data_[K16Cd2Au4]
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 [10.6887]
_cell_length_b [15.6154]
_cell_length_c [6.5667]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9545]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K8CdAu2]
_chemical_formula_sum '[K16 Cd2 Au4]'
_cell_volume [1063.6959]
_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  0.1919  0.1336  0.0857  1.0
  K  K1  4  0.0000  0.2452  0.5000  1.0
  K  K2  4  0.1271  0.5000  0.2971  1.0
  Cd  Cd3  2  0.0000  0.0000  0.5000  1.0
  Au  Au4  4  0.0000  0.3199  0.0000  1.0
]