data_[Tl4Sb4Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.2268]
_cell_length_b [6.5701]
_cell_length_c [12.4219]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.9883]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TlSbCl6]
_chemical_formula_sum '[Tl4 Sb4 Cl24]'
_cell_volume [976.1085]
_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  0.1116  0.2500  1.0
  Sb  Sb1  4  0.2500  0.2500  0.0000  1.0
  Cl  Cl2  8  0.0766  0.3791  0.8910  1.0
  Cl  Cl3  8  0.1502  0.0491  0.5395  1.0
  Cl  Cl4  8  0.2136  0.4152  0.1630  1.0
]