# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.93245141
_cell_length_b   12.64928564
_cell_length_c   47.27402715
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.09346927
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni216
_cell_volume   5463.48450335
_cell_formula_units_Z   216
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
  Ni  Ni1  1  0.136409  0.042914  0.327777  1
  Ni  Ni2  1  0.637680  0.043355  0.328187  1
  Ni  Ni3  1  0.569729  0.407388  0.311613  1
  Ni  Ni4  1  0.002878  0.773639  0.296291  1
  Ni  Ni5  1  0.069565  0.407714  0.311634  1
  Ni  Ni6  1  0.502297  0.773191  0.296122  1
  Ni  Ni7  1  0.602458  0.223022  0.319010  1
  Ni  Ni8  1  0.103652  0.225407  0.319557  1
  Ni  Ni9  1  0.036035  0.590619  0.303810  1
  Ni  Ni10  1  0.469319  0.956737  0.288896  1
  Ni  Ni11  1  0.536527  0.590611  0.303810  1
  Ni  Ni12  1  0.670661  0.861536  0.335728  1
  Ni  Ni13  1  0.352468  0.223201  0.319081  1
  Ni  Ni14  1  0.852627  0.223201  0.319082  1
  Ni  Ni15  1  0.786158  0.590359  0.303859  1
  Ni  Ni16  1  0.218902  0.955832  0.289027  1
  Ni  Ni17  1  0.286114  0.590281  0.303792  1
  Ni  Ni18  1  0.718824  0.955820  0.289027  1
  Ni  Ni19  1  0.387549  0.043357  0.328187  1
  Ni  Ni20  1  0.888374  0.042916  0.327774  1
  Ni  Ni21  1  0.819600  0.407389  0.311614  1
  Ni  Ni22  1  0.252835  0.773195  0.296123  1
  Ni  Ni23  1  0.320082  0.407710  0.311634  1
  Ni  Ni24  1  0.752676  0.773609  0.296293  1
  Ni  Ni25  1  0.842614  0.953340  0.374985  1
  Ni  Ni26  1  0.342562  0.953345  0.375130  1
  Ni  Ni27  1  0.274490  0.316573  0.358673  1
  Ni  Ni28  1  0.706174  0.680321  0.343156  1
  Ni  Ni29  1  0.773950  0.316181  0.358535  1
  Ni  Ni30  1  0.205975  0.680129  0.343085  1
  Ni  Ni31  1  0.308110  0.135436  0.366924  1
  Ni  Ni32  1  0.809113  0.135439  0.366926  1
  Ni  Ni33  1  0.740090  0.498356  0.350870  1
  Ni  Ni34  1  0.172736  0.861542  0.335729  1
  Ni  Ni35  1  0.240039  0.498257  0.350865  1
  Ni  Ni36  1  0.376385  0.771019  0.382860  1
  Ni  Ni37  1  0.058655  0.135531  0.366998  1
  Ni  Ni38  1  0.558723  0.135656  0.367043  1
  Ni  Ni39  1  0.490317  0.498451  0.350867  1
  Ni  Ni40  1  0.922162  0.862472  0.335237  1
  Ni  Ni41  1  0.989956  0.498455  0.350868  1
  Ni  Ni42  1  0.421942  0.862024  0.335459  1
  Ni  Ni43  1  0.092487  0.953337  0.374985  1
  Ni  Ni44  1  0.592552  0.953345  0.375131  1
  Ni  Ni45  1  0.524019  0.316181  0.358534  1
  Ni  Ni46  1  0.955992  0.680329  0.343155  1
  Ni  Ni47  1  0.023872  0.316573  0.358674  1
  Ni  Ni48  1  0.456000  0.680132  0.343085  1
  Ni  Ni49  1  0.546771  0.861908  0.422641  1
  Ni  Ni50  1  0.046802  0.861960  0.422595  1
  Ni  Ni51  1  0.978762  0.225786  0.406616  1
  Ni  Ni52  1  0.410386  0.588994  0.390666  1
  Ni  Ni53  1  0.478631  0.225742  0.406583  1
  Ni  Ni54  1  0.910328  0.589094  0.390678  1
  Ni  Ni55  1  0.012829  0.043969  0.414654  1
  Ni  Ni56  1  0.512863  0.044025  0.414735  1
  Ni  Ni57  1  0.444553  0.407176  0.398485  1
  Ni  Ni58  1  0.876544  0.771341  0.382779  1
  Ni  Ni59  1  0.944337  0.407173  0.398488  1
  Ni  Ni60  1  0.080772  0.679881  0.430500  1
  Ni  Ni61  1  0.762929  0.044010  0.414682  1
  Ni  Ni62  1  0.262775  0.044007  0.414678  1
  Ni  Ni63  1  0.194447  0.407181  0.398511  1
  Ni  Ni64  1  0.626436  0.770978  0.382927  1
  Ni  Ni65  1  0.694388  0.407057  0.398450  1
  Ni  Ni66  1  0.126290  0.770976  0.382928  1
  Ni  Ni67  1  0.796832  0.861964  0.422595  1
  Ni  Ni68  1  0.296818  0.861905  0.422640  1
  Ni  Ni69  1  0.228734  0.225787  0.406613  1
  Ni  Ni70  1  0.660500  0.589093  0.390677  1
  Ni  Ni71  1  0.728824  0.225741  0.406586  1
  Ni  Ni72  1  0.160340  0.588992  0.390668  1
  Ni  Ni73  1  0.251155  0.770693  0.470274  1
  Ni  Ni74  1  0.751156  0.770725  0.470258  1
  Ni  Ni75  1  0.683142  0.134593  0.454378  1
  Ni  Ni76  1  0.114791  0.497983  0.438354  1
  Ni  Ni77  1  0.183078  0.134575  0.454363  1
  Ni  Ni78  1  0.614870  0.498004  0.438337  1
  Ni  Ni79  1  0.717137  0.952654  0.462343  1
  Ni  Ni80  1  0.217121  0.952645  0.462335  1
  Ni  Ni81  1  0.148991  0.316346  0.446352  1
  Ni  Ni82  1  0.580771  0.679884  0.430496  1
  Ni  Ni83  1  0.648978  0.316314  0.446321  1
  Ni  Ni84  1  0.785221  0.588850  0.478159  1
  Ni  Ni85  1  0.467139  0.952652  0.462360  1
  Ni  Ni86  1  0.967119  0.952649  0.462326  1
  Ni  Ni87  1  0.898979  0.316335  0.446342  1
  Ni  Ni88  1  0.330765  0.679869  0.430482  1
  Ni  Ni89  1  0.399000  0.316345  0.446335  1
  Ni  Ni90  1  0.830830  0.680000  0.430461  1
  Ni  Ni91  1  0.501139  0.770695  0.470272  1
  Ni  Ni92  1  1.001152  0.770722  0.470260  1
  Ni  Ni93  1  0.933118  0.134574  0.454370  1
  Ni  Ni94  1  0.364838  0.497988  0.438350  1
  Ni  Ni95  1  0.433080  0.134594  0.454370  1
  Ni  Ni96  1  0.864783  0.498000  0.438340  1
  Ni  Ni97  1  0.955576  0.679646  0.517977  1
  Ni  Ni98  1  0.455563  0.679626  0.517972  1
  Ni  Ni99  1  0.387426  0.043314  0.502051  1
  Ni  Ni100  1  0.819289  0.407027  0.486102  1
  Ni  Ni101  1  0.887420  0.043313  0.502062  1
  Ni  Ni102  1  0.319307  0.407042  0.486107  1
  Ni  Ni103  1  0.421507  0.861443  0.510035  1
  Ni  Ni104  1  0.921461  0.861449  0.510022  1
  Ni  Ni105  1  0.853389  0.225205  0.494091  1
  Ni  Ni106  1  0.285190  0.588813  0.478171  1
  Ni  Ni107  1  0.353381  0.225225  0.494072  1
  Ni  Ni108  1  0.489664  0.497817  0.525878  1
  Ni  Ni109  1  0.171480  0.861437  0.510023  1
  Ni  Ni110  1  0.671486  0.861450  0.510031  1
  Ni  Ni111  1  0.603385  0.225218  0.494077  1
  Ni  Ni112  1  0.035189  0.588820  0.478174  1
  Ni  Ni113  1  0.103383  0.225209  0.494083  1
  Ni  Ni114  1  0.535213  0.588825  0.478165  1
  Ni  Ni115  1  0.205572  0.679634  0.517983  1
  Ni  Ni116  1  0.705583  0.679638  0.517966  1
  Ni  Ni117  1  0.637449  0.043322  0.502069  1
  Ni  Ni118  1  0.069289  0.407026  0.486114  1
  Ni  Ni119  1  0.137408  0.043305  0.502043  1
  Ni  Ni120  1  0.569322  0.407043  0.486095  1
  Ni  Ni121  1  0.660066  0.588614  0.565678  1
  Ni  Ni122  1  0.160007  0.588625  0.565698  1
  Ni  Ni123  1  0.091728  0.952091  0.549750  1
  Ni  Ni124  1  0.523705  0.315919  0.533800  1
  Ni  Ni125  1  0.591849  0.952134  0.549789  1
  Ni  Ni126  1  0.023688  0.315871  0.533820  1
  Ni  Ni127  1  0.125942  0.770443  0.557790  1
  Ni  Ni128  1  0.625925  0.770408  0.557771  1
  Ni  Ni129  1  0.557712  0.133955  0.541761  1
  Ni  Ni130  1  0.989639  0.497790  0.525891  1
  Ni  Ni131  1  0.057707  0.133947  0.541760  1
  Ni  Ni132  1  0.194003  0.406609  0.573574  1
  Ni  Ni133  1  0.875908  0.770438  0.557780  1
  Ni  Ni134  1  0.375970  0.770435  0.557785  1
  Ni  Ni135  1  0.307707  0.133957  0.541737  1
  Ni  Ni136  1  0.739664  0.497795  0.525887  1
  Ni  Ni137  1  0.807711  0.133946  0.541795  1
  Ni  Ni138  1  0.239627  0.497787  0.525895  1
  Ni  Ni139  1  0.910047  0.588629  0.565695  1
  Ni  Ni140  1  0.409979  0.588611  0.565681  1
  Ni  Ni141  1  0.341812  0.952093  0.549754  1
  Ni  Ni142  1  0.773670  0.315875  0.533815  1
  Ni  Ni143  1  0.841739  0.952131  0.549785  1
  Ni  Ni144  1  0.273697  0.315915  0.533805  1
  Ni  Ni145  1  0.364376  0.497575  0.613330  1
  Ni  Ni146  1  0.864432  0.497504  0.613319  1
  Ni  Ni147  1  0.796100  0.861190  0.597607  1
  Ni  Ni148  1  0.228009  0.224619  0.581433  1
  Ni  Ni149  1  0.296364  0.861164  0.597597  1
  Ni  Ni150  1  0.727922  0.224543  0.581484  1
  Ni  Ni151  1  0.830502  0.679513  0.605528  1
  Ni  Ni152  1  0.330370  0.679511  0.605530  1
  Ni  Ni153  1  0.261980  0.042586  0.589402  1
  Ni  Ni154  1  0.694023  0.406612  0.573570  1
  Ni  Ni155  1  0.762058  0.042731  0.589574  1
  Ni  Ni156  1  0.898342  0.315357  0.621082  1
  Ni  Ni157  1  0.580366  0.679372  0.605486  1
  Ni  Ni158  1  0.080446  0.679533  0.605559  1
  Ni  Ni159  1  0.011930  0.042662  0.589468  1
  Ni  Ni160  1  0.444076  0.406734  0.573533  1
  Ni  Ni161  1  0.512116  0.042667  0.589468  1
  Ni  Ni162  1  0.944015  0.406618  0.573544  1
  Ni  Ni163  1  0.614543  0.497574  0.613329  1
  Ni  Ni164  1  0.114412  0.497501  0.613321  1
  Ni  Ni165  1  0.046171  0.861162  0.597595  1
  Ni  Ni166  1  0.478009  0.224623  0.581431  1
  Ni  Ni167  1  0.546465  0.861192  0.597609  1
  Ni  Ni168  1  0.978020  0.224541  0.581485  1
  Ni  Ni169  1  0.068889  0.406377  0.660757  1
  Ni  Ni170  1  0.568991  0.406723  0.660829  1
  Ni  Ni171  1  0.500677  0.769987  0.645290  1
  Ni  Ni172  1  0.932343  0.133026  0.629205  1
  Ni  Ni173  1  1.001055  0.770336  0.645426  1
  Ni  Ni174  1  0.432069  0.132968  0.628975  1
  Ni  Ni175  1  0.534779  0.588305  0.653114  1
  Ni  Ni176  1  0.034648  0.588047  0.653133  1
  Ni  Ni177  1  0.965680  0.951626  0.637337  1
  Ni  Ni178  1  0.398468  0.315609  0.621062  1
  Ni  Ni179  1  0.467251  0.951632  0.637338  1
  Ni  Ni180  1  0.601269  0.224583  0.668438  1
  Ni  Ni181  1  0.284619  0.588329  0.653125  1
  Ni  Ni182  1  0.784957  0.588326  0.653125  1
  Ni  Ni183  1  0.716765  0.952223  0.637588  1
  Ni  Ni184  1  0.148225  0.315225  0.621204  1
  Ni  Ni185  1  0.216384  0.951474  0.637315  1
  Ni  Ni186  1  0.648329  0.315228  0.621202  1
  Ni  Ni187  1  0.318969  0.406730  0.660829  1
  Ni  Ni188  1  0.818726  0.406382  0.660756  1
  Ni  Ni189  1  0.750586  0.769987  0.645289  1
  Ni  Ni190  1  0.182202  0.132965  0.628976  1
  Ni  Ni191  1  0.250560  0.770337  0.645426  1
  Ni  Ni192  1  0.681994  0.133026  0.629205  1
  Ni  Ni193  1  0.771193  0.311707  0.707400  1
  Ni  Ni194  1  0.272453  0.313578  0.707626  1
  Ni  Ni195  1  0.204593  0.678650  0.692406  1
  Ni  Ni196  1  0.638349  0.045388  0.677146  1
  Ni  Ni197  1  0.704902  0.678451  0.692382  1
  Ni  Ni198  1  0.136397  0.043651  0.676237  1
  Ni  Ni199  1  0.238021  0.495769  0.700138  1
  Ni  Ni200  1  0.738876  0.495757  0.700138  1
  Ni  Ni201  1  0.671165  0.861169  0.684515  1
  Ni  Ni202  1  0.104541  0.224586  0.668441  1
  Ni  Ni203  1  0.172303  0.863441  0.685013  1
  Ni  Ni204  1  0.306557  0.131945  0.714725  1
  Ni  Ni205  1  0.988098  0.495061  0.700121  1
  Ni  Ni206  1  0.488506  0.495869  0.700180  1
  Ni  Ni207  1  0.421366  0.861250  0.684543  1
  Ni  Ni208  1  0.853266  0.225306  0.668061  1
  Ni  Ni209  1  0.921046  0.861249  0.684543  1
  Ni  Ni210  1  0.353337  0.225453  0.668017  1
  Ni  Ni211  1  0.021697  0.311712  0.707402  1
  Ni  Ni212  1  0.522280  0.313543  0.707627  1
  Ni  Ni213  1  0.454689  0.678453  0.692382  1
  Ni  Ni214  1  0.888245  0.045388  0.677146  1
  Ni  Ni215  1  0.955190  0.678646  0.692406  1
  Ni  Ni216  1  0.388458  0.043656  0.676235  1
