# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56152216
_cell_length_b   12.63410604
_cell_length_c   47.90268801
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.12895032
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni162
_cell_volume   3968.34230631
_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  0.551451  0.180404  0.318301  1
  Ni  Ni2  1  0.529864  0.858725  0.301667  1
  Ni  Ni3  1  0.504728  0.537814  0.286219  1
  Ni  Ni4  1  0.884784  0.847071  0.318301  1
  Ni  Ni5  1  0.863198  0.525391  0.301667  1
  Ni  Ni6  1  0.218118  0.513738  0.318301  1
  Ni  Ni7  1  0.838061  0.204480  0.286219  1
  Ni  Ni8  1  0.196531  0.192058  0.301667  1
  Ni  Ni9  1  0.171395  0.871147  0.286219  1
  Ni  Ni10  1  0.633429  0.360893  0.299057  1
  Ni  Ni11  1  0.611703  0.041845  0.283997  1
  Ni  Ni12  1  0.656903  0.681031  0.315610  1
  Ni  Ni13  1  0.966762  0.027559  0.299057  1
  Ni  Ni14  1  0.945036  0.708511  0.283997  1
  Ni  Ni15  1  0.300096  0.694226  0.299057  1
  Ni  Ni16  1  0.990237  0.347697  0.315610  1
  Ni  Ni17  1  0.278370  0.375178  0.283997  1
  Ni  Ni18  1  0.323570  0.014364  0.315610  1
  Ni  Ni19  1  0.619317  0.142780  0.368010  1
  Ni  Ni20  1  0.596418  0.821714  0.351302  1
  Ni  Ni21  1  0.574597  0.500186  0.334703  1
  Ni  Ni22  1  0.952651  0.809446  0.368010  1
  Ni  Ni23  1  0.929752  0.488381  0.351302  1
  Ni  Ni24  1  0.285984  0.476113  0.368010  1
  Ni  Ni25  1  0.907930  0.166853  0.334703  1
  Ni  Ni26  1  0.263085  0.155047  0.351302  1
  Ni  Ni27  1  0.241264  0.833519  0.334703  1
  Ni  Ni28  1  0.703159  0.323631  0.348637  1
  Ni  Ni29  1  0.680153  0.002970  0.332295  1
  Ni  Ni30  1  0.725725  0.644592  0.365300  1
  Ni  Ni31  1  0.036493  0.990298  0.348637  1
  Ni  Ni32  1  0.013486  0.669636  0.332295  1
  Ni  Ni33  1  0.369826  0.656964  0.348637  1
  Ni  Ni34  1  0.059058  0.311259  0.365300  1
  Ni  Ni35  1  0.346820  0.336303  0.332295  1
  Ni  Ni36  1  0.392391  0.977925  0.365300  1
  Ni  Ni37  1  0.687977  0.105421  0.418198  1
  Ni  Ni38  1  0.665171  0.784427  0.401456  1
  Ni  Ni39  1  0.642265  0.463491  0.384782  1
  Ni  Ni40  1  0.021310  0.772087  0.418198  1
  Ni  Ni41  1  0.998505  0.451093  0.401456  1
  Ni  Ni42  1  0.354643  0.438754  0.418198  1
  Ni  Ni43  1  0.975599  0.130158  0.384782  1
  Ni  Ni44  1  0.331838  0.117760  0.401456  1
  Ni  Ni45  1  0.308932  0.796824  0.384782  1
  Ni  Ni46  1  0.771859  0.286467  0.398758  1
  Ni  Ni47  1  0.748884  0.965536  0.382125  1
  Ni  Ni48  1  0.794737  0.607399  0.415468  1
  Ni  Ni49  1  0.105192  0.953133  0.398758  1
  Ni  Ni50  1  0.082217  0.632202  0.382125  1
  Ni  Ni51  1  0.438525  0.619800  0.398758  1
  Ni  Ni52  1  0.128070  0.274066  0.415468  1
  Ni  Ni53  1  0.415551  0.298869  0.382125  1
  Ni  Ni54  1  0.461403  0.940733  0.415468  1
  Ni  Ni55  1  0.756726  0.068215  0.468347  1
  Ni  Ni56  1  0.733814  0.747262  0.451628  1
  Ni  Ni57  1  0.710944  0.426317  0.434920  1
  Ni  Ni58  1  0.090060  0.734882  0.468347  1
  Ni  Ni59  1  0.067147  0.413929  0.451628  1
  Ni  Ni60  1  0.423393  0.401548  0.468347  1
  Ni  Ni61  1  0.044278  0.092984  0.434920  1
  Ni  Ni62  1  0.400480  0.080595  0.451628  1
  Ni  Ni63  1  0.377611  0.759651  0.434920  1
  Ni  Ni64  1  0.840625  0.249289  0.448902  1
  Ni  Ni65  1  0.817703  0.928338  0.432208  1
  Ni  Ni66  1  0.863523  0.570235  0.465614  1
  Ni  Ni67  1  0.173958  0.915955  0.448902  1
  Ni  Ni68  1  0.151036  0.595005  0.432208  1
  Ni  Ni69  1  0.507291  0.582622  0.448902  1
  Ni  Ni70  1  0.196856  0.236901  0.465614  1
  Ni  Ni71  1  0.484369  0.261672  0.432208  1
  Ni  Ni72  1  0.530190  0.903568  0.465614  1
  Ni  Ni73  1  0.825471  0.031040  0.518488  1
  Ni  Ni74  1  0.802556  0.710092  0.501777  1
  Ni  Ni75  1  0.779650  0.389148  0.485066  1
  Ni  Ni76  1  0.158804  0.697707  0.518488  1
  Ni  Ni77  1  0.135889  0.376758  0.501777  1
  Ni  Ni78  1  0.492137  0.364373  0.518488  1
  Ni  Ni79  1  0.112983  0.055814  0.485066  1
  Ni  Ni80  1  0.469223  0.043425  0.501777  1
  Ni  Ni81  1  0.446317  0.722481  0.485066  1
  Ni  Ni82  1  0.909370  0.212120  0.499046  1
  Ni  Ni83  1  0.886455  0.891171  0.482335  1
  Ni  Ni84  1  0.932276  0.533064  0.515757  1
  Ni  Ni85  1  0.242703  0.878786  0.499046  1
  Ni  Ni86  1  0.219788  0.557838  0.482335  1
  Ni  Ni87  1  0.576037  0.545453  0.499046  1
  Ni  Ni88  1  0.265609  0.199730  0.515757  1
  Ni  Ni89  1  0.553122  0.224505  0.482335  1
  Ni  Ni90  1  0.598943  0.866397  0.515757  1
  Ni  Ni91  1  0.894223  0.993873  0.568615  1
  Ni  Ni92  1  0.871301  0.672922  0.551921  1
  Ni  Ni93  1  0.848403  0.351977  0.535209  1
  Ni  Ni94  1  0.227557  0.660540  0.568615  1
  Ni  Ni95  1  0.204635  0.339589  0.551921  1
  Ni  Ni96  1  0.560890  0.327206  0.568615  1
  Ni  Ni97  1  0.181736  0.018643  0.535209  1
  Ni  Ni98  1  0.537968  0.006256  0.551921  1
  Ni  Ni99  1  0.515069  0.685310  0.535209  1
  Ni  Ni100  1  0.978112  0.174949  0.549195  1
  Ni  Ni101  1  0.955199  0.853996  0.532476  1
  Ni  Ni102  1  1.000981  0.495894  0.565903  1
  Ni  Ni103  1  0.311445  0.841616  0.549195  1
  Ni  Ni104  1  0.288533  0.520663  0.532476  1
  Ni  Ni105  1  0.644779  0.508283  0.549195  1
  Ni  Ni106  1  0.334315  0.162561  0.565903  1
  Ni  Ni107  1  0.621866  0.187330  0.532476  1
  Ni  Ni108  1  0.667648  0.829227  0.565903  1
  Ni  Ni109  1  0.963042  0.956676  0.618698  1
  Ni  Ni110  1  0.940067  0.635745  0.602065  1
  Ni  Ni111  1  0.917189  0.314812  0.585355  1
  Ni  Ni112  1  0.296375  0.623342  0.618698  1
  Ni  Ni113  1  0.273400  0.302411  0.602065  1
  Ni  Ni114  1  0.629709  0.290009  0.618698  1
  Ni  Ni115  1  0.250523  0.981479  0.585355  1
  Ni  Ni116  1  0.606734  0.969078  0.602065  1
  Ni  Ni117  1  0.583856  0.648145  0.585355  1
  Ni  Ni118  1  0.046755  0.137784  0.599366  1
  Ni  Ni119  1  0.023949  0.816790  0.582625  1
  Ni  Ni120  1  0.069660  0.458720  0.616041  1
  Ni  Ni121  1  0.380088  0.804451  0.599366  1
  Ni  Ni122  1  0.357283  0.483457  0.582625  1
  Ni  Ni123  1  0.713421  0.471118  0.599366  1
  Ni  Ni124  1  0.402994  0.125387  0.616041  1
  Ni  Ni125  1  0.690616  0.150124  0.582625  1
  Ni  Ni126  1  0.736327  0.792054  0.616041  1
  Ni  Ni127  1  0.031773  0.919242  0.668528  1
  Ni  Ni128  1  0.008766  0.598580  0.652186  1
  Ni  Ni129  1  0.986201  0.277619  0.635523  1
  Ni  Ni130  1  0.365106  0.585908  0.668528  1
  Ni  Ni131  1  0.342100  0.265247  0.652186  1
  Ni  Ni132  1  0.698440  0.252575  0.668528  1
  Ni  Ni133  1  0.319535  0.944286  0.635523  1
  Ni  Ni134  1  0.675433  0.931914  0.652186  1
  Ni  Ni135  1  0.652868  0.610953  0.635523  1
  Ni  Ni136  1  0.115507  0.100497  0.649521  1
  Ni  Ni137  1  0.092608  0.779431  0.632813  1
  Ni  Ni138  1  0.137329  0.422025  0.666119  1
  Ni  Ni139  1  0.448841  0.767164  0.649521  1
  Ni  Ni140  1  0.425942  0.446098  0.632813  1
  Ni  Ni141  1  0.782174  0.433830  0.649521  1
  Ni  Ni142  1  0.470662  0.088692  0.666119  1
  Ni  Ni143  1  0.759275  0.112765  0.632813  1
  Ni  Ni144  1  0.803995  0.755359  0.666119  1
  Ni  Ni145  1  0.100223  0.880367  0.716825  1
  Ni  Ni146  1  0.078497  0.561319  0.701766  1
  Ni  Ni147  1  0.055022  0.241181  0.685213  1
  Ni  Ni148  1  0.433556  0.547033  0.716825  1
  Ni  Ni149  1  0.411830  0.227985  0.701766  1
  Ni  Ni150  1  0.766889  0.213700  0.716825  1
  Ni  Ni151  1  0.388356  0.907847  0.685213  1
  Ni  Ni152  1  0.745163  0.894652  0.701766  1
  Ni  Ni153  1  0.721689  0.574514  0.685213  1
  Ni  Ni154  1  0.182062  0.063487  0.699156  1
  Ni  Ni155  1  0.160475  0.741807  0.682522  1
  Ni  Ni156  1  0.207198  0.384398  0.714604  1
  Ni  Ni157  1  0.515395  0.730153  0.699156  1
  Ni  Ni158  1  0.493808  0.408474  0.682522  1
  Ni  Ni159  1  0.848728  0.396820  0.699156  1
  Ni  Ni160  1  0.540531  0.051064  0.714604  1
  Ni  Ni161  1  0.827142  0.075140  0.682522  1
  Ni  Ni162  1  0.873865  0.717731  0.714604  1
