# generated using pymatgen
data_SbIrS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08126230
_cell_length_b   6.06713006
_cell_length_c   6.08358891
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbIrS
_chemical_formula_sum   'Sb4 Ir4 S4'
_cell_volume   224.45893630
_cell_formula_units_Z   4
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
  Sb  Sb0  1  0.38009404  0.63434003  0.38259024  1.0
  Sb  Sb1  1  0.61990596  0.36565997  0.88259024  1.0
  Sb  Sb2  1  0.11990596  0.63434003  0.88259024  1.0
  Sb  Sb3  1  0.88009404  0.36565997  0.38259024  1.0
  Ir  Ir4  1  0.50977324  0.76512766  0.99947275  1.0
  Ir  Ir5  1  0.49022676  0.23487234  0.49947275  1.0
  Ir  Ir6  1  0.99022676  0.76512766  0.49947275  1.0
  Ir  Ir7  1  0.00977324  0.23487234  0.99947275  1.0
  S  S8  1  0.11750900  0.12676873  0.62013700  1.0
  S  S9  1  0.88249100  0.87323127  0.12013700  1.0
  S  S10  1  0.38249100  0.12676873  0.12013700  1.0
  S  S11  1  0.61750900  0.87323127  0.62013700  1.0