# generated using pymatgen
data_Zr8Ni21
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.62544909
_cell_length_b   20.83127964
_cell_length_c   54.19172686
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.56331035
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Ni21
_chemical_formula_sum   'Zr80 Ni210'
_cell_volume   8605.53387553
_cell_formula_units_Z   10
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  0.194893  0.357601  0.351948  1
  Zr  Zr2  1  0.208051  0.960071  0.306133  1
  Zr  Zr3  1  0.225480  0.691165  0.321605  1
  Zr  Zr4  1  0.368868  0.279571  0.274772  1
  Zr  Zr5  1  0.714104  0.683079  0.282771  1
  Zr  Zr6  1  0.715010  0.082778  0.323173  1
  Zr  Zr7  1  0.870911  0.554219  0.300824  1
  Zr  Zr8  1  0.704476  0.961524  0.346004  1
  Zr  Zr9  1  0.871725  0.379132  0.295042  1
  Zr  Zr10  1  0.721081  0.782883  0.342687  1
  Zr  Zr11  1  0.715531  0.865734  0.287354  1
  Zr  Zr12  1  0.703840  0.264681  0.328512  1
  Zr  Zr13  1  0.374156  0.466643  0.314214  1
  Zr  Zr14  1  0.377780  0.072611  0.271986  1
  Zr  Zr15  1  0.064526  0.578730  0.357119  1
  Zr  Zr16  1  0.204542  0.175287  0.309561  1
  Zr  Zr17  1  0.053509  0.164804  0.441390  1
  Zr  Zr18  1  0.072748  0.765016  0.399992  1
  Zr  Zr19  1  0.087235  0.494552  0.409752  1
  Zr  Zr20  1  0.213411  0.087689  0.364006  1
  Zr  Zr21  1  0.569597  0.493322  0.370203  1
  Zr  Zr22  1  0.584325  0.889050  0.416723  1
  Zr  Zr23  1  0.709380  0.362356  0.390321  1
  Zr  Zr24  1  0.572034  0.767245  0.439447  1
  Zr  Zr25  1  0.712627  0.182344  0.385727  1
  Zr  Zr26  1  0.576426  0.586594  0.432937  1
  Zr  Zr27  1  0.570554  0.671328  0.377234  1
  Zr  Zr28  1  0.563424  0.070699  0.419578  1
  Zr  Zr29  1  0.217027  0.274326  0.405276  1
  Zr  Zr30  1  0.219650  0.872559  0.362273  1
  Zr  Zr31  1  0.906327  0.385303  0.446397  1
  Zr  Zr32  1  0.067469  0.979547  0.401222  1
  Zr  Zr33  1  0.737580  0.973312  0.532622  1
  Zr  Zr34  1  0.896089  0.566802  0.489827  1
  Zr  Zr35  1  0.923030  0.301699  0.500268  1
  Zr  Zr36  1  0.081860  0.895044  0.457452  1
  Zr  Zr37  1  0.409842  0.300059  0.460947  1
  Zr  Zr38  1  0.253313  0.694164  0.510257  1
  Zr  Zr39  1  0.566165  0.174240  0.479833  1
  Zr  Zr40  1  0.409311  0.568408  0.529273  1
  Zr  Zr41  1  0.577768  0.990047  0.477709  1
  Zr  Zr42  1  0.413431  0.394492  0.523347  1
  Zr  Zr43  1  0.405747  0.474036  0.466785  1
  Zr  Zr44  1  0.241684  0.878299  0.512379  1
  Zr  Zr45  1  0.080351  0.085549  0.496354  1
  Zr  Zr46  1  0.077669  0.676653  0.453533  1
  Zr  Zr47  1  0.741735  0.191740  0.536523  1
  Zr  Zr48  1  0.739129  0.782813  0.493743  1
  Zr  Zr49  1  0.606123  0.780703  0.626118  1
  Zr  Zr50  1  0.732233  0.373963  0.580275  1
  Zr  Zr51  1  0.746748  0.103414  0.590043  1
  Zr  Zr52  1  0.765916  0.703563  0.548740  1
  Zr  Zr53  1  0.247456  0.101158  0.550601  1
  Zr  Zr54  1  0.110058  0.506240  0.599737  1
  Zr  Zr55  1  0.235095  0.979369  0.573339  1
  Zr  Zr56  1  0.250077  0.375727  0.620047  1
  Zr  Zr57  1  0.256022  0.797677  0.570535  1
  Zr  Zr58  1  0.248976  0.196966  0.612766  1
  Zr  Zr59  1  0.243061  0.281913  0.557125  1
  Zr  Zr60  1  0.106796  0.686077  0.604436  1
  Zr  Zr61  1  0.751987  0.888853  0.588852  1
  Zr  Zr62  1  0.912837  0.483226  0.543682  1
  Zr  Zr63  1  0.599874  0.995985  0.627783  1
  Zr  Zr64  1  0.602302  0.594028  0.584998  1
  Zr  Zr65  1  0.450718  0.590119  0.715193  1
  Zr  Zr66  1  0.593728  0.177322  0.668431  1
  Zr  Zr67  1  0.611750  0.908760  0.683820  1
  Zr  Zr68  1  0.624094  0.510592  0.638456  1
  Zr  Zr69  1  0.114993  0.907077  0.644045  1
  Zr  Zr70  1  0.948191  0.313311  0.688846  1
  Zr  Zr71  1  0.104393  0.785907  0.666895  1
  Zr  Zr72  1  0.106346  0.186206  0.707352  1
  Zr  Zr73  1  0.116834  0.603829  0.661790  1
  Zr  Zr74  1  0.104037  0.002750  0.702730  1
  Zr  Zr75  1  0.098445  0.085675  0.647373  1
  Zr  Zr76  1  0.948402  0.490424  0.694396  1
  Zr  Zr77  1  0.614879  0.693232  0.680654  1
  Zr  Zr78  1  0.754520  0.289797  0.632880  1
  Zr  Zr79  1  0.442658  0.798219  0.718032  1
  Zr  Zr80  1  0.444909  0.401749  0.675887  1
  Ni  Ni81  1  0.369666  0.408464  0.267074  1
  Ni  Ni82  1  0.214762  0.823493  0.313415  1
  Ni  Ni83  1  0.094552  0.470281  0.280565  1
  Ni  Ni84  1  0.936837  0.876038  0.325999  1
  Ni  Ni85  1  0.502697  0.771023  0.301349  1
  Ni  Ni86  1  0.496354  0.170441  0.344370  1
  Ni  Ni87  1  0.202061  0.571068  0.307508  1
  Ni  Ni88  1  0.033705  0.977862  0.349660  1
  Ni  Ni89  1  0.390051  0.654543  0.284133  1
  Ni  Ni90  1  0.387708  0.069927  0.319603  1
  Ni  Ni91  1  0.856299  0.372821  0.344448  1
  Ni  Ni92  1  0.878245  0.977171  0.300138  1
  Ni  Ni93  1  0.565017  0.673301  0.326633  1
  Ni  Ni94  1  0.706753  0.270283  0.280364  1
  Ni  Ni95  1  0.531141  0.378928  0.345455  1
  Ni  Ni96  1  0.547631  0.977842  0.298919  1
  Ni  Ni97  1  0.645163  0.470850  0.279819  1
  Ni  Ni98  1  0.487935  0.876988  0.324387  1
  Ni  Ni99  1  0.935028  0.769284  0.301861  1
  Ni  Ni100  1  0.928968  0.170353  0.345082  1
  Ni  Ni101  1  0.730787  0.579904  0.345617  1
  Ni  Ni102  1  0.872899  0.172372  0.298069  1
  Ni  Ni103  1  0.712389  0.466758  0.326076  1
  Ni  Ni104  1  0.714362  0.072622  0.277191  1
  Ni  Ni105  1  0.395022  0.584786  0.345731  1
  Ni  Ni106  1  0.542009  0.173349  0.296855  1
  Ni  Ni107  1  0.040285  0.464532  0.326757  1
  Ni  Ni108  1  0.034293  0.073083  0.279215  1
  Ni  Ni109  1  0.544608  0.570288  0.306761  1
  Ni  Ni110  1  0.377316  0.979689  0.347534  1
  Ni  Ni111  1  0.051115  0.657636  0.282293  1
  Ni  Ni112  1  0.042636  0.068645  0.321919  1
  Ni  Ni113  1  0.382136  0.877050  0.279427  1
  Ni  Ni114  1  0.377497  0.277562  0.322861  1
  Ni  Ni115  1  0.197579  0.361967  0.301853  1
  Ni  Ni116  1  0.046048  0.770013  0.348815  1
  Ni  Ni117  1  0.043547  0.874184  0.280340  1
  Ni  Ni118  1  0.031406  0.276021  0.323030  1
  Ni  Ni119  1  0.542950  0.364841  0.301365  1
  Ni  Ni120  1  0.393400  0.772665  0.348413  1
  Ni  Ni121  1  0.889524  0.669076  0.326182  1
  Ni  Ni122  1  0.030266  0.267378  0.279737  1
  Ni  Ni123  1  0.209747  0.221620  0.357008  1
  Ni  Ni124  1  0.072804  0.630223  0.405081  1
  Ni  Ni125  1  0.927943  0.274678  0.369932  1
  Ni  Ni126  1  0.789575  0.681382  0.417664  1
  Ni  Ni127  1  0.353348  0.578692  0.392278  1
  Ni  Ni128  1  0.353558  0.977228  0.436924  1
  Ni  Ni129  1  0.034536  0.378777  0.395428  1
  Ni  Ni130  1  0.899289  0.782872  0.443876  1
  Ni  Ni131  1  0.246697  0.474195  0.365698  1
  Ni  Ni132  1  0.253120  0.874087  0.413721  1
  Ni  Ni133  1  0.715408  0.180445  0.434755  1
  Ni  Ni134  1  0.740522  0.782404  0.392691  1
  Ni  Ni135  1  0.426079  0.479158  0.416593  1
  Ni  Ni136  1  0.546433  0.070223  0.370010  1
  Ni  Ni137  1  0.390190  0.184565  0.435176  1
  Ni  Ni138  1  0.410922  0.782372  0.393442  1
  Ni  Ni139  1  0.486674  0.277239  0.369224  1
  Ni  Ni140  1  0.349910  0.682120  0.417794  1
  Ni  Ni141  1  0.795085  0.575561  0.392489  1
  Ni  Ni142  1  0.795527  0.977547  0.438178  1
  Ni  Ni143  1  0.571495  0.385871  0.435282  1
  Ni  Ni144  1  0.734676  0.979504  0.392141  1
  Ni  Ni145  1  0.554645  0.274048  0.416368  1
  Ni  Ni146  1  0.551055  0.872762  0.370753  1
  Ni  Ni147  1  0.239179  0.388698  0.434723  1
  Ni  Ni148  1  0.401381  0.975744  0.390836  1
  Ni  Ni149  1  0.884936  0.272180  0.416643  1
  Ni  Ni150  1  0.885736  0.876026  0.372784  1
  Ni  Ni151  1  0.379812  0.382649  0.393206  1
  Ni  Ni152  1  0.246543  0.784466  0.443442  1
  Ni  Ni153  1  0.900143  0.469858  0.368614  1
  Ni  Ni154  1  0.909425  0.872886  0.416201  1
  Ni  Ni155  1  0.241621  0.685813  0.370745  1
  Ni  Ni156  1  0.237009  0.084336  0.414007  1
  Ni  Ni157  1  0.041340  0.168590  0.391797  1
  Ni  Ni158  1  0.903036  0.573146  0.438752  1
  Ni  Ni159  1  0.898165  0.682414  0.371073  1
  Ni  Ni160  1  0.892946  0.080339  0.414405  1
  Ni  Ni161  1  0.386223  0.171468  0.390962  1
  Ni  Ni162  1  0.248640  0.574917  0.438705  1
  Ni  Ni163  1  0.749546  0.474306  0.416051  1
  Ni  Ni164  1  0.875601  0.070276  0.370102  1
  Ni  Ni165  1  0.075895  0.029734  0.449123  1
  Ni  Ni166  1  0.909545  0.434294  0.495040  1
  Ni  Ni167  1  0.786765  0.084036  0.460343  1
  Ni  Ni168  1  0.629306  0.484636  0.507936  1
  Ni  Ni169  1  0.189768  0.383904  0.482186  1
  Ni  Ni170  1  0.032740  0.784322  0.529763  1
  Ni  Ni171  1  0.894350  0.188278  0.484290  1
  Ni  Ni172  1  0.735693  0.588348  0.533304  1
  Ni  Ni173  1  0.083437  0.280118  0.456824  1
  Ni  Ni174  1  0.925113  0.680141  0.505809  1
  Ni  Ni175  1  0.401787  0.987189  0.527683  1
  Ni  Ni176  1  0.558348  0.581552  0.482877  1
  Ni  Ni177  1  0.260719  0.286920  0.507248  1
  Ni  Ni178  1  0.417687  0.881177  0.462387  1
  Ni  Ni179  1  0.074013  0.989602  0.526487  1
  Ni  Ni180  1  0.236727  0.586293  0.483193  1
  Ni  Ni181  1  0.350429  0.084880  0.459967  1
  Ni  Ni182  1  0.185081  0.487582  0.507660  1
  Ni  Ni183  1  0.634136  0.380976  0.482462  1
  Ni  Ni184  1  0.469034  0.783462  0.530135  1
  Ni  Ni185  1  0.405510  0.191663  0.525317  1
  Ni  Ni186  1  0.402340  0.783623  0.484366  1
  Ni  Ni187  1  0.417217  0.084773  0.505713  1
  Ni  Ni188  1  0.413841  0.676784  0.464761  1
  Ni  Ni189  1  0.078446  0.197099  0.525229  1
  Ni  Ni190  1  0.074633  0.783557  0.483748  1
  Ni  Ni191  1  0.744845  0.084807  0.506334  1
  Ni  Ni192  1  0.740920  0.671347  0.464856  1
  Ni  Ni193  1  0.234532  0.191836  0.482969  1
  Ni  Ni194  1  0.077760  0.589878  0.532332  1
  Ni  Ni195  1  0.741454  0.278597  0.457816  1
  Ni  Ni196  1  0.584898  0.676562  0.507148  1
  Ni  Ni197  1  0.078065  0.490885  0.460679  1
  Ni  Ni198  1  0.910877  0.885450  0.505551  1
  Ni  Ni199  1  0.908582  0.982897  0.484535  1
  Ni  Ni200  1  0.741167  0.377653  0.529411  1
  Ni  Ni201  1  0.733487  0.486350  0.460674  1
  Ni  Ni202  1  0.567191  0.886690  0.505563  1
  Ni  Ni203  1  0.252260  0.981647  0.484520  1
  Ni  Ni204  1  0.085653  0.382185  0.529404  1
  Ni  Ni205  1  0.582485  0.282188  0.506912  1
  Ni  Ni206  1  0.745421  0.878748  0.463586  1
  Ni  Ni207  1  0.743549  0.838605  0.540974  1
  Ni  Ni208  1  0.746538  0.238326  0.584961  1
  Ni  Ni209  1  0.465899  0.891136  0.553159  1
  Ni  Ni210  1  0.465620  0.289860  0.597793  1
  Ni  Ni211  1  0.029841  0.187077  0.572355  1
  Ni  Ni212  1  0.891323  0.593928  0.620248  1
  Ni  Ni213  1  0.566318  0.994304  0.576350  1
  Ni  Ni214  1  0.572819  0.394169  0.624418  1
  Ni  Ni215  1  0.920205  0.085527  0.546176  1
  Ni  Ni216  1  0.784731  0.489711  0.594801  1
  Ni  Ni217  1  0.273133  0.798183  0.620099  1
  Ni  Ni218  1  0.393227  0.389365  0.573555  1
  Ni  Ni219  1  0.078946  0.086038  0.597343  1
  Ni  Ni220  1  0.104114  0.687963  0.555381  1
  Ni  Ni221  1  0.943867  0.798105  0.620004  1
  Ni  Ni222  1  0.069960  0.394189  0.574010  1
  Ni  Ni223  1  0.023945  0.890817  0.551910  1
  Ni  Ni224  1  0.024861  0.292939  0.597512  1
  Ni  Ni225  1  0.469564  0.186351  0.572262  1
  Ni  Ni226  1  0.332344  0.590957  0.621067  1
  Ni  Ni227  1  0.268486  0.995788  0.619285  1
  Ni  Ni228  1  0.264878  0.594458  0.573861  1
  Ni  Ni229  1  0.084755  0.888884  0.597953  1
  Ni  Ni230  1  0.247707  0.482634  0.554852  1
  Ni  Ni231  1  0.933781  0.992502  0.617278  1
  Ni  Ni232  1  0.934287  0.596330  0.573503  1
  Ni  Ni233  1  0.418035  0.892699  0.599226  1
  Ni  Ni234  1  0.580092  0.479849  0.555453  1
  Ni  Ni235  1  0.910033  0.995523  0.573857  1
  Ni  Ni236  1  0.919269  0.398424  0.621326  1
  Ni  Ni237  1  0.572919  0.083919  0.546629  1
  Ni  Ni238  1  0.439706  0.485801  0.596993  1
  Ni  Ni239  1  0.916379  0.295329  0.551306  1
  Ni  Ni240  1  0.777947  0.699809  0.598368  1
  Ni  Ni241  1  0.582375  0.784016  0.576115  1
  Ni  Ni242  1  0.577918  0.182661  0.619281  1
  Ni  Ni243  1  0.570782  0.293587  0.551382  1
  Ni  Ni244  1  0.433142  0.696838  0.599221  1
  Ni  Ni245  1  0.926467  0.788031  0.575706  1
  Ni  Ni246  1  0.921273  0.186089  0.618912  1
  Ni  Ni247  1  0.408643  0.086061  0.596601  1
  Ni  Ni248  1  0.429294  0.683843  0.554985  1
  Ni  Ni249  1  0.609282  0.646705  0.633246  1
  Ni  Ni250  1  0.604551  0.045246  0.676701  1
  Ni  Ni251  1  0.323093  0.697953  0.645840  1
  Ni  Ni252  1  0.316379  0.097683  0.688759  1
  Ni  Ni253  1  0.882431  0.992579  0.664068  1
  Ni  Ni254  1  0.733711  0.397902  0.708399  1
  Ni  Ni255  1  0.431835  0.798642  0.670463  1
  Ni  Ni256  1  0.429781  0.215517  0.705845  1
  Ni  Ni257  1  0.785816  0.890621  0.640372  1
  Ni  Ni258  1  0.617177  0.297982  0.682324  1
  Ni  Ni259  1  0.112636  0.598975  0.709830  1
  Ni  Ni260  1  0.254721  0.195374  0.663413  1
  Ni  Ni261  1  0.941273  0.891507  0.689920  1
  Ni  Ni262  1  0.962693  0.495787  0.645274  1
  Ni  Ni263  1  0.789347  0.601437  0.710426  1
  Ni  Ni264  1  0.930050  0.199077  0.663763  1
  Ni  Ni265  1  0.890516  0.698018  0.645107  1
  Ni  Ni266  1  0.884902  0.099328  0.688265  1
  Ni  Ni267  1  0.331541  0.991780  0.665658  1
  Ni  Ni268  1  0.161637  0.396271  0.709399  1
  Ni  Ni269  1  0.105785  0.796454  0.712894  1
  Ni  Ni270  1  0.105540  0.401578  0.663817  1
  Ni  Ni271  1  0.946791  0.696516  0.692077  1
  Ni  Ni272  1  0.088923  0.288375  0.644232  1
  Ni  Ni273  1  0.785773  0.795781  0.710904  1
  Ni  Ni274  1  0.778895  0.404000  0.663072  1
  Ni  Ni275  1  0.277927  0.695831  0.693392  1
  Ni  Ni276  1  0.424448  0.283841  0.644256  1
  Ni  Ni277  1  0.776838  0.799974  0.668189  1
  Ni  Ni278  1  0.768196  0.210912  0.707683  1
  Ni  Ni279  1  0.442068  0.888827  0.642522  1
  Ni  Ni280  1  0.274707  0.298765  0.683071  1
  Ni  Ni281  1  0.773464  0.098541  0.641256  1
  Ni  Ni282  1  0.621534  0.506153  0.688617  1
  Ni  Ni283  1  0.441852  0.590378  0.667502  1
  Ni  Ni284  1  0.437396  0.991027  0.710662  1
  Ni  Ni285  1  0.426060  0.095839  0.641642  1
  Ni  Ni286  1  0.279892  0.502469  0.690179  1
  Ni  Ni287  1  0.787411  0.592348  0.667163  1
  Ni  Ni288  1  0.775921  0.994521  0.709741  1
  Ni  Ni289  1  0.271701  0.891015  0.690988  1
  Ni  Ni290  1  0.287370  0.489931  0.645540  1
