data_[Cd8Au20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.4555]
_cell_length_b [5.0534]
_cell_length_c [7.7632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.8613]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Cd2Au5]
_chemical_formula_sum '[Cd8 Au20]'
_cell_volume [526.6706]
_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
[
  Cd  Cd0  8  0.0761  0.3180  0.1050  1.0
  Au  Au1  8  0.1425  0.1791  0.4629  1.0
  Au  Au2  8  0.2128  0.3208  0.8186  1.0
  Au  Au3  4  0.0000  0.1764  0.7500  1.0
]