data_[K8Sb8Cl8F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sb  2.0500  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [7.7117]
_cell_length_b [7.7963]
_cell_length_c [14.3355]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [KSbClF3]
_chemical_formula_sum '[K8 Sb8 Cl8 F24]'
_cell_volume [861.8986]
_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  8  0.1755  0.6977  0.4417  1
  Sb  Sb1  8  0.1331  0.5095  0.1823  1
  Cl  Cl2  8  0.0141  0.6310  0.6420  1
  F  F3  8  0.1118  0.2437  0.6563  1
  F  F4  8  0.1236  0.5050  0.8423  1
  F  F5  8  0.1605  0.5292  0.0448  1
]