data_[Zn24Cd4Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [11.2408]
_cell_length_b [9.9967]
_cell_length_c [6.4403]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Zn6CdAu3]
_chemical_formula_sum '[Zn24 Cd4 Au12]'
_cell_volume [723.7022]
_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
[
  Zn  Zn0  8  0.1917  0.4544  0.1191  1.0
  Zn  Zn1  8  0.2036  0.1809  0.3123  1.0
  Zn  Zn2  4  0.0000  0.0255  0.1989  1.0
  Zn  Zn3  4  0.0000  0.2829  0.1235  1.0
  Cd  Cd4  4  0.0000  0.2575  0.6051  1.0
  Au  Au5  8  0.1573  0.1178  0.9123  1.0
  Au  Au6  4  0.0000  0.4949  0.8702  1.0
]