# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.54494228
_cell_length_b   12.57561265
_cell_length_c   48.01863467
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.13527617
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3949.50911683
_cell_formula_units_Z   162
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  0.555851  0.180578  0.316712  1
  Ni  Ni2  1  0.537485  0.856885  0.299390  1
  Ni  Ni3  1  0.508683  0.538749  0.283839  1
  Ni  Ni4  1  0.889185  0.847245  0.316712  1
  Ni  Ni5  1  0.870818  0.523552  0.299390  1
  Ni  Ni6  1  0.222518  0.513911  0.316712  1
  Ni  Ni7  1  0.842016  0.205416  0.283839  1
  Ni  Ni8  1  0.204152  0.190219  0.299390  1
  Ni  Ni9  1  0.175349  0.872082  0.283839  1
  Ni  Ni10  1  0.629438  0.359846  0.297110  1
  Ni  Ni11  1  0.603691  0.042469  0.281859  1
  Ni  Ni12  1  0.654836  0.679129  0.314392  1
  Ni  Ni13  1  0.962771  0.026513  0.297110  1
  Ni  Ni14  1  0.937024  0.709136  0.281859  1
  Ni  Ni15  1  0.296104  0.693179  0.297110  1
  Ni  Ni16  1  0.988169  0.345796  0.314392  1
  Ni  Ni17  1  0.270357  0.375802  0.281859  1
  Ni  Ni18  1  0.321502  0.012462  0.314392  1
  Ni  Ni19  1  0.621420  0.141644  0.366606  1
  Ni  Ni20  1  0.598778  0.820801  0.349709  1
  Ni  Ni21  1  0.577895  0.498527  0.332863  1
  Ni  Ni22  1  0.954754  0.808311  0.366606  1
  Ni  Ni23  1  0.932111  0.487468  0.349709  1
  Ni  Ni24  1  0.288087  0.474978  0.366606  1
  Ni  Ni25  1  0.911229  0.165193  0.332863  1
  Ni  Ni26  1  0.265445  0.154135  0.349709  1
  Ni  Ni27  1  0.244562  0.831860  0.332863  1
  Ni  Ni28  1  0.703395  0.322204  0.347223  1
  Ni  Ni29  1  0.678945  0.002559  0.330865  1
  Ni  Ni30  1  0.725895  0.643132  0.364110  1
  Ni  Ni31  1  0.036728  0.988870  0.347223  1
  Ni  Ni32  1  0.012279  0.669226  0.330865  1
  Ni  Ni33  1  0.370062  0.655537  0.347223  1
  Ni  Ni34  1  0.059228  0.309799  0.364110  1
  Ni  Ni35  1  0.345612  0.335892  0.330865  1
  Ni  Ni36  1  0.392562  0.976466  0.364110  1
  Ni  Ni37  1  0.689405  0.103973  0.416641  1
  Ni  Ni38  1  0.666477  0.783224  0.399928  1
  Ni  Ni39  1  0.643900  0.462110  0.383178  1
  Ni  Ni40  1  0.022739  0.770640  0.416641  1
  Ni  Ni41  1  0.999810  0.449890  0.399928  1
  Ni  Ni42  1  0.356072  0.437306  0.416641  1
  Ni  Ni43  1  0.977234  0.128776  0.383178  1
  Ni  Ni44  1  0.333144  0.116557  0.399928  1
  Ni  Ni45  1  0.310567  0.795443  0.383178  1
  Ni  Ni46  1  0.772281  0.285101  0.397390  1
  Ni  Ni47  1  0.749520  0.964193  0.380673  1
  Ni  Ni48  1  0.795213  0.605943  0.414036  1
  Ni  Ni49  1  0.105614  0.951768  0.397390  1
  Ni  Ni50  1  0.082853  0.630859  0.380673  1
  Ni  Ni51  1  0.438948  0.618434  0.397390  1
  Ni  Ni52  1  0.128547  0.272609  0.414036  1
  Ni  Ni53  1  0.416186  0.297526  0.380673  1
  Ni  Ni54  1  0.461880  0.939276  0.414036  1
  Ni  Ni55  1  0.757930  0.066584  0.466691  1
  Ni  Ni56  1  0.735017  0.745733  0.450002  1
  Ni  Ni57  1  0.712159  0.424902  0.433315  1
  Ni  Ni58  1  0.091263  0.733250  0.466691  1
  Ni  Ni59  1  0.068350  0.412400  0.450002  1
  Ni  Ni60  1  0.424597  0.399917  0.466691  1
  Ni  Ni61  1  0.045493  0.091569  0.433315  1
  Ni  Ni62  1  0.401684  0.079067  0.450002  1
  Ni  Ni63  1  0.378826  0.758236  0.433315  1
  Ni  Ni64  1  0.840986  0.247710  0.447389  1
  Ni  Ni65  1  0.818128  0.926801  0.430698  1
  Ni  Ni66  1  0.863899  0.568568  0.464053  1
  Ni  Ni67  1  0.174320  0.914377  0.447389  1
  Ni  Ni68  1  0.151461  0.593467  0.430698  1
  Ni  Ni69  1  0.507653  0.581043  0.447389  1
  Ni  Ni70  1  0.197233  0.235234  0.464053  1
  Ni  Ni71  1  0.484795  0.260134  0.430698  1
  Ni  Ni72  1  0.530566  0.901901  0.464053  1
  Ni  Ni73  1  0.826602  0.029191  0.516732  1
  Ni  Ni74  1  0.803698  0.708316  0.500050  1
  Ni  Ni75  1  0.780806  0.387466  0.483372  1
  Ni  Ni76  1  0.159935  0.695858  0.516732  1
  Ni  Ni77  1  0.137031  0.374983  0.500050  1
  Ni  Ni78  1  0.493268  0.362525  0.516732  1
  Ni  Ni79  1  0.114139  0.054132  0.483372  1
  Ni  Ni80  1  0.470364  0.041650  0.500050  1
  Ni  Ni81  1  0.447472  0.720799  0.483372  1
  Ni  Ni82  1  0.909679  0.210297  0.497414  1
  Ni  Ni83  1  0.886775  0.889422  0.480732  1
  Ni  Ni84  1  0.932571  0.531147  0.514091  1
  Ni  Ni85  1  0.243012  0.876964  0.497414  1
  Ni  Ni86  1  0.220108  0.556089  0.480732  1
  Ni  Ni87  1  0.576346  0.543630  0.497414  1
  Ni  Ni88  1  0.265904  0.197814  0.514091  1
  Ni  Ni89  1  0.553442  0.222755  0.480732  1
  Ni  Ni90  1  0.599238  0.864481  0.514091  1
  Ni  Ni91  1  0.895249  0.991812  0.566766  1
  Ni  Ni92  1  0.872390  0.670903  0.550075  1
  Ni  Ni93  1  0.849477  0.350046  0.533410  1
  Ni  Ni94  1  0.228582  0.658479  0.566766  1
  Ni  Ni95  1  0.205723  0.337570  0.550075  1
  Ni  Ni96  1  0.561915  0.325146  0.566766  1
  Ni  Ni97  1  0.182811  0.016712  0.533410  1
  Ni  Ni98  1  0.539057  0.004237  0.550075  1
  Ni  Ni99  1  0.516144  0.683379  0.533410  1
  Ni  Ni100  1  0.978360  0.172880  0.547461  1
  Ni  Ni101  1  0.955447  0.852030  0.530772  1
  Ni  Ni102  1  1.001217  0.493711  0.564148  1
  Ni  Ni103  1  0.311693  0.839547  0.547461  1
  Ni  Ni104  1  0.288780  0.518696  0.530772  1
  Ni  Ni105  1  0.645026  0.506213  0.547461  1
  Ni  Ni106  1  0.334550  0.160378  0.564148  1
  Ni  Ni107  1  0.622113  0.185363  0.530772  1
  Ni  Ni108  1  0.667884  0.827044  0.564148  1
  Ni  Ni109  1  0.963857  0.954421  0.616790  1
  Ni  Ni110  1  0.941096  0.633512  0.600074  1
  Ni  Ni111  1  0.918163  0.312671  0.583427  1
  Ni  Ni112  1  0.297190  0.621087  0.616790  1
  Ni  Ni113  1  0.274429  0.300179  0.600074  1
  Ni  Ni114  1  0.630523  0.287754  0.616790  1
  Ni  Ni115  1  0.251496  0.979337  0.583427  1
  Ni  Ni116  1  0.607762  0.966846  0.600074  1
  Ni  Ni117  1  0.584830  0.646004  0.583427  1
  Ni  Ni118  1  0.046900  0.135390  0.597535  1
  Ni  Ni119  1  0.023971  0.814640  0.580823  1
  Ni  Ni120  1  0.069476  0.456504  0.614285  1
  Ni  Ni121  1  0.380233  0.802056  0.597535  1
  Ni  Ni122  1  0.357305  0.481307  0.580823  1
  Ni  Ni123  1  0.713566  0.468723  0.597535  1
  Ni  Ni124  1  0.402810  0.123170  0.614285  1
  Ni  Ni125  1  0.690638  0.147974  0.580823  1
  Ni  Ni126  1  0.736143  0.789837  0.614285  1
  Ni  Ni127  1  0.034431  0.916054  0.666598  1
  Ni  Ni128  1  0.009981  0.596410  0.650240  1
  Ni  Ni129  1  0.987482  0.275481  0.633354  1
  Ni  Ni130  1  0.367765  0.582721  0.666598  1
  Ni  Ni131  1  0.343315  0.263076  0.650240  1
  Ni  Ni132  1  0.701098  0.249388  0.666598  1
  Ni  Ni133  1  0.320815  0.942148  0.633354  1
  Ni  Ni134  1  0.676648  0.929743  0.650240  1
  Ni  Ni135  1  0.654148  0.608814  0.633354  1
  Ni  Ni136  1  0.114599  0.097812  0.647755  1
  Ni  Ni137  1  0.091956  0.776969  0.630857  1
  Ni  Ni138  1  0.135481  0.420087  0.664600  1
  Ni  Ni139  1  0.447932  0.764479  0.647755  1
  Ni  Ni140  1  0.425290  0.443636  0.630857  1
  Ni  Ni141  1  0.781265  0.431145  0.647755  1
  Ni  Ni142  1  0.468815  0.086753  0.664600  1
  Ni  Ni143  1  0.758623  0.110302  0.630857  1
  Ni  Ni144  1  0.802148  0.753420  0.664600  1
  Ni  Ni145  1  0.109686  0.876144  0.715605  1
  Ni  Ni146  1  0.083939  0.558767  0.700353  1
  Ni  Ni147  1  0.058541  0.239484  0.683071  1
  Ni  Ni148  1  0.443019  0.542811  0.715605  1
  Ni  Ni149  1  0.417272  0.225434  0.700353  1
  Ni  Ni150  1  0.776352  0.209478  0.715605  1
  Ni  Ni151  1  0.391874  0.906151  0.683071  1
  Ni  Ni152  1  0.750606  0.892101  0.700353  1
  Ni  Ni153  1  0.725208  0.572817  0.683071  1
  Ni  Ni154  1  0.175891  0.061728  0.698073  1
  Ni  Ni155  1  0.157525  0.738035  0.680751  1
  Ni  Ni156  1  0.204694  0.379864  0.713624  1
  Ni  Ni157  1  0.509225  0.728394  0.698073  1
  Ni  Ni158  1  0.490859  0.404702  0.680751  1
  Ni  Ni159  1  0.842558  0.395061  0.698073  1
  Ni  Ni160  1  0.538027  0.046531  0.713624  1
  Ni  Ni161  1  0.824192  0.071369  0.680751  1
  Ni  Ni162  1  0.871361  0.713198  0.713624  1
