# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.50446735
_cell_length_b   3.50446735
_cell_length_c   49.41424864
_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   Ni24
_cell_volume   606.870786309
_cell_formula_units_Z   24
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  1.002216  0.002216  0.337942  1
  Ni  Ni2  1  0.502216  0.502216  0.337942  1
  Ni  Ni3  1  1.002216  0.502216  0.302526  1
  Ni  Ni4  1  0.502216  0.002216  0.302526  1
  Ni  Ni5  1  1.002216  0.002216  0.409145  1
  Ni  Ni6  1  0.502216  0.502216  0.409145  1
  Ni  Ni7  1  1.002216  0.502216  0.373336  1
  Ni  Ni8  1  0.502216  0.002216  0.373336  1
  Ni  Ni9  1  1.002216  0.002216  0.480744  1
  Ni  Ni10  1  0.502216  0.502216  0.480744  1
  Ni  Ni11  1  1.002216  0.502216  0.444950  1
  Ni  Ni12  1  0.502216  0.002216  0.444950  1
  Ni  Ni13  1  1.002216  0.002216  0.552333  1
  Ni  Ni14  1  0.502216  0.502216  0.552333  1
  Ni  Ni15  1  1.002216  0.502216  0.516539  1
  Ni  Ni16  1  0.502216  0.002216  0.516539  1
  Ni  Ni17  1  1.002216  0.002216  0.623947  1
  Ni  Ni18  1  0.502216  0.502216  0.623947  1
  Ni  Ni19  1  1.002216  0.502216  0.588138  1
  Ni  Ni20  1  0.502216  0.002216  0.588138  1
  Ni  Ni21  1  1.002216  0.002216  0.694757  1
  Ni  Ni22  1  0.502216  0.502216  0.694757  1
  Ni  Ni23  1  1.002216  0.502216  0.659341  1
  Ni  Ni24  1  0.502216  0.002216  0.659341  1
