data_[Li2Ga8Au2]
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 [8.9866]
_cell_length_b [4.5038]
_cell_length_c [5.5746]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4269]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiGa4Au]
_chemical_formula_sum '[Li2 Ga8 Au2]'
_cell_volume [217.4981]
_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  0.0000  0.5000  0.5000  1
  Ga  Ga1  4  0.1250  0.0000  0.2569  1
  Ga  Ga2  4  0.1959  0.0000  0.7571  1
  Au  Au3  2  0.0000  0.5000  0.0000  1
]