data_[Cs4Tl4Cd8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.2706]
_cell_length_b [15.4210]
_cell_length_c [7.5175]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.9614]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsTl(CdBr3)2]
_chemical_formula_sum '[Cs4 Tl4 Cd8 Br24]'
_cell_volume [1760.7097]
_cell_formula_units_Z [4]
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
[
  Cs  Cs0  4  0.0000  0.1035  0.2500  1.0
  Tl  Tl1  4  0.0000  0.2972  0.7500  1.0
  Cd  Cd2  8  0.2120  0.4153  0.2784  1.0
  Br  Br3  8  0.1171  0.1037  0.7033  1.0
  Br  Br4  8  0.1254  0.2866  0.1285  1.0
  Br  Br5  8  0.1658  0.4323  0.6168  1.0
]