data_[Li2Ge2Au6S8]
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
  Au  2.5400  1.3500  1.0700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4777]
_cell_length_b [7.9049]
_cell_length_c [9.2433]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1778]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiGeAu3S4]
_chemical_formula_sum '[Li2 Ge2 Au6 S8]'
_cell_volume [399.6267]
_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  0.2340  0.7500  0.7310  1
  Ge  Ge1  2  0.2644  0.2500  0.6799  1
  Au  Au2  4  0.2130  0.5756  0.0849  1
  Au  Au3  2  0.2063  0.7500  0.3852  1
  S  S4  4  0.4995  0.5122  0.2829  1
  S  S5  2  0.0518  0.2500  0.0718  1
  S  S6  2  0.1187  0.2500  0.4494  1
]