data_[Ce4Tl6Rh2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Tl  1.6200  1.9000  1.3325
  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 [6.7236]
_cell_length_b [11.7867]
_cell_length_c [7.9997]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0457]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce2Tl3RhS6]
_chemical_formula_sum '[Ce4 Tl6 Rh2 S12]'
_cell_volume [606.1225]
_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
[
  Ce  Ce0  4  0.0000  0.3362  0.0000  1.0
  Tl  Tl1  4  0.0000  0.1753  0.5000  1.0
  Tl  Tl2  2  0.0000  0.5000  0.5000  1.0
  Rh  Rh3  2  0.0000  0.0000  0.0000  1.0
  S  S4  8  0.2127  0.8479  0.1873  1.0
  S  S5  4  0.2346  0.0000  0.7960  1.0
]