# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70981584
_cell_length_b   4.71597634
_cell_length_c   46.99491249
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.45120820
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni78
_cell_volume   1807.50957375
_cell_formula_units_Z   78
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  0.716746  0.477711  0.293949  1
  Ni  Ni2  1  0.998549  0.410554  0.303198  1
  Ni  Ni3  1  0.442892  0.540036  0.284421  1
  Ni  Ni4  1  0.785181  0.927415  0.301707  1
  Ni  Ni5  1  0.236310  0.031186  0.283402  1
  Ni  Ni6  1  0.507273  0.986994  0.291946  1
  Ni  Ni7  1  0.560770  0.305329  0.325768  1
  Ni  Ni8  1  0.841395  0.247165  0.336182  1
  Ni  Ni9  1  0.278070  0.373159  0.314055  1
  Ni  Ni10  1  0.627898  0.761097  0.334594  1
  Ni  Ni11  1  0.066917  0.867927  0.311655  1
  Ni  Ni12  1  0.349294  0.820519  0.324687  1
  Ni  Ni13  1  0.396453  0.154823  0.359442  1
  Ni  Ni14  1  0.677601  0.095357  0.370853  1
  Ni  Ni15  1  0.118883  0.199397  0.346746  1
  Ni  Ni16  1  0.463948  0.608388  0.369333  1
  Ni  Ni17  1  0.906804  0.706066  0.344912  1
  Ni  Ni18  1  0.182790  0.661608  0.357031  1
  Ni  Ni19  1  0.233760  1.000319  0.394004  1
  Ni  Ni20  1  0.513023  0.950478  0.405898  1
  Ni  Ni21  1  0.955756  0.047598  0.382337  1
  Ni  Ni22  1  0.299358  0.459767  0.403825  1
  Ni  Ni23  1  0.743678  0.555261  0.380418  1
  Ni  Ni24  1  0.021662  0.506510  0.391740  1
  Ni  Ni25  1  0.070214  0.851532  0.428920  1
  Ni  Ni26  1  0.348879  0.802415  0.440586  1
  Ni  Ni27  1  0.792154  0.900069  0.417373  1
  Ni  Ni28  1  0.135746  0.310448  0.438557  1
  Ni  Ni29  1  0.578882  0.408542  0.415471  1
  Ni  Ni30  1  0.857521  0.359569  0.426982  1
  Ni  Ni31  1  0.906586  0.702835  0.463788  1
  Ni  Ni32  1  0.185126  0.653501  0.475358  1
  Ni  Ni33  1  0.627920  0.752253  0.452206  1
  Ni  Ni34  1  0.972030  0.161629  0.473430  1
  Ni  Ni35  1  0.414468  0.261012  0.450250  1
  Ni  Ni36  1  0.693391  0.210981  0.461833  1
  Ni  Ni37  1  0.742677  0.554245  0.498585  1
  Ni  Ni38  1  0.021397  0.504685  0.510195  1
  Ni  Ni39  1  0.463886  0.603914  0.486974  1
  Ni  Ni40  1  0.808123  0.013031  0.508250  1
  Ni  Ni41  1  0.250612  0.112259  0.485029  1
  Ni  Ni42  1  0.529332  0.062700  0.496639  1
  Ni  Ni43  1  0.578619  0.405964  0.533391  1
  Ni  Ni44  1  0.857541  0.355933  0.544974  1
  Ni  Ni45  1  0.299979  0.455316  0.521794  1
  Ni  Ni46  1  0.644089  0.864692  0.543019  1
  Ni  Ni47  1  0.086883  0.963444  0.519867  1
  Ni  Ni48  1  0.365423  0.914109  0.531437  1
  Ni  Ni49  1  0.414488  0.257376  0.568242  1
  Ni  Ni50  1  0.693127  0.208402  0.579753  1
  Ni  Ni51  1  0.136263  0.306497  0.556667  1
  Ni  Ni52  1  0.479855  0.716876  0.577852  1
  Ni  Ni53  1  0.923130  0.814530  0.554638  1
  Ni  Ni54  1  0.201795  0.765412  0.566305  1
  Ni  Ni55  1  0.250347  0.110435  0.603484  1
  Ni  Ni56  1  0.528331  0.061684  0.614807  1
  Ni  Ni57  1  0.972651  0.157178  0.591400  1
  Ni  Ni58  1  0.316253  0.569346  0.612887  1
  Ni  Ni59  1  0.758986  0.666467  0.589326  1
  Ni  Ni60  1  0.038249  0.616626  0.601220  1
  Ni  Ni61  1  0.089219  0.955337  0.638194  1
  Ni  Ni62  1  0.365205  0.910878  0.650312  1
  Ni  Ni63  1  0.808061  1.008557  0.625891  1
  Ni  Ni64  1  0.153126  0.417547  0.648479  1
  Ni  Ni65  1  0.594408  0.521588  0.624371  1
  Ni  Ni66  1  0.875556  0.462121  0.635783  1
  Ni  Ni67  1  0.922715  0.796425  0.670538  1
  Ni  Ni68  1  0.205092  0.749018  0.683569  1
  Ni  Ni69  1  0.644111  0.855848  0.660631  1
  Ni  Ni70  1  0.993939  0.243786  0.681169  1
  Ni  Ni71  1  0.430614  0.369780  0.659042  1
  Ni  Ni72  1  0.711239  0.311616  0.669457  1
  Ni  Ni73  1  0.764736  0.629951  0.703278  1
  Ni  Ni74  1  0.035699  0.585759  0.711822  1
  Ni  Ni75  1  0.486829  0.689530  0.693517  1
  Ni  Ni76  1  0.829117  0.076908  0.710803  1
  Ni  Ni77  1  0.273461  0.206390  0.692027  1
  Ni  Ni78  1  0.555263  0.139234  0.701275  1
