# generated using pymatgen
data_LiS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.75944595
_cell_length_b   7.75944595
_cell_length_c   7.75944595
_cell_angle_alpha   144.12837251
_cell_angle_beta   144.12837251
_cell_angle_gamma   51.63537380
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiS
_chemical_formula_sum   'Li4 S4'
_cell_volume   159.53202414
_cell_formula_units_Z   4
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  0.72330500  0.72330500  0.00000000  1
  Li  Li1  1  0.27669500  0.27669500  0.00000000  1
  Li  Li2  1  0.00000000  0.50000000  0.50000000  1
  Li  Li3  1  0.50000000  0.00000000  0.50000000  1
  S  S4  1  0.03652800  0.72157600  0.00000000  1
  S  S5  1  0.72157600  0.03652800  0.00000000  1
  S  S6  1  0.96347200  0.96347200  0.68504800  1
  S  S7  1  0.27842400  0.27842400  0.31495200  1
