# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47913389
_cell_length_b   4.09683793
_cell_length_c   47.35629346
_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   Ni20
_cell_volume   480.979391693
_cell_formula_units_Z   20
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  0.001293  0.751556  0.302594  1
  Ni  Ni2  1  0.501293  0.251556  0.288831  1
  Ni  Ni3  1  0.501293  0.751556  0.348014  1
  Ni  Ni4  1  0.001293  0.251556  0.333435  1
  Ni  Ni5  1  0.001293  0.751556  0.393677  1
  Ni  Ni6  1  0.501293  0.251556  0.378656  1
  Ni  Ni7  1  0.501293  0.751556  0.439277  1
  Ni  Ni8  1  0.001293  0.251556  0.424101  1
  Ni  Ni9  1  0.001293  0.751556  0.484841  1
  Ni  Ni10  1  0.501293  0.251556  0.469612  1
  Ni  Ni11  1  0.501293  0.751556  0.530382  1
  Ni  Ni12  1  0.001293  0.251556  0.515154  1
  Ni  Ni13  1  0.001293  0.751556  0.575893  1
  Ni  Ni14  1  0.501293  0.251556  0.560718  1
  Ni  Ni15  1  0.501293  0.751556  0.621338  1
  Ni  Ni16  1  0.001293  0.251556  0.606317  1
  Ni  Ni17  1  0.001293  0.751556  0.666559  1
  Ni  Ni18  1  0.501293  0.251556  0.651981  1
  Ni  Ni19  1  0.501293  0.751556  0.711163  1
  Ni  Ni20  1  0.001293  0.251556  0.697401  1
