data_[Cs8K4Tl4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Tl  1.6200  1.9000  1.3325
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.0275]
_cell_length_b [19.1119]
_cell_length_c [13.9760]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs2KTlCl5]
_chemical_formula_sum '[Cs8 K4 Tl4 Cl20]'
_cell_volume [1342.8786]
_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  0.1125  0.6931  1.0
  Cs  Cs1  4  0.0000  0.1453  0.3106  1.0
  K  K2  4  0.0000  0.2132  0.0202  1.0
  Tl  Tl3  4  0.0000  0.4701  0.4573  1.0
  Cl  Cl4  4  0.0000  0.0425  0.0250  1.0
  Cl  Cl5  4  0.0000  0.2882  0.6600  1.0
  Cl  Cl6  4  0.0000  0.3296  0.3803  1.0
  Cl  Cl7  4  0.0000  0.3792  0.0028  1.0
  Cl  Cl8  4  0.0000  0.4891  0.7746  1.0
]