data_[Li3Al2Zn2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [P-3m1]
_cell_length_a [4.4215]
_cell_length_b [4.4215]
_cell_length_c [10.6016]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Li3Al2(ZnAu2)2]
_chemical_formula_sum '[Li3 Al2 Zn2 Au4]'
_cell_volume [179.4894]
_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
[
  Li  Li0  2  0.0000  0.0000  0.2667  1.0
  Li  Li1  1  0.0000  0.0000  0.0000  1.0
  Al  Al2  2  0.3333  0.6667  0.4191  1.0
  Zn  Zn3  2  0.3333  0.6667  0.9176  1.0
  Au  Au4  2  0.3333  0.6667  0.1677  1.0
  Au  Au5  2  0.3333  0.6667  0.6590  1.0
]