data_[Cd2Pd4Au6]
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 [P2_1/m]
_cell_length_a [5.7922]
_cell_length_b [4.8177]
_cell_length_c [7.6554]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.8384]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CdPd2Au3]
_chemical_formula_sum '[Cd2 Pd4 Au6]'
_cell_volume [209.8151]
_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
[
  Cd  Cd0  2  0.3117  0.2500  0.2181  1.0
  Pd  Pd1  2  0.1392  0.2500  0.5520  1.0
  Pd  Pd2  2  0.4715  0.2500  0.8852  1.0
  Au  Au3  2  0.0238  0.7500  0.1149  1.0
  Au  Au4  2  0.1951  0.7500  0.7799  1.0
  Au  Au5  2  0.3575  0.7500  0.4482  1.0
]