data_[Cd4Ag24Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [8.0037]
_cell_length_b [18.4477]
_cell_length_c [5.1324]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cd(Ag2Au)3]
_chemical_formula_sum '[Cd4 Ag24 Au12]'
_cell_volume [757.8045]
_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  4  0.0000  0.1575  0.4768  1.0
  Ag  Ag1  8  0.1787  0.2712  0.1499  1.0
  Ag  Ag2  8  0.1876  0.4247  0.9717  1.0
  Ag  Ag3  4  0.0000  0.0032  0.7167  1.0
  Ag  Ag4  4  0.0000  0.3074  0.6616  1.0
  Au  Au5  8  0.1785  0.1202  0.9802  1.0
  Au  Au6  4  0.0000  0.4481  0.4560  1.0
]