data_[Cd32Ag12Au4]
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 [Fmmm]
_cell_length_a [6.7936]
_cell_length_b [9.8753]
_cell_length_c [15.6225]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Cd8Ag3Au]
_chemical_formula_sum '[Cd32 Ag12 Au4]'
_cell_volume [1048.1062]
_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  16  0.0000  0.2497  0.4037  1
  Cd  Cd1  16  0.2492  0.0000  0.8466  1
  Ag  Ag2  8  0.2500  0.2500  0.2500  1
  Ag  Ag3  4  0.0000  0.0000  0.0000  1
  Au  Au4  4  0.0000  0.0000  0.5000  1
]