data_[Li2V2Au6S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  V  1.6300  1.3500  0.7775
  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 [6.0873]
_cell_length_b [7.2471]
_cell_length_c [9.8166]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.7735]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiVAu3S4]
_chemical_formula_sum '[Li2 V2 Au6 S8]'
_cell_volume [423.9549]
_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  0.0393  0.2500  0.5408  1
  V  V1  2  0.1738  0.7500  0.7440  1
  Au  Au2  4  0.1491  0.0626  0.9135  1
  Au  Au3  2  0.3467  0.2500  0.1537  1
  S  S4  4  0.0493  0.0132  0.3220  1
  S  S5  2  0.3372  0.7500  0.9735  1
  S  S6  2  0.4130  0.7500  0.6121  1
]