data_[K4Cd12Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.6197]
_cell_length_b [4.6645]
_cell_length_c [9.3766]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.7174]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KCd3Au2]
_chemical_formula_sum '[K4 Cd12 Au8]'
_cell_volume [654.8887]
_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  0.1525  0.0000  0.0899  1.0
  Cd  Cd1  4  0.0158  0.0000  0.3348  1.0
  Cd  Cd2  4  0.1041  0.5000  0.6978  1.0
  Cd  Cd3  4  0.1761  0.5000  0.4400  1.0
  Au  Au4  4  0.0115  0.5000  0.1520  1.0
  Au  Au5  4  0.1745  0.0000  0.6300  1.0
]