data_[Tl9Zn3Ag9Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.4225]
_cell_length_b [8.4225]
_cell_length_c [22.9927]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Tl3ZnAg3Br8]
_chemical_formula_sum '[Tl9 Zn3 Ag9 Br24]'
_cell_volume [1412.5552]
_cell_formula_units_Z [3]
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  9  0.0000  0.5000  0.5000  1
  Zn  Zn1  3  -0.0000  -0.0000  0.0000  1
  Ag  Ag2  9  0.0000  0.5000  0.0000  1
  Br  Br3  18  0.0255  0.5127  0.7310  1
  Br  Br4  6  0.0000  0.0000  0.2653  1
]