data_[Co8Rh2S16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  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 [10.3344]
_cell_length_b [6.7304]
_cell_length_c [7.7170]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.1460]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Co4RhS8]
_chemical_formula_sum '[Co8 Rh2 S16]'
_cell_volume [404.1984]
_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
[
  Co  Co0  4  0.0000  0.2333  0.0000  1
  Co  Co1  4  0.2288  0.0000  0.4902  1
  Rh  Rh2  2  0.0000  0.5000  0.5000  1
  S  S3  8  0.2233  0.2559  0.6698  1
  S  S4  4  0.0178  0.5000  0.8276  1
  S  S5  4  0.0373  0.0000  0.8357  1
]