data_[Na6Ir2Rh4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.3427]
_cell_length_b [10.9852]
_cell_length_c [6.5935]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7053]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na3Ir(RhS3)2]
_chemical_formula_sum '[Na6 Ir2 Rh4 S12]'
_cell_volume [435.1387]
_cell_formula_units_Z [2]
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
[
  Na  Na0  4  0.0000  0.1672  0.5000  1.0
  Na  Na1  2  0.0000  0.5000  0.5000  1.0
  Ir  Ir2  2  0.0000  0.0000  0.0000  1.0
  Rh  Rh3  4  0.0000  0.3333  0.0000  1.0
  S  S4  8  0.2286  0.1662  0.1872  1.0
  S  S5  4  0.2300  0.5000  0.1873  1.0
]