data_[Tl10Sb4Cl24]
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/m]
_cell_length_a [17.1931]
_cell_length_b [8.0609]
_cell_length_c [9.9893]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4294]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl5(SbCl6)2]
_chemical_formula_sum '[Tl10 Sb4 Cl24]'
_cell_volume [1305.6030]
_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  0.1879  0.5000  0.8095  1.0
  Tl  Tl1  4  0.2172  0.5000  0.3803  1.0
  Tl  Tl2  2  0.0000  0.0000  0.5000  1.0
  Sb  Sb3  4  0.0000  0.2512  0.0000  1.0
  Cl  Cl4  8  0.1294  0.2385  0.5558  1.0
  Cl  Cl5  8  0.1608  0.2631  0.0844  1.0
  Cl  Cl6  4  0.0021  0.0000  0.1855  1.0
  Cl  Cl7  4  0.0053  0.5000  0.1885  1.0
]