data_[Tl4Cd2Ag4Br12]
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/m]
_cell_length_a [14.5245]
_cell_length_b [7.7931]
_cell_length_c [7.6685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.6184]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl2Cd(AgBr3)2]
_chemical_formula_sum '[Tl4 Cd2 Ag4 Br12]'
_cell_volume [739.1526]
_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
[
  Tl  Tl0  4  0.2451  0.5000  0.1938  1.0
  Cd  Cd1  2  0.0000  0.5000  0.5000  1.0
  Ag  Ag2  4  0.0708  0.0000  0.2273  1.0
  Br  Br3  8  0.0621  0.2540  0.8074  1.0
  Br  Br4  4  0.2215  0.5000  0.6018  1.0
]