data_[K8Ce12Cl38]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ce  1.1200  1.8500  1.0800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [I23]
_cell_length_a [12.7397]
_cell_length_b [12.7397]
_cell_length_c [12.7397]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [197]
_chemical_formula_structural [K4Ce6Cl19]
_chemical_formula_sum '[K8 Ce12 Cl38]'
_cell_volume [2067.6535]
_cell_formula_units_Z [2]
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  0.1373  0.1373  0.1373  1
  Ce  Ce1  12  0.0000  0.1557  0.5000  1
  Cl  Cl2  24  0.0376  0.2831  0.3197  1
  Cl  Cl3  12  0.0000  0.0000  0.3425  1
  Cl  Cl4  2  0.0000  0.0000  0.0000  1
]