data_[Li6Ag4Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.1079]
_cell_length_b [4.0857]
_cell_length_c [8.5707]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7619]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3(AgAu2)2]
_chemical_formula_sum '[Li6 Ag4 Au8]'
_cell_volume [300.1532]
_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  4  0.1585  0.5000  0.5600  1.0
  Li  Li1  2  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  4  0.1724  0.5000  0.2304  1.0
  Au  Au3  4  0.0117  0.0000  0.3412  1.0
  Au  Au4  4  0.1649  0.5000  0.8878  1.0
]