data_[Li8Ga8Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.5179]
_cell_length_b [4.5029]
_cell_length_c [7.9879]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0838]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Ga2Au]
_chemical_formula_sum '[Li8 Ga8 Au4]'
_cell_volume [327.2385]
_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
[
  Li  Li0  4  0.0516  0.5000  0.3513  1.0
  Li  Li1  4  0.1653  0.5000  0.0514  1.0
  Ga  Ga2  4  0.0439  0.0000  0.8604  1.0
  Ga  Ga3  4  0.1426  0.0000  0.5699  1.0
  Au  Au4  4  0.2446  0.0000  0.2727  1.0
]