data_[Tl1Re1Ag2Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Re  1.9000  1.3500  0.7125
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4786]
_cell_length_b [7.2235]
_cell_length_c [8.5670]
_cell_angle_alpha [92.9207]
_cell_angle_beta [90.8206]
_cell_angle_gamma [97.2537]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TlRe(AgBr4)2]
_chemical_formula_sum '[Tl1 Re1 Ag2 Br8]'
_cell_volume [397.1092]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.5000  1.0
  Re  Re1  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.0396  0.5040  0.7247  1.0
  Br  Br3  2  0.2023  0.7220  0.9809  1.0
  Br  Br4  2  0.2364  0.1654  0.8022  1.0
  Br  Br5  2  0.2436  0.1484  0.2158  1.0
  Br  Br6  2  0.2574  0.6722  0.4770  1.0
]