data_[Li6Ge3Bi3Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ge  2.0100  1.2500  0.7700
  Bi  2.0200  1.6000  1.0350
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.6605]
_cell_length_b [4.6605]
_cell_length_c [23.9424]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Li2GeBiAu4]
_chemical_formula_sum '[Li6 Ge3 Bi3 Au12]'
_cell_volume [450.3562]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.2482  1.0
  Ge  Ge1  3  -0.0000  -0.0000  0.5000  1.0
  Bi  Bi2  3  0.0000  0.0000  0.0000  1.0
  Au  Au3  6  0.0000  0.0000  0.1313  1.0
  Au  Au4  6  0.0000  0.0000  0.3893  1.0
]