data_[K4Sb8I24]
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
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.6101]
_cell_length_b [13.6433]
_cell_length_c [12.3084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3701]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [K(SbI3)2]
_chemical_formula_sum '[K4 Sb8 I24]'
_cell_volume [2163.6792]
_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  0.0714  0.7500  1.0
  Sb  Sb1  8  0.1316  0.4511  0.7147  1.0
  I  I2  8  0.1228  0.5253  0.4635  1.0
  I  I3  8  0.1232  0.2511  0.6586  1.0
  I  I4  8  0.1425  0.0409  0.1184  1.0
]