# generated using pymatgen
data_Ni8IrS8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04880417
_cell_length_b   7.04880443
_cell_length_c   7.04880459
_cell_angle_alpha   59.99999924
_cell_angle_beta   59.99999801
_cell_angle_gamma   59.99999726
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni8IrS8
_chemical_formula_sum   'Ni8 Ir1 S8'
_cell_volume   247.64602501
_cell_formula_units_Z   1
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  Ni0  1  0.61934724  0.12688425  0.12688425  1.0
  Ni  Ni1  1  0.12688425  0.61934724  0.12688425  1.0
  Ni  Ni2  1  0.12688425  0.12688425  0.61934724  1.0
  Ni  Ni3  1  0.12688425  0.12688425  0.12688425  1.0
  Ni  Ni4  1  0.38065276  0.87311575  0.87311575  1.0
  Ni  Ni5  1  0.87311575  0.38065276  0.87311575  1.0
  Ni  Ni6  1  0.87311575  0.87311575  0.38065276  1.0
  Ni  Ni7  1  0.87311575  0.87311575  0.87311575  1.0
  Ir  Ir8  1  0.50000000  0.50000000  0.50000000  1.0
  S  S9  1  0.25000000  0.25000000  0.25000000  1.0
  S  S10  1  0.75000000  0.75000000  0.75000000  1.0
  S  S11  1  0.74113346  0.25886654  0.25886654  1.0
  S  S12  1  0.74113346  0.25886654  0.74113346  1.0
  S  S13  1  0.74113346  0.74113346  0.25886654  1.0
  S  S14  1  0.25886654  0.74113346  0.74113346  1.0
  S  S15  1  0.25886654  0.74113346  0.25886654  1.0
  S  S16  1  0.25886654  0.25886654  0.74113346  1.0