data_[K12Na20Cd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Na  0.9300  1.8000  1.1600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [14.8745]
_cell_length_b [15.6861]
_cell_length_c [7.3320]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [K3Na5Cd2]
_chemical_formula_sum '[K12 Na20 Cd8]'
_cell_volume [1710.7284]
_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  0.1263  0.2361  0.0000  1
  K  K1  4  0.0000  0.0000  0.2500  1
  Na  Na2  8  0.1172  0.3401  0.5000  1
  Na  Na3  8  0.2416  0.5000  0.2500  1
  Na  Na4  4  0.0000  0.5000  0.2500  1
  Cd  Cd5  8  0.1546  0.1429  0.5000  1
]