data_[Cd8Pd16Au24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Fddd]
_cell_length_a [5.7853]
_cell_length_b [8.2870]
_cell_length_c [17.3883]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [70]
_chemical_formula_structural [CdPd2Au3]
_chemical_formula_sum '[Cd8 Pd16 Au24]'
_cell_volume [833.6417]
_cell_formula_units_Z [8]
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  0.0000  0.0000  0.5000  1
  Pd  Pd1  16  0.0000  0.0000  0.3320  1
  Au  Au2  16  0.0000  0.0000  0.1651  1
  Au  Au3  8  0.0000  0.0000  0.0000  1
]