# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53539540
_cell_length_b   12.50733726
_cell_length_c   48.01721810
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.14040351
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3922.20792948
_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  0.551362  0.180034  0.316572  1
  Ni  Ni2  1  0.533095  0.857303  0.299134  1
  Ni  Ni3  1  0.505349  0.537355  0.284562  1
  Ni  Ni4  1  0.884696  0.846701  0.316572  1
  Ni  Ni5  1  0.866428  0.523970  0.299134  1
  Ni  Ni6  1  0.218029  0.513368  0.316572  1
  Ni  Ni7  1  0.838682  0.204022  0.284562  1
  Ni  Ni8  1  0.199761  0.190637  0.299134  1
  Ni  Ni9  1  0.172016  0.870688  0.284562  1
  Ni  Ni10  1  0.634486  0.359477  0.296815  1
  Ni  Ni11  1  0.611072  0.041707  0.282359  1
  Ni  Ni12  1  0.657275  0.680038  0.313835  1
  Ni  Ni13  1  0.967819  0.026144  0.296815  1
  Ni  Ni14  1  0.944405  0.708373  0.282359  1
  Ni  Ni15  1  0.301152  0.692810  0.296815  1
  Ni  Ni16  1  0.990608  0.346705  0.313835  1
  Ni  Ni17  1  0.277739  0.375040  0.282359  1
  Ni  Ni18  1  0.323941  0.013371  0.313835  1
  Ni  Ni19  1  0.620824  0.141207  0.366355  1
  Ni  Ni20  1  0.597491  0.820303  0.349563  1
  Ni  Ni21  1  0.576303  0.498520  0.333034  1
  Ni  Ni22  1  0.954158  0.807874  0.366355  1
  Ni  Ni23  1  0.930824  0.486970  0.349563  1
  Ni  Ni24  1  0.287491  0.474540  0.366355  1
  Ni  Ni25  1  0.909637  0.165187  0.333034  1
  Ni  Ni26  1  0.264157  0.153637  0.349563  1
  Ni  Ni27  1  0.242970  0.831854  0.333034  1
  Ni  Ni28  1  0.704305  0.322005  0.346936  1
  Ni  Ni29  1  0.681055  1.001782  0.330683  1
  Ni  Ni30  1  0.726558  0.642982  0.363683  1
  Ni  Ni31  1  0.037638  0.988672  0.346936  1
  Ni  Ni32  1  0.014389  0.668449  0.330683  1
  Ni  Ni33  1  0.370972  0.655338  0.346936  1
  Ni  Ni34  1  0.059891  0.309649  0.363683  1
  Ni  Ni35  1  0.347722  0.335115  0.330683  1
  Ni  Ni36  1  0.393224  0.976316  0.363683  1
  Ni  Ni37  1  0.689648  0.103605  0.416461  1
  Ni  Ni38  1  0.666730  0.782716  0.399725  1
  Ni  Ni39  1  0.643853  0.461737  0.383064  1
  Ni  Ni40  1  0.022982  0.770271  0.416461  1
  Ni  Ni41  1  1.000063  0.449382  0.399725  1
  Ni  Ni42  1  0.356315  0.436938  0.416461  1
  Ni  Ni43  1  0.977186  0.128403  0.383064  1
  Ni  Ni44  1  0.333396  0.116049  0.399725  1
  Ni  Ni45  1  0.310520  0.795070  0.383064  1
  Ni  Ni46  1  0.772704  0.284686  0.397090  1
  Ni  Ni47  1  0.749801  0.963813  0.380445  1
  Ni  Ni48  1  0.795551  0.605565  0.413790  1
  Ni  Ni49  1  0.106037  0.951352  0.397090  1
  Ni  Ni50  1  0.083135  0.630480  0.380445  1
  Ni  Ni51  1  0.439370  0.618019  0.397090  1
  Ni  Ni52  1  0.128884  0.272232  0.413790  1
  Ni  Ni53  1  0.416468  0.297146  0.380445  1
  Ni  Ni54  1  0.462217  0.938899  0.413790  1
  Ni  Ni55  1  0.758498  0.066216  0.466563  1
  Ni  Ni56  1  0.735546  0.745335  0.449854  1
  Ni  Ni57  1  0.712640  0.424451  0.433160  1
  Ni  Ni58  1  0.091831  0.732883  0.466563  1
  Ni  Ni59  1  0.068879  0.412001  0.449854  1
  Ni  Ni60  1  0.425165  0.399549  0.466563  1
  Ni  Ni61  1  0.045974  0.091118  0.433160  1
  Ni  Ni62  1  0.402212  0.078668  0.449854  1
  Ni  Ni63  1  0.379307  0.757785  0.433160  1
  Ni  Ni64  1  0.841458  0.247320  0.447196  1
  Ni  Ni65  1  0.818515  0.926440  0.430505  1
  Ni  Ni66  1  0.864381  0.568203  0.463895  1
  Ni  Ni67  1  0.174792  0.913987  0.447196  1
  Ni  Ni68  1  0.151848  0.593107  0.430505  1
  Ni  Ni69  1  0.508125  0.580654  0.447196  1
  Ni  Ni70  1  0.197714  0.234870  0.463895  1
  Ni  Ni71  1  0.485181  0.259773  0.430505  1
  Ni  Ni72  1  0.531047  0.901536  0.463895  1
  Ni  Ni73  1  0.827328  0.028847  0.516665  1
  Ni  Ni74  1  0.804381  0.707968  0.499964  1
  Ni  Ni75  1  0.781448  0.387088  0.483264  1
  Ni  Ni76  1  0.160661  0.695514  0.516665  1
  Ni  Ni77  1  0.137715  0.374634  0.499964  1
  Ni  Ni78  1  0.493995  0.362181  0.516665  1
  Ni  Ni79  1  0.114781  0.053755  0.483264  1
  Ni  Ni80  1  0.471048  0.041301  0.499964  1
  Ni  Ni81  1  0.448114  0.720421  0.483264  1
  Ni  Ni82  1  0.910276  0.209955  0.497299  1
  Ni  Ni83  1  0.887329  0.889075  0.480598  1
  Ni  Ni84  1  0.933210  0.530835  0.513999  1
  Ni  Ni85  1  0.243610  0.876622  0.497299  1
  Ni  Ni86  1  0.220663  0.555742  0.480598  1
  Ni  Ni87  1  0.576943  0.543288  0.497299  1
  Ni  Ni88  1  0.266543  0.197501  0.513999  1
  Ni  Ni89  1  0.553996  0.222408  0.480598  1
  Ni  Ni90  1  0.599876  0.864168  0.513999  1
  Ni  Ni91  1  0.896143  0.991483  0.566758  1
  Ni  Ni92  1  0.873199  0.670602  0.550067  1
  Ni  Ni93  1  0.850277  0.349720  0.533368  1
  Ni  Ni94  1  0.229476  0.658149  0.566758  1
  Ni  Ni95  1  0.206533  0.337269  0.550067  1
  Ni  Ni96  1  0.562810  0.324816  0.566758  1
  Ni  Ni97  1  0.183610  0.016386  0.533368  1
  Ni  Ni98  1  0.539866  0.003935  0.550067  1
  Ni  Ni99  1  0.516944  0.683053  0.533368  1
  Ni  Ni100  1  0.979112  0.172588  0.547409  1
  Ni  Ni101  1  0.956160  0.851706  0.530700  1
  Ni  Ni102  1  1.002017  0.493471  0.564103  1
  Ni  Ni103  1  0.312445  0.839254  0.547409  1
  Ni  Ni104  1  0.289493  0.518373  0.530700  1
  Ni  Ni105  1  0.645779  0.505921  0.547409  1
  Ni  Ni106  1  0.335350  0.160138  0.564103  1
  Ni  Ni107  1  0.622826  0.185040  0.530700  1
  Ni  Ni108  1  0.668684  0.826804  0.564103  1
  Ni  Ni109  1  0.964856  0.954109  0.616818  1
  Ni  Ni110  1  0.941954  0.633237  0.600173  1
  Ni  Ni111  1  0.919107  0.312357  0.583473  1
  Ni  Ni112  1  0.298190  0.620776  0.616818  1
  Ni  Ni113  1  0.275287  0.299903  0.600173  1
  Ni  Ni114  1  0.631523  0.287443  0.616818  1
  Ni  Ni115  1  0.252440  0.979024  0.583473  1
  Ni  Ni116  1  0.608621  0.966570  0.600173  1
  Ni  Ni117  1  0.585774  0.645691  0.583473  1
  Ni  Ni118  1  0.047928  0.135207  0.597538  1
  Ni  Ni119  1  0.025009  0.814318  0.580802  1
  Ni  Ni120  1  0.070805  0.456186  0.614198  1
  Ni  Ni121  1  0.381261  0.801874  0.597538  1
  Ni  Ni122  1  0.358343  0.480985  0.580802  1
  Ni  Ni123  1  0.714595  0.468540  0.597538  1
  Ni  Ni124  1  0.404138  0.122852  0.614198  1
  Ni  Ni125  1  0.691676  0.147651  0.580802  1
  Ni  Ni126  1  0.737471  0.789519  0.614198  1
  Ni  Ni127  1  0.033602  0.916141  0.666580  1
  Ni  Ni128  1  0.010353  0.595917  0.650327  1
  Ni  Ni129  1  0.988100  0.274940  0.633580  1
  Ni  Ni130  1  0.366936  0.582807  0.666580  1
  Ni  Ni131  1  0.343686  0.262584  0.650327  1
  Ni  Ni132  1  0.700269  0.249474  0.666580  1
  Ni  Ni133  1  0.321433  0.941607  0.633580  1
  Ni  Ni134  1  0.677019  0.929251  0.650327  1
  Ni  Ni135  1  0.654767  0.608273  0.633580  1
  Ni  Ni136  1  0.117167  0.097619  0.647700  1
  Ni  Ni137  1  0.093833  0.776716  0.630908  1
  Ni  Ni138  1  0.138354  0.419402  0.664229  1
  Ni  Ni139  1  0.450500  0.764286  0.647700  1
  Ni  Ni140  1  0.427167  0.443382  0.630908  1
  Ni  Ni141  1  0.783833  0.430952  0.647700  1
  Ni  Ni142  1  0.471688  0.086069  0.664229  1
  Ni  Ni143  1  0.760500  0.110049  0.630908  1
  Ni  Ni144  1  0.805021  0.752736  0.664229  1
  Ni  Ni145  1  0.103586  0.876216  0.714904  1
  Ni  Ni146  1  0.080172  0.558445  0.700448  1
  Ni  Ni147  1  0.057383  0.237885  0.683428  1
  Ni  Ni148  1  0.436919  0.542883  0.714904  1
  Ni  Ni149  1  0.413505  0.225112  0.700448  1
  Ni  Ni150  1  0.770252  0.209549  0.714904  1
  Ni  Ni151  1  0.390716  0.904551  0.683428  1
  Ni  Ni152  1  0.746838  0.891779  0.700448  1
  Ni  Ni153  1  0.724050  0.571218  0.683428  1
  Ni  Ni154  1  0.181563  0.060619  0.698129  1
  Ni  Ni155  1  0.163295  0.737888  0.680691  1
  Ni  Ni156  1  0.209309  0.380567  0.712701  1
  Ni  Ni157  1  0.514896  0.727286  0.698129  1
  Ni  Ni158  1  0.496629  0.404555  0.680691  1
  Ni  Ni159  1  0.848230  0.393953  0.698129  1
  Ni  Ni160  1  0.542642  0.047234  0.712701  1
  Ni  Ni161  1  0.829962  0.071221  0.680691  1
  Ni  Ni162  1  0.875975  0.713901  0.712701  1
