# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.77445525
_cell_length_b   13.15164471
_cell_length_c   46.28188839
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.42283247
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni252
_cell_volume   6252.03073241
_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  0.808840  0.659722  0.290830  1
  Ni  Ni2  1  0.142174  0.326389  0.290830  1
  Ni  Ni3  1  0.199303  0.670988  0.280993  1
  Ni  Ni4  1  0.420303  0.649420  0.301075  1
  Ni  Ni5  1  0.753636  0.316087  0.301075  1
  Ni  Ni6  1  0.086969  0.982754  0.301075  1
  Ni  Ni7  1  0.475507  0.993056  0.290830  1
  Ni  Ni8  1  0.532637  0.337654  0.280993  1
  Ni  Ni9  1  0.865970  0.004321  0.280993  1
  Ni  Ni10  1  0.831373  0.474945  0.307137  1
  Ni  Ni11  1  0.164706  0.141612  0.307137  1
  Ni  Ni12  1  0.219705  0.485936  0.297135  1
  Ni  Ni13  1  0.608485  0.498018  0.287449  1
  Ni  Ni14  1  0.941818  0.164685  0.287449  1
  Ni  Ni15  1  0.275151  0.831352  0.287449  1
  Ni  Ni16  1  0.498040  0.808278  0.307137  1
  Ni  Ni17  1  0.553038  0.152603  0.297135  1
  Ni  Ni18  1  0.886371  0.819269  0.297135  1
  Ni  Ni19  1  0.638746  0.630767  0.322656  1
  Ni  Ni20  1  0.972079  0.297433  0.322656  1
  Ni  Ni21  1  0.028254  0.638647  0.311702  1
  Ni  Ni22  1  0.247033  0.622257  0.333099  1
  Ni  Ni23  1  0.580366  0.288924  0.333099  1
  Ni  Ni24  1  0.913699  0.955591  0.333099  1
  Ni  Ni25  1  0.305413  0.964100  0.322656  1
  Ni  Ni26  1  0.361587  0.305314  0.311702  1
  Ni  Ni27  1  0.694921  0.971980  0.311702  1
  Ni  Ni28  1  0.653510  0.449234  0.339798  1
  Ni  Ni29  1  0.986843  0.115900  0.339798  1
  Ni  Ni30  1  0.044882  0.458247  0.329265  1
  Ni  Ni31  1  0.434410  0.468156  0.319171  1
  Ni  Ni32  1  0.767743  0.134823  0.319171  1
  Ni  Ni33  1  0.101076  0.801490  0.319171  1
  Ni  Ni34  1  0.320177  0.782567  0.339798  1
  Ni  Ni35  1  0.378216  0.124914  0.329265  1
  Ni  Ni36  1  0.711549  0.791580  0.329265  1
  Ni  Ni37  1  0.464132  0.603926  0.353708  1
  Ni  Ni38  1  0.797465  0.270593  0.353708  1
  Ni  Ni39  1  0.855882  0.612046  0.343413  1
  Ni  Ni40  1  0.072777  0.594814  0.364035  1
  Ni  Ni41  1  0.406111  0.261481  0.364035  1
  Ni  Ni42  1  0.739444  0.928148  0.364035  1
  Ni  Ni43  1  0.130798  0.937260  0.353708  1
  Ni  Ni44  1  0.189216  0.278713  0.343413  1
  Ni  Ni45  1  0.522549  0.945379  0.343413  1
  Ni  Ni46  1  0.478891  0.422027  0.370940  1
  Ni  Ni47  1  0.812225  0.088693  0.370940  1
  Ni  Ni48  1  0.869891  0.431160  0.360486  1
  Ni  Ni49  1  0.261344  0.440027  0.350198  1
  Ni  Ni50  1  0.594678  0.106694  0.350198  1
  Ni  Ni51  1  0.928011  0.773360  0.350198  1
  Ni  Ni52  1  0.145558  0.755360  0.370940  1
  Ni  Ni53  1  0.203224  0.097827  0.360486  1
  Ni  Ni54  1  0.536558  0.764494  0.360486  1
  Ni  Ni55  1  0.289953  0.576206  0.384913  1
  Ni  Ni56  1  0.623287  0.242873  0.384913  1
  Ni  Ni57  1  0.681220  0.585480  0.374478  1
  Ni  Ni58  1  0.898597  0.567002  0.395295  1
  Ni  Ni59  1  0.231930  0.233668  0.395295  1
  Ni  Ni60  1  0.565263  0.900335  0.395295  1
  Ni  Ni61  1  0.956620  0.909539  0.384913  1
  Ni  Ni62  1  0.014554  0.252146  0.374478  1
  Ni  Ni63  1  0.347887  0.918813  0.374478  1
  Ni  Ni64  1  0.304888  0.394238  0.402171  1
  Ni  Ni65  1  0.638221  0.060904  0.402171  1
  Ni  Ni66  1  0.696242  0.403473  0.391785  1
  Ni  Ni67  1  0.087384  0.412713  0.381268  1
  Ni  Ni68  1  0.420717  0.079380  0.381268  1
  Ni  Ni69  1  0.754051  0.746047  0.381268  1
  Ni  Ni70  1  0.971554  0.727571  0.402171  1
  Ni  Ni71  1  0.029575  0.070139  0.391785  1
  Ni  Ni72  1  0.362908  0.736806  0.391785  1
  Ni  Ni73  1  0.115846  0.548583  0.416084  1
  Ni  Ni74  1  0.449180  0.215250  0.416084  1
  Ni  Ni75  1  0.507235  0.557819  0.405712  1
  Ni  Ni76  1  0.724526  0.539435  0.426516  1
  Ni  Ni77  1  0.057859  0.206102  0.426516  1
  Ni  Ni78  1  0.391192  0.872769  0.426516  1
  Ni  Ni79  1  0.782513  0.881916  0.416084  1
  Ni  Ni80  1  0.840568  0.224486  0.405712  1
  Ni  Ni81  1  0.173901  0.891153  0.405712  1
  Ni  Ni82  1  0.130894  0.366698  0.433381  1
  Ni  Ni83  1  0.464228  0.033365  0.433381  1
  Ni  Ni84  1  0.522224  0.375876  0.422995  1
  Ni  Ni85  1  0.913607  0.385084  0.412564  1
  Ni  Ni86  1  0.246940  0.051750  0.412564  1
  Ni  Ni87  1  0.580273  0.718417  0.412564  1
  Ni  Ni88  1  0.797561  0.700031  0.433381  1
  Ni  Ni89  1  0.855558  0.042542  0.422995  1
  Ni  Ni90  1  0.188891  0.709209  0.422995  1
  Ni  Ni91  1  0.941818  0.521052  0.447335  1
  Ni  Ni92  1  0.275151  0.187719  0.447335  1
  Ni  Ni93  1  0.333152  0.530234  0.436933  1
  Ni  Ni94  1  0.550491  0.511851  0.457754  1
  Ni  Ni95  1  0.883825  0.178518  0.457754  1
  Ni  Ni96  1  0.217158  0.845185  0.457754  1
  Ni  Ni97  1  0.608484  0.854385  0.447335  1
  Ni  Ni98  1  0.666486  0.196901  0.436933  1
  Ni  Ni99  1  0.999819  0.863568  0.436933  1
  Ni  Ni100  1  0.956920  0.339112  0.464631  1
  Ni  Ni101  1  0.290253  0.005779  0.464631  1
  Ni  Ni102  1  0.348244  0.348284  0.454222  1
  Ni  Ni103  1  0.739593  0.357494  0.443819  1
  Ni  Ni104  1  0.072926  0.024160  0.443819  1
  Ni  Ni105  1  0.406259  0.690827  0.443819  1
  Ni  Ni106  1  0.623587  0.672446  0.464631  1
  Ni  Ni107  1  0.681577  0.014950  0.454222  1
  Ni  Ni108  1  0.014911  0.681617  0.454222  1
  Ni  Ni109  1  0.767808  0.493474  0.478573  1
  Ni  Ni110  1  0.101141  0.160140  0.478573  1
  Ni  Ni111  1  0.159135  0.502658  0.468153  1
  Ni  Ni112  1  0.376465  0.484282  0.488983  1
  Ni  Ni113  1  0.709798  0.150948  0.488983  1
  Ni  Ni114  1  0.043132  0.817615  0.488983  1
  Ni  Ni115  1  0.434474  0.826807  0.478573  1
  Ni  Ni116  1  0.492469  0.169325  0.468153  1
  Ni  Ni117  1  0.825802  0.835991  0.468153  1
  Ni  Ni118  1  0.782909  0.311532  0.495874  1
  Ni  Ni119  1  0.116242  0.978199  0.495874  1
  Ni  Ni120  1  0.174235  0.320731  0.485453  1
  Ni  Ni121  1  0.565575  0.329914  0.475052  1
  Ni  Ni122  1  0.898908  0.996581  0.475052  1
  Ni  Ni123  1  0.232242  0.663248  0.475052  1
  Ni  Ni124  1  0.449575  0.644865  0.495874  1
  Ni  Ni125  1  0.507568  0.987397  0.485453  1
  Ni  Ni126  1  0.840901  0.654064  0.485453  1
  Ni  Ni127  1  0.593799  0.465894  0.509811  1
  Ni  Ni128  1  0.927133  0.132561  0.509811  1
  Ni  Ni129  1  0.985125  0.475093  0.499391  1
  Ni  Ni130  1  0.202459  0.456710  0.520212  1
  Ni  Ni131  1  0.535792  0.123377  0.520212  1
  Ni  Ni132  1  0.869126  0.790044  0.520212  1
  Ni  Ni133  1  0.260466  0.799228  0.509811  1
  Ni  Ni134  1  0.318459  0.141760  0.499391  1
  Ni  Ni135  1  0.651792  0.808426  0.499391  1
  Ni  Ni136  1  0.608899  0.283967  0.527112  1
  Ni  Ni137  1  0.942232  0.950633  0.527112  1
  Ni  Ni138  1  1.000226  0.293151  0.516692  1
  Ni  Ni139  1  0.391569  0.302343  0.506281  1
  Ni  Ni140  1  0.724902  0.969010  0.506281  1
  Ni  Ni141  1  0.058235  0.635676  0.506281  1
  Ni  Ni142  1  0.275565  0.617300  0.527112  1
  Ni  Ni143  1  0.333560  0.959818  0.516692  1
  Ni  Ni144  1  0.666893  0.626485  0.516692  1
  Ni  Ni145  1  0.419790  0.438341  0.541042  1
  Ni  Ni146  1  0.753123  0.105008  0.541042  1
  Ni  Ni147  1  0.811114  0.447513  0.530633  1
  Ni  Ni148  1  0.028441  0.429131  0.551445  1
  Ni  Ni149  1  0.361775  0.095798  0.551445  1
  Ni  Ni150  1  0.695108  0.762465  0.551445  1
  Ni  Ni151  1  0.086457  0.771674  0.541042  1
  Ni  Ni152  1  0.144447  0.114179  0.530633  1
  Ni  Ni153  1  0.477781  0.780846  0.530633  1
  Ni  Ni154  1  0.434882  0.256391  0.558332  1
  Ni  Ni155  1  0.768215  0.923057  0.558332  1
  Ni  Ni156  1  0.826216  0.265573  0.547930  1
  Ni  Ni157  1  0.217543  0.274773  0.537511  1
  Ni  Ni158  1  0.550876  0.941440  0.537511  1
  Ni  Ni159  1  0.884209  0.608107  0.537511  1
  Ni  Ni160  1  0.101548  0.589724  0.558332  1
  Ni  Ni161  1  0.159549  0.932240  0.547930  1
  Ni  Ni162  1  0.492883  0.598906  0.547930  1
  Ni  Ni163  1  0.245810  0.410749  0.572270  1
  Ni  Ni164  1  0.579143  0.077416  0.572270  1
  Ni  Ni165  1  0.637140  0.419927  0.561884  1
  Ni  Ni166  1  0.854427  0.401541  0.582701  1
  Ni  Ni167  1  0.187761  0.068208  0.582701  1
  Ni  Ni168  1  0.521094  0.734875  0.582701  1
  Ni  Ni169  1  0.912476  0.744082  0.572270  1
  Ni  Ni170  1  0.970473  0.086594  0.561884  1
  Ni  Ni171  1  0.303806  0.753260  0.561884  1
  Ni  Ni172  1  0.260799  0.228806  0.589552  1
  Ni  Ni173  1  0.594133  0.895472  0.589552  1
  Ni  Ni174  1  0.652187  0.238042  0.579180  1
  Ni  Ni175  1  0.043508  0.247189  0.568749  1
  Ni  Ni176  1  0.376842  0.913856  0.568749  1
  Ni  Ni177  1  0.710175  0.580523  0.568749  1
  Ni  Ni178  1  0.927466  0.562139  0.589552  1
  Ni  Ni179  1  0.985521  0.904709  0.579180  1
  Ni  Ni180  1  0.318854  0.571375  0.579180  1
  Ni  Ni181  1  0.071792  0.383152  0.603480  1
  Ni  Ni182  1  0.405126  0.049819  0.603480  1
  Ni  Ni183  1  0.463146  0.392387  0.593094  1
  Ni  Ni184  1  0.680650  0.373912  0.613997  1
  Ni  Ni185  1  0.013983  0.040578  0.613997  1
  Ni  Ni186  1  0.347317  0.707245  0.613997  1
  Ni  Ni187  1  0.738459  0.716486  0.603480  1
  Ni  Ni188  1  0.796480  0.059054  0.593094  1
  Ni  Ni189  1  0.129813  0.725720  0.593094  1
  Ni  Ni190  1  0.086814  0.201145  0.620787  1
  Ni  Ni191  1  0.420147  0.867812  0.620787  1
  Ni  Ni192  1  0.478081  0.210419  0.610352  1
  Ni  Ni193  1  0.869437  0.219623  0.599969  1
  Ni  Ni194  1  0.202771  0.886290  0.599969  1
  Ni  Ni195  1  0.536104  0.552957  0.599969  1
  Ni  Ni196  1  0.753480  0.534478  0.620787  1
  Ni  Ni197  1  0.811414  0.877085  0.610352  1
  Ni  Ni198  1  0.144747  0.543752  0.610352  1
  Ni  Ni199  1  0.898143  0.355465  0.634778  1
  Ni  Ni200  1  0.231476  0.022131  0.634778  1
  Ni  Ni201  1  0.289142  0.364598  0.624324  1
  Ni  Ni202  1  0.506690  0.346598  0.645066  1
  Ni  Ni203  1  0.840023  0.013265  0.645066  1
  Ni  Ni204  1  0.173356  0.679931  0.645066  1
  Ni  Ni205  1  0.564810  0.688798  0.634778  1
  Ni  Ni206  1  0.622476  0.031265  0.624324  1
  Ni  Ni207  1  0.955809  0.697932  0.624324  1
  Ni  Ni208  1  0.912152  0.174579  0.651851  1
  Ni  Ni209  1  0.245485  0.841245  0.651851  1
  Ni  Ni210  1  0.303902  0.182699  0.641556  1
  Ni  Ni211  1  0.695257  0.191811  0.631229  1
  Ni  Ni212  1  0.028590  0.858477  0.631229  1
  Ni  Ni213  1  0.361923  0.525144  0.631229  1
  Ni  Ni214  1  0.578818  0.507912  0.651851  1
  Ni  Ni215  1  0.637236  0.849365  0.641556  1
  Ni  Ni216  1  0.970569  0.516032  0.641556  1
  Ni  Ni217  1  0.723151  0.328378  0.666000  1
  Ni  Ni218  1  0.056485  0.995045  0.666000  1
  Ni  Ni219  1  0.114524  0.337391  0.655467  1
  Ni  Ni220  1  0.333624  0.318469  0.676093  1
  Ni  Ni221  1  0.666958  0.985135  0.676093  1
  Ni  Ni222  1  1.000291  0.651802  0.676093  1
  Ni  Ni223  1  0.389818  0.661711  0.666000  1
  Ni  Ni224  1  0.447857  0.004058  0.655467  1
  Ni  Ni225  1  0.781191  0.670725  0.655467  1
  Ni  Ni226  1  0.739780  0.147978  0.683563  1
  Ni  Ni227  1  0.073113  0.814644  0.683563  1
  Ni  Ni228  1  0.129288  0.155858  0.672608  1
  Ni  Ni229  1  0.521001  0.164367  0.662166  1
  Ni  Ni230  1  0.854335  0.831034  0.662166  1
  Ni  Ni231  1  0.187668  0.497701  0.662166  1
  Ni  Ni232  1  0.406446  0.481311  0.683563  1
  Ni  Ni233  1  0.462621  0.822525  0.672608  1
  Ni  Ni234  1  0.795954  0.489192  0.672608  1
  Ni  Ni235  1  0.548329  0.300689  0.698130  1
  Ni  Ni236  1  0.881663  0.967356  0.698130  1
  Ni  Ni237  1  0.936661  0.311680  0.688127  1
  Ni  Ni238  1  0.159549  0.288607  0.707815  1
  Ni  Ni239  1  0.492883  0.955273  0.707815  1
  Ni  Ni240  1  0.826216  0.621940  0.707815  1
  Ni  Ni241  1  0.214996  0.634022  0.698130  1
  Ni  Ni242  1  0.269994  0.978346  0.688127  1
  Ni  Ni243  1  0.603328  0.645013  0.688127  1
  Ni  Ni244  1  0.568730  0.115637  0.714271  1
  Ni  Ni245  1  0.902064  0.782304  0.714271  1
  Ni  Ni246  1  0.959194  0.126902  0.704435  1
  Ni  Ni247  1  0.347731  0.137205  0.694190  1
  Ni  Ni248  1  0.681065  0.803871  0.694190  1
  Ni  Ni249  1  0.014398  0.470538  0.694190  1
  Ni  Ni250  1  0.235397  0.448971  0.714271  1
  Ni  Ni251  1  0.292527  0.793569  0.704435  1
  Ni  Ni252  1  0.625860  0.460236  0.704435  1
