data_[K8I12Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  I  2.6600  1.4000  1.2733
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.4184]
_cell_length_b [9.5905]
_cell_length_c [17.1827]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.2139]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [K2(ICl2)3]
_chemical_formula_sum '[K8 I12 Cl24]'
_cell_volume [1831.8238]
_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  8  0.0458  0.2480  0.0004  1
  I  I1  8  0.1689  0.0496  0.7574  1
  I  I2  4  0.0000  0.4711  0.2500  1
  Cl  Cl3  8  0.0604  0.4731  0.4014  1
  Cl  Cl4  8  0.1204  0.0251  0.6061  1
  Cl  Cl5  8  0.2200  0.0720  0.9086  1
]