# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.78137982
_cell_length_b   13.28107629
_cell_length_c   46.22218924
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.56483331
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni252
_cell_volume   6314.40264221
_cell_formula_units_Z   252
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  0.806670  0.663641  0.293299  1
  Ni  Ni2  1  0.140004  0.330307  0.293299  1
  Ni  Ni3  1  0.199140  0.678416  0.283304  1
  Ni  Ni4  1  0.417910  0.653705  0.302439  1
  Ni  Ni5  1  0.751243  0.320372  0.302439  1
  Ni  Ni6  1  0.084576  0.987039  0.302439  1
  Ni  Ni7  1  0.473337  0.996974  0.293299  1
  Ni  Ni8  1  0.532474  0.345082  0.283304  1
  Ni  Ni9  1  0.865807  0.011749  0.283304  1
  Ni  Ni10  1  0.833026  0.479184  0.308993  1
  Ni  Ni11  1  0.166359  0.145851  0.308993  1
  Ni  Ni12  1  0.223375  0.490239  0.298280  1
  Ni  Ni13  1  0.611480  0.502303  0.289178  1
  Ni  Ni14  1  0.944813  0.168970  0.289178  1
  Ni  Ni15  1  0.278146  0.835636  0.289178  1
  Ni  Ni16  1  0.499692  0.812517  0.308993  1
  Ni  Ni17  1  0.556708  0.156905  0.298280  1
  Ni  Ni18  1  0.890042  0.823572  0.298280  1
  Ni  Ni19  1  0.636847  0.633641  0.323923  1
  Ni  Ni20  1  0.970181  0.300308  0.323923  1
  Ni  Ni21  1  0.026388  0.643065  0.312932  1
  Ni  Ni22  1  0.243112  0.627329  0.333929  1
  Ni  Ni23  1  0.576445  0.293996  0.333929  1
  Ni  Ni24  1  0.909779  0.960662  0.333929  1
  Ni  Ni25  1  0.303514  0.966974  0.323923  1
  Ni  Ni26  1  0.359721  0.309731  0.312932  1
  Ni  Ni27  1  0.693055  0.976398  0.312932  1
  Ni  Ni28  1  0.654110  0.452547  0.340104  1
  Ni  Ni29  1  0.987443  0.119213  0.340104  1
  Ni  Ni30  1  0.046562  0.464075  0.329974  1
  Ni  Ni31  1  0.435685  0.474048  0.319874  1
  Ni  Ni32  1  0.769018  0.140714  0.319874  1
  Ni  Ni33  1  0.102352  0.807381  0.319874  1
  Ni  Ni34  1  0.320777  0.785880  0.340104  1
  Ni  Ni35  1  0.379895  0.130742  0.329974  1
  Ni  Ni36  1  0.713228  0.797409  0.329974  1
  Ni  Ni37  1  0.462597  0.608030  0.354480  1
  Ni  Ni38  1  0.795931  0.274697  0.354480  1
  Ni  Ni39  1  0.853152  0.617449  0.344561  1
  Ni  Ni40  1  0.070823  0.599498  0.365028  1
  Ni  Ni41  1  0.404156  0.266165  0.365028  1
  Ni  Ni42  1  0.737490  0.932832  0.365028  1
  Ni  Ni43  1  0.129264  0.941364  0.354480  1
  Ni  Ni44  1  0.186486  0.284115  0.344561  1
  Ni  Ni45  1  0.519819  0.950782  0.344561  1
  Ni  Ni46  1  0.478122  0.426966  0.371803  1
  Ni  Ni47  1  0.811456  0.093633  0.371803  1
  Ni  Ni48  1  0.869974  0.435788  0.361189  1
  Ni  Ni49  1  0.261678  0.444355  0.350477  1
  Ni  Ni50  1  0.595011  0.111022  0.350477  1
  Ni  Ni51  1  0.928345  0.777689  0.350477  1
  Ni  Ni52  1  0.144789  0.760299  0.371803  1
  Ni  Ni53  1  0.203307  0.102455  0.361189  1
  Ni  Ni54  1  0.536640  0.769122  0.361189  1
  Ni  Ni55  1  0.288236  0.580918  0.385759  1
  Ni  Ni56  1  0.621569  0.247584  0.385759  1
  Ni  Ni57  1  0.679463  0.589612  0.375631  1
  Ni  Ni58  1  0.896739  0.572161  0.396399  1
  Ni  Ni59  1  0.230072  0.238827  0.396399  1
  Ni  Ni60  1  0.563406  0.905494  0.396399  1
  Ni  Ni61  1  0.954903  0.914251  0.385759  1
  Ni  Ni62  1  0.012797  0.256279  0.375631  1
  Ni  Ni63  1  0.346130  0.922946  0.375631  1
  Ni  Ni64  1  0.303295  0.399716  0.402990  1
  Ni  Ni65  1  0.636629  0.066383  0.402990  1
  Ni  Ni66  1  0.695160  0.408312  0.392572  1
  Ni  Ni67  1  0.086403  0.417966  0.382165  1
  Ni  Ni68  1  0.419736  0.084633  0.382165  1
  Ni  Ni69  1  0.753070  0.751299  0.382165  1
  Ni  Ni70  1  0.969962  0.733049  0.402990  1
  Ni  Ni71  1  0.028493  0.074979  0.392572  1
  Ni  Ni72  1  0.361827  0.741645  0.392572  1
  Ni  Ni73  1  0.113853  0.554251  0.417149  1
  Ni  Ni74  1  0.447186  0.220918  0.417149  1
  Ni  Ni75  1  0.505213  0.563075  0.406760  1
  Ni  Ni76  1  0.722399  0.544987  0.427623  1
  Ni  Ni77  1  0.055732  0.211653  0.427623  1
  Ni  Ni78  1  0.389066  0.878320  0.427623  1
  Ni  Ni79  1  0.780520  0.887584  0.417149  1
  Ni  Ni80  1  0.838546  0.229741  0.406760  1
  Ni  Ni81  1  0.171880  0.896408  0.406760  1
  Ni  Ni82  1  0.128981  0.372630  0.434378  1
  Ni  Ni83  1  0.462314  0.039297  0.434378  1
  Ni  Ni84  1  0.520594  0.381434  0.423918  1
  Ni  Ni85  1  0.911939  0.390604  0.413502  1
  Ni  Ni86  1  0.245272  0.057271  0.413502  1
  Ni  Ni87  1  0.578605  0.723938  0.413502  1
  Ni  Ni88  1  0.795647  0.705964  0.434378  1
  Ni  Ni89  1  0.853927  0.048101  0.423918  1
  Ni  Ni90  1  0.187260  0.714767  0.423918  1
  Ni  Ni91  1  0.939562  0.527073  0.448442  1
  Ni  Ni92  1  0.272896  0.193740  0.448442  1
  Ni  Ni93  1  0.331011  0.535991  0.437951  1
  Ni  Ni94  1  0.548069  0.517973  0.458859  1
  Ni  Ni95  1  0.881402  0.184640  0.458859  1
  Ni  Ni96  1  0.214735  0.851306  0.458859  1
  Ni  Ni97  1  0.606229  0.860406  0.448442  1
  Ni  Ni98  1  0.664344  0.202657  0.437951  1
  Ni  Ni99  1  0.997678  0.869324  0.437951  1
  Ni  Ni100  1  0.954684  0.345454  0.465675  1
  Ni  Ni101  1  0.288017  0.012121  0.465675  1
  Ni  Ni102  1  0.346118  0.354529  0.455221  1
  Ni  Ni103  1  0.737584  0.363473  0.444818  1
  Ni  Ni104  1  0.070918  0.030140  0.444818  1
  Ni  Ni105  1  0.404251  0.696807  0.444818  1
  Ni  Ni106  1  0.621351  0.678787  0.465675  1
  Ni  Ni107  1  0.679452  0.021196  0.455221  1
  Ni  Ni108  1  0.012785  0.687863  0.455221  1
  Ni  Ni109  1  0.765258  0.499972  0.479713  1
  Ni  Ni110  1  0.098591  0.166638  0.479713  1
  Ni  Ni111  1  0.156697  0.509054  0.469269  1
  Ni  Ni112  1  0.373819  0.490934  0.490126  1
  Ni  Ni113  1  0.707153  0.157600  0.490126  1
  Ni  Ni114  1  0.040486  0.824267  0.490126  1
  Ni  Ni115  1  0.431924  0.833305  0.479713  1
  Ni  Ni116  1  0.490030  0.175720  0.469269  1
  Ni  Ni117  1  0.823363  0.842387  0.469269  1
  Ni  Ni118  1  0.780404  0.318357  0.496966  1
  Ni  Ni119  1  0.113737  0.985024  0.496966  1
  Ni  Ni120  1  0.171852  0.327452  0.486533  1
  Ni  Ni121  1  0.563291  0.336368  0.476094  1
  Ni  Ni122  1  0.896624  0.003035  0.476094  1
  Ni  Ni123  1  0.229957  0.669701  0.476094  1
  Ni  Ni124  1  0.447071  0.651691  0.496966  1
  Ni  Ni125  1  0.505185  0.994119  0.486533  1
  Ni  Ni126  1  0.838518  0.660785  0.486533  1
  Ni  Ni127  1  0.590968  0.472858  0.510987  1
  Ni  Ni128  1  0.924301  0.139525  0.510987  1
  Ni  Ni129  1  0.982415  0.481953  0.500554  1
  Ni  Ni130  1  0.199528  0.463942  0.521426  1
  Ni  Ni131  1  0.532862  0.130609  0.521426  1
  Ni  Ni132  1  0.866195  0.797276  0.521426  1
  Ni  Ni133  1  0.257634  0.806192  0.510987  1
  Ni  Ni134  1  0.315749  0.148620  0.500554  1
  Ni  Ni135  1  0.649082  0.815286  0.500554  1
  Ni  Ni136  1  0.606123  0.291257  0.528251  1
  Ni  Ni137  1  0.939456  0.957923  0.528251  1
  Ni  Ni138  1  0.997561  0.300339  0.517807  1
  Ni  Ni139  1  0.389000  0.309377  0.507394  1
  Ni  Ni140  1  0.722333  0.976043  0.507394  1
  Ni  Ni141  1  0.055666  0.642710  0.507394  1
  Ni  Ni142  1  0.272789  0.624590  0.528251  1
  Ni  Ni143  1  0.330895  0.967005  0.517807  1
  Ni  Ni144  1  0.664228  0.633672  0.517807  1
  Ni  Ni145  1  0.416701  0.445781  0.542299  1
  Ni  Ni146  1  0.750034  0.112448  0.542299  1
  Ni  Ni147  1  0.808135  0.454856  0.531845  1
  Ni  Ni148  1  0.025235  0.436837  0.552702  1
  Ni  Ni149  1  0.358568  0.103503  0.552702  1
  Ni  Ni150  1  0.691902  0.770170  0.552702  1
  Ni  Ni151  1  0.083367  0.779114  0.542299  1
  Ni  Ni152  1  0.141468  0.121523  0.531845  1
  Ni  Ni153  1  0.474802  0.788190  0.531845  1
  Ni  Ni154  1  0.431808  0.264320  0.559569  1
  Ni  Ni155  1  0.765141  0.930986  0.559569  1
  Ni  Ni156  1  0.823257  0.273237  0.549078  1
  Ni  Ni157  1  0.214750  0.282337  0.538661  1
  Ni  Ni158  1  0.548084  0.949004  0.538661  1
  Ni  Ni159  1  0.881417  0.615671  0.538661  1
  Ni  Ni160  1  0.098475  0.597653  0.559569  1
  Ni  Ni161  1  0.156590  0.939904  0.549078  1
  Ni  Ni162  1  0.489924  0.606571  0.549078  1
  Ni  Ni163  1  0.242225  0.418876  0.573602  1
  Ni  Ni164  1  0.575559  0.085543  0.573602  1
  Ni  Ni165  1  0.633838  0.427680  0.563142  1
  Ni  Ni166  1  0.850880  0.409706  0.584018  1
  Ni  Ni167  1  0.184214  0.076373  0.584018  1
  Ni  Ni168  1  0.517547  0.743039  0.584018  1
  Ni  Ni169  1  0.908892  0.752210  0.573602  1
  Ni  Ni170  1  0.967172  0.094347  0.563142  1
  Ni  Ni171  1  0.300505  0.761013  0.563142  1
  Ni  Ni172  1  0.257606  0.237236  0.590760  1
  Ni  Ni173  1  0.590939  0.903902  0.590760  1
  Ni  Ni174  1  0.648966  0.246059  0.580371  1
  Ni  Ni175  1  0.040420  0.255324  0.569897  1
  Ni  Ni176  1  0.373754  0.921990  0.569897  1
  Ni  Ni177  1  0.707087  0.588657  0.569897  1
  Ni  Ni178  1  0.924273  0.570569  0.590760  1
  Ni  Ni179  1  0.982299  0.912726  0.580371  1
  Ni  Ni180  1  0.315633  0.579393  0.580371  1
  Ni  Ni181  1  0.067659  0.391998  0.604948  1
  Ni  Ni182  1  0.400993  0.058665  0.604948  1
  Ni  Ni183  1  0.459524  0.400594  0.594530  1
  Ni  Ni184  1  0.676416  0.382344  0.615355  1
  Ni  Ni185  1  0.009750  0.049011  0.615355  1
  Ni  Ni186  1  0.343083  0.715678  0.615355  1
  Ni  Ni187  1  0.734326  0.725331  0.604948  1
  Ni  Ni188  1  0.792857  0.067261  0.594530  1
  Ni  Ni189  1  0.126190  0.733928  0.594530  1
  Ni  Ni190  1  0.083356  0.210698  0.621889  1
  Ni  Ni191  1  0.416689  0.877365  0.621889  1
  Ni  Ni192  1  0.474583  0.219393  0.611761  1
  Ni  Ni193  1  0.866080  0.228150  0.601121  1
  Ni  Ni194  1  0.199414  0.894816  0.601121  1
  Ni  Ni195  1  0.532747  0.561483  0.601121  1
  Ni  Ni196  1  0.750022  0.544031  0.621889  1
  Ni  Ni197  1  0.807917  0.886059  0.611761  1
  Ni  Ni198  1  0.141250  0.552726  0.611761  1
  Ni  Ni199  1  0.892846  0.364522  0.636331  1
  Ni  Ni200  1  0.226179  0.031189  0.636331  1
  Ni  Ni201  1  0.284697  0.373344  0.625717  1
  Ni  Ni202  1  0.501141  0.355955  0.647043  1
  Ni  Ni203  1  0.834474  0.022622  0.647043  1
  Ni  Ni204  1  0.167808  0.689288  0.647043  1
  Ni  Ni205  1  0.559512  0.697855  0.636331  1
  Ni  Ni206  1  0.618030  0.040011  0.625717  1
  Ni  Ni207  1  0.951363  0.706678  0.625717  1
  Ni  Ni208  1  0.909667  0.182862  0.652959  1
  Ni  Ni209  1  0.243000  0.849528  0.652959  1
  Ni  Ni210  1  0.300222  0.192280  0.643040  1
  Ni  Ni211  1  0.691996  0.200812  0.632492  1
  Ni  Ni212  1  0.025329  0.867478  0.632492  1
  Ni  Ni213  1  0.358663  0.534145  0.632492  1
  Ni  Ni214  1  0.576333  0.516195  0.652959  1
  Ni  Ni215  1  0.633555  0.858947  0.643040  1
  Ni  Ni216  1  0.966888  0.525613  0.643040  1
  Ni  Ni217  1  0.716257  0.336235  0.667546  1
  Ni  Ni218  1  0.049591  0.002901  0.667546  1
  Ni  Ni219  1  0.108709  0.347764  0.657416  1
  Ni  Ni220  1  0.327134  0.326263  0.677646  1
  Ni  Ni221  1  0.660467  0.992929  0.677646  1
  Ni  Ni222  1  0.993801  0.659596  0.677646  1
  Ni  Ni223  1  0.382924  0.669568  0.667546  1
  Ni  Ni224  1  0.442043  0.014430  0.657416  1
  Ni  Ni225  1  0.775376  0.681097  0.657416  1
  Ni  Ni226  1  0.736431  0.157246  0.684588  1
  Ni  Ni227  1  0.069765  0.823912  0.684588  1
  Ni  Ni228  1  0.125972  0.166669  0.673597  1
  Ni  Ni229  1  0.519707  0.172981  0.663591  1
  Ni  Ni230  1  0.853040  0.839648  0.663591  1
  Ni  Ni231  1  0.186374  0.506314  0.663591  1
  Ni  Ni232  1  0.403098  0.490579  0.684588  1
  Ni  Ni233  1  0.459305  0.833336  0.673597  1
  Ni  Ni234  1  0.792638  0.500003  0.673597  1
  Ni  Ni235  1  0.539444  0.310072  0.699240  1
  Ni  Ni236  1  0.872777  0.976738  0.699240  1
  Ni  Ni237  1  0.929794  0.321126  0.688527  1
  Ni  Ni238  1  0.151340  0.298007  0.708342  1
  Ni  Ni239  1  0.484673  0.964674  0.708342  1
  Ni  Ni240  1  0.818006  0.631341  0.708342  1
  Ni  Ni241  1  0.206111  0.643405  0.699240  1
  Ni  Ni242  1  0.263127  0.987793  0.688527  1
  Ni  Ni243  1  0.596460  0.654460  0.688527  1
  Ni  Ni244  1  0.563679  0.121895  0.714216  1
  Ni  Ni245  1  0.897012  0.788561  0.714216  1
  Ni  Ni246  1  0.956149  0.136670  0.704221  1
  Ni  Ni247  1  0.344910  0.146605  0.695081  1
  Ni  Ni248  1  0.678243  0.813272  0.695081  1
  Ni  Ni249  1  0.011576  0.479938  0.695081  1
  Ni  Ni250  1  0.230346  0.455228  0.714216  1
  Ni  Ni251  1  0.289482  0.803336  0.704221  1
  Ni  Ni252  1  0.622816  0.470003  0.704221  1
