data_[Cd2Pb4Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Pb  2.3300  1.8000  1.1225
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.5440]
_cell_length_b [5.7426]
_cell_length_c [12.3410]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.3844]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Cd(PbAu2)2]
_chemical_formula_sum '[Cd2 Pb4 Au8]'
_cell_volume [319.3572]
_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  0.0701  0.7500  0.0339  1
  Pb  Pb1  2  0.1821  0.7500  0.3070  1
  Pb  Pb2  2  0.2989  0.7500  0.6254  1
  Au  Au3  4  0.3933  0.0043  0.8745  1
  Au  Au4  2  0.1411  0.2500  0.2088  1
  Au  Au5  2  0.2608  0.2500  0.5332  1
]