data_[K4Tl4Cd8I24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.3044]
_cell_length_b [14.3159]
_cell_length_c [8.6633]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.4028]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KTl(CdI3)2]
_chemical_formula_sum '[K4 Tl4 Cd8 I24]'
_cell_volume [1939.8263]
_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
[
  K  K0  4  0.0000  0.3158  0.7500  1.0
  Tl  Tl1  4  0.0000  0.1026  0.2500  1.0
  Cd  Cd2  8  0.2101  0.4083  0.2388  1.0
  I  I3  8  0.1129  0.0938  0.6592  1.0
  I  I4  8  0.1288  0.4584  0.4878  1.0
  I  I5  8  0.1426  0.2366  0.1162  1.0
]