data_[Ba3U3Rh12S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  U  1.3800  1.7500  0.9913
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.7315]
_cell_length_b [7.7315]
_cell_length_c [16.8617]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [BaU(RhS2)4]
_chemical_formula_sum '[Ba3 U3 Rh12 S24]'
_cell_volume [872.8997]
_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
[
  Ba  Ba0  3  0.0000  0.0000  0.4130  1
  U  U1  3  0.0000  0.0000  0.9751  1
  Rh  Rh2  9  0.1674  0.3347  0.8356  1
  Rh  Rh3  3  0.0000  0.0000  0.6246  1
  S  S4  9  0.0048  0.5024  0.2348  1
  S  S5  9  0.0792  0.5396  0.7594  1
  S  S6  3  0.0000  0.0000  0.2353  1
  S  S7  3  0.0000  0.0000  0.7626  1
]