# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.15146001
_cell_length_b   6.51402892
_cell_length_c   48.80726002
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni54
_cell_volume   1319.88158379
_cell_formula_units_Z   54
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  0.253265  0.114843  0.312802  1
  Ni  Ni2  1  0.253265  0.833309  0.281780  1
  Ni  Ni3  1  0.253265  0.467850  0.296235  1
  Ni  Ni4  1  0.753265  0.042416  0.286277  1
  Ni  Ni5  1  0.753265  0.680174  0.300609  1
  Ni  Ni6  1  0.753265  0.328349  0.317721  1
  Ni  Ni7  1  0.253265  0.040037  0.362339  1
  Ni  Ni8  1  0.253265  0.753901  0.329555  1
  Ni  Ni9  1  0.253265  0.398340  0.345935  1
  Ni  Ni10  1  0.753265  0.966577  0.334646  1
  Ni  Ni11  1  0.753265  0.612458  0.351065  1
  Ni  Ni12  1  0.753265  0.254959  0.367719  1
  Ni  Ni13  1  0.253265  0.967635  0.412505  1
  Ni  Ni14  1  0.253265  0.682445  0.379231  1
  Ni  Ni15  1  0.253265  0.324615  0.395801  1
  Ni  Ni16  1  0.753265  0.897934  0.384710  1
  Ni  Ni17  1  0.753265  0.540404  0.401323  1
  Ni  Ni18  1  0.753265  0.183541  0.418074  1
  Ni  Ni19  1  0.253265  0.895699  0.462620  1
  Ni  Ni20  1  0.253265  0.610130  0.429220  1
  Ni  Ni21  1  0.253265  0.252938  0.445914  1
  Ni  Ni22  1  0.753265  0.826101  0.434837  1
  Ni  Ni23  1  0.753265  0.468944  0.451548  1
  Ni  Ni24  1  0.753265  0.111734  0.468266  1
  Ni  Ni25  1  0.253265  0.824039  0.512765  1
  Ni  Ni26  1  0.253265  0.538463  0.479340  1
  Ni  Ni27  1  0.253265  0.181252  0.496051  1
  Ni  Ni28  1  0.753265  0.754502  0.484998  1
  Ni  Ni29  1  0.753265  0.397290  0.501712  1
  Ni  Ni30  1  0.753265  0.040079  0.518423  1
  Ni  Ni31  1  0.253265  0.752441  0.562926  1
  Ni  Ni32  1  0.253265  0.466808  0.529497  1
  Ni  Ni33  1  0.253265  0.109598  0.546215  1
  Ni  Ni34  1  0.753265  0.682843  0.535143  1
  Ni  Ni35  1  0.753265  0.325604  0.551849  1
  Ni  Ni36  1  0.753265  0.968412  0.568543  1
  Ni  Ni37  1  0.253265  0.680608  0.613053  1
  Ni  Ni38  1  0.253265  0.395001  0.579689  1
  Ni  Ni39  1  0.253265  0.038138  0.596440  1
  Ni  Ni40  1  0.753265  0.610907  0.585259  1
  Ni  Ni41  1  0.753265  0.253927  0.601962  1
  Ni  Ni42  1  0.753265  0.896097  0.618532  1
  Ni  Ni43  1  0.253265  0.611965  0.663117  1
  Ni  Ni44  1  0.253265  0.323583  0.630045  1
  Ni  Ni45  1  0.253265  0.966084  0.646698  1
  Ni  Ni46  1  0.753265  0.538505  0.635424  1
  Ni  Ni47  1  0.753265  0.180202  0.651829  1
  Ni  Ni48  1  0.753265  0.824641  0.668208  1
  Ni  Ni49  1  0.253265  0.536126  0.711486  1
  Ni  Ni50  1  0.253265  0.250193  0.680042  1
  Ni  Ni51  1  0.253265  0.898368  0.697154  1
  Ni  Ni52  1  0.753265  0.463699  0.684961  1
  Ni  Ni53  1  0.753265  0.110692  0.701528  1
  Ni  Ni54  1  0.753265  0.745233  0.715983  1
