data_[Tl4Cd4Ag8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.9457]
_cell_length_b [12.9124]
_cell_length_c [8.8198]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.9977]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TlCd(AgBr3)2]
_chemical_formula_sum '[Tl4 Cd4 Ag8 Br24]'
_cell_volume [1529.8545]
_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
[
  Tl  Tl0  4  0.0000  0.1836  0.2500  1.0
  Cd  Cd1  4  0.0000  0.1673  0.7500  1.0
  Ag  Ag2  8  0.1908  0.4583  0.1481  1.0
  Br  Br3  8  0.1139  0.0429  0.6590  1.0
  Br  Br4  8  0.1218  0.2547  0.0294  1.0
  Br  Br5  8  0.1269  0.4280  0.3802  1.0
]