data_[Rb6Ce4Tl2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ce  1.1200  1.8500  1.0800
  Tl  1.6200  1.9000  1.3325
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.4430]
_cell_length_b [4.2474]
_cell_length_c [9.1895]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3177]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb3Ce2TlS6]
_chemical_formula_sum '[Rb6 Ce4 Tl2 S12]'
_cell_volume [731.9274]
_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
[
  Rb  Rb0  4  0.1531  0.0000  0.8395  1
  Rb  Rb1  2  0.0000  0.5000  0.5000  1
  Ce  Ce2  4  0.1691  0.0000  0.3344  1
  Tl  Tl3  2  0.0000  0.5000  0.0000  1
  S  S4  4  0.0312  0.0000  0.2605  1
  S  S5  4  0.1741  0.5000  0.1438  1
  S  S6  4  0.1805  0.5000  0.5467  1
]