data_[Na8Rh4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  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 [6.4286]
_cell_length_b [10.9528]
_cell_length_c [6.8314]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.1929]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2RhS3]
_chemical_formula_sum '[Na8 Rh4 S12]'
_cell_volume [456.9595]
_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
[
  Na  Na0  4  0.0000  0.1516  0.5000  1
  Na  Na1  2  0.0000  0.0000  0.0000  1
  Na  Na2  2  0.0000  0.5000  0.5000  1
  Rh  Rh3  4  0.0000  0.3303  0.0000  1
  S  S4  8  0.2400  0.3100  0.7949  1
  S  S5  4  0.1929  0.5000  0.2032  1
]