  0.529155  1
  Ni  Ni125  1  0.976146  0.525170  0.621754  1
  Ni  Ni126  1  0.446423  0.393929  0.577560  1
  Ni  Ni127  1  0.087141  0.637754  0.544956  1
  Ni  Ni128  1  0.623145  0.771129  0.590365  1
  Ni  Ni129  1  0.119189  0.057446  0.581755  1
  Ni  Ni130  1  0.589961  0.923686  0.543502  1
  Ni  Ni131  1  0.271945  0.015953  0.567626  1
  Ni  Ni132  1  0.803856  0.147501  0.614838  1
  Ni  Ni133  1  0.303868  0.860870  0.613644  1
  Ni  Ni134  1  0.774123  0.727840  0.577787  1
  Ni  Ni135  1  0.343054  0.498301  0.608342  1
  Ni  Ni136  1  0.816475  0.357207  0.570939  1
  Ni  Ni137  1  0.048975  0.293476  0.547170  1
  Ni  Ni138  1  0.578791  0.428743  0.590728  1
  Ni  Ni139  1  0.180545  0.329854  0.556505  1
  Ni  Ni140  1  0.711721  0.456111  0.602092  1
  Ni  Ni141  1  0.354879  0.706378  0.565544  1
  Ni  Ni142  1  0.884056  0.838988  0.611388  1
  Ni  Ni143  1  0.381179  0.125019  0.601978  1
  Ni  Ni144  1  0.856426  0.987998  0.563869  1
  Ni  Ni145  1  0.010820  0.948058  0.549292  1
  Ni  Ni146  1  0.536604  0.080854  0.590447  1
  Ni  Ni147  1  0.036501  0.796725  0.596236  1
  Ni  Ni148  1  0.511140  0.660658  0.553540  1
  Ni  Ni149  1  0.077675  0.429915  0.589065  1
  Ni  Ni150  1  0.552133  0.291515  0.548429  1
  Ni  Ni151  1  0.313719  0.362903  0.566448  1
  Ni  Ni152  1  0.843066  0.492986  0.613428  1
  Ni  Ni153  1  0.046890  0.798004  0.707067  1
  Ni  Ni154  1  0.504070  0.661803  0.663717  1
  Ni  Ni155  1  0.147895  0.904314  0.628761  1
  Ni  Ni156  1  0.680143  0.033119  0.672186  1
  Ni  Ni157  1  0.182285  0.317482  0.663262  1
  Ni  Ni158  1  0.646566  0.191282  0.626897  1
  Ni  Ni159  1  0.334476  0.278753  0.649156  1
  Ni  Ni160  1  0.869369  0.408011  0.693174  1
  Ni  Ni161  1  0.362971  0.126484  0.693354  1
  Ni  Ni162  1  0.836009  0.999139  0.663545  1
  Ni  Ni163  1  0.393499  0.769433  0.695542  1
  Ni  Ni164  1  0.876776  0.632194  0.655258  1
  Ni  Ni165  1  0.108732  0.562994  0.631780  1
  Ni  Ni166  1  0.637985  0.696594  0.677370  1
  Ni  Ni167  1  0.241088  0.595036  0.639517  1
  Ni  Ni168  1  0.772597  0.720894  0.687141  1
  Ni  Ni169  1  0.414388  0.964332  0.648301  1
  Ni  Ni170  1  0.955726  0.098273  0.692033  1
  Ni  Ni171  1  0.442363  0.389939  0.684945  1
  Ni  Ni172  1  0.916450  0.256688  0.647116  1
  Ni  Ni173  1  0.068852  0.215462  0.632203  1
  Ni  Ni174  1  0.592469  0.342702  0.673262  1
  Ni  Ni175  1  0.101263  0.058319  0.677149  1
  Ni  Ni176  1  0.571231  0.923046  0.637480  1
  Ni  Ni177  1  0.145637  0.694825  0.674689  1
  Ni  Ni178  1  0.610331  0.562350  0.633884  1
  Ni  Ni179  1  0.374394  0.629839  0.651102  1
  Ni  Ni180  1  0.913218  0.754550  0.697570  1
