data_[Zn2Cu3Au2]
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 [P-1]
_cell_length_a [2.7975]
_cell_length_b [6.3364]
_cell_length_c [6.6122]
_cell_angle_alpha [62.1979]
_cell_angle_beta [89.6074]
_cell_angle_gamma [77.4619]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Zn2Cu3Au2]
_chemical_formula_sum '[Zn2 Cu3 Au2]'
_cell_volume [100.6006]
_cell_formula_units_Z [1]
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  2  0.0852  0.8380  0.4242  1.0
  Cu  Cu1  2  0.2979  0.3961  0.7214  1.0
  Cu  Cu2  1  0.0000  0.0000  0.0000  1.0
  Au  Au3  2  0.3669  0.2730  0.1767  1.0
]