data_[Li2Ga6Au2]
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 [P2_1/m]
_cell_length_a [5.0651]
_cell_length_b [5.6915]
_cell_length_c [6.6990]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.8984]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiGa3Au]
_chemical_formula_sum '[Li2 Ga6 Au2]'
_cell_volume [182.7084]
_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
[
  Li  Li0  2  0.1095  0.2500  0.3776  1.0
  Ga  Ga1  4  0.4575  0.0018  0.7934  1.0
  Ga  Ga2  2  0.0630  0.2500  0.9317  1.0
  Au  Au3  2  0.3021  0.7500  0.4460  1.0
]