data_[Zn20Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.2033]
_cell_length_b [4.7398]
_cell_length_c [7.2587]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.1931]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Zn5Au2]
_chemical_formula_sum '[Zn20 Au8]'
_cell_volume [479.3616]
_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  0.0721  0.1709  0.4238  1.0
  Zn  Zn1  8  0.1932  0.1873  0.7692  1.0
  Zn  Zn2  4  0.0000  0.3316  0.7500  1.0
  Au  Au3  8  0.1234  0.3243  0.0923  1.0
]