data_[Rh3S3O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P3_121]
_cell_length_a [5.1111]
_cell_length_b [5.1111]
_cell_length_c [12.2632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [152]
_chemical_formula_structural [RhSO4]
_chemical_formula_sum '[Rh3 S3 O12]'
_cell_volume [277.4328]
_cell_formula_units_Z [3]
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
[
  Rh  Rh0  3  0.0000  0.4939  0.1667  1
  S  S1  3  0.0000  0.4902  0.6667  1
  O  O2  6  0.0507  0.6798  0.7654  1
  O  O3  6  0.1840  0.7278  0.3148  1
]