data_[K8Pt8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pt  2.2800  1.3500  0.8050
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [10.1403]
_cell_length_b [13.8073]
_cell_length_c [9.8576]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9732]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [KPtCl3]
_chemical_formula_sum '[K8 Pt8 Cl24]'
_cell_volume [1261.1078]
_cell_formula_units_Z [8]
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  0.2371  0.1611  0.4567  1.0
  K  K1  4  0.2735  0.1698  0.9727  1.0
  Pt  Pt2  4  0.1866  0.4457  0.7263  1.0
  Pt  Pt3  4  0.4719  0.4467  0.5159  1.0
  Cl  Cl4  4  0.0341  0.2107  0.0941  1.0
  Cl  Cl5  4  0.1184  0.2870  0.6599  1.0
  Cl  Cl6  4  0.1855  0.0021  0.6984  1.0
  Cl  Cl7  4  0.2634  0.3979  0.3144  1.0
  Cl  Cl8  4  0.3949  0.3968  0.9295  1.0
  Cl  Cl9  4  0.4905  0.0022  0.5258  1.0
]