data_[Al4Zn2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.9235]
_cell_length_b [7.8436]
_cell_length_c [4.8655]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7267]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Al2ZnAu]
_chemical_formula_sum '[Al4 Zn2 Au2]'
_cell_volume [140.9431]
_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
[
  Al  Al0  4  0.3525  0.5429  0.7232  1
  Zn  Zn1  2  0.1117  0.7500  0.1400  1
  Au  Au2  2  0.2076  0.2500  0.4350  1
]