data_[Cs4Tl4Cu8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  Cu  1.9000  1.3500  0.8200
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.3849]
_cell_length_b [14.5337]
_cell_length_c [9.4188]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.9444]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsTl(CuCl3)2]
_chemical_formula_sum '[Cs4 Tl4 Cu8 Cl24]'
_cell_volume [1465.0075]
_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
[
  Cs  Cs0  4  0.0000  0.1512  0.2500  1.0
  Tl  Tl1  4  0.0000  0.4359  0.7500  1.0
  Cu  Cu2  8  0.2361  0.1327  0.7054  1.0
  Cl  Cl3  8  0.0856  0.3790  0.1082  1.0
  Cl  Cl4  8  0.1810  0.2743  0.6773  1.0
  Cl  Cl5  8  0.1865  0.0008  0.5985  1.0
]