data_[Zn10Cu4Au10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Cu  1.9000  1.3500  0.8200
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.3887]
_cell_length_b [3.7843]
_cell_length_c [8.9701]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.7893]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn5Cu2Au5]
_chemical_formula_sum '[Zn10 Cu4 Au10]'
_cell_volume [372.0409]
_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
[
  Zn  Zn0  4  0.0834  0.0000  0.7472  1.0
  Zn  Zn1  4  0.2456  0.5000  0.7308  1.0
  Zn  Zn2  2  0.0000  0.0000  0.0000  1.0
  Cu  Cu3  4  0.1727  0.0000  0.5081  1.0
  Au  Au4  4  0.0882  0.5000  0.2600  1.0
  Au  Au5  4  0.1652  0.5000  0.0056  1.0
  Au  Au6  2  0.0000  0.5000  0.5000  1.0
]