# generated using pymatgen
data_Li3AuS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76341785
_cell_length_b   6.29217201
_cell_length_c   7.04856730
_cell_angle_alpha   116.50935913
_cell_angle_beta   114.13173633
_cell_angle_gamma   89.99998697
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3AuS2
_chemical_formula_sum   'Li6 Au2 S4'
_cell_volume   203.46958040
_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  1  0.77361780  0.52361780  0.54723559  1.0
  Li  Li1  1  0.22638220  0.97638220  0.45276441  1.0
  Li  Li2  1  0.22638220  0.47638220  0.45276441  1.0
  Li  Li3  1  0.77361780  0.02361780  0.54723559  1.0
  Li  Li4  1  0.50000000  0.75000000  0.00000000  1.0
  Li  Li5  1  0.50000000  0.25000000  0.00000000  1.0
  Au  Au6  1  0.00000000  0.50000000  0.00000000  1.0
  Au  Au7  1  0.00000000  -0.00000000  0.00000000  1.0
  S  S8  1  0.15311705  0.35874412  0.71749024  1.0
  S  S9  1  0.43562781  0.14125588  0.28250976  1.0
  S  S10  1  0.56437219  0.85874412  0.71749024  1.0
  S  S11  1  0.84688295  0.64125588  0.28250976  1.0