# generated using pymatgen
data_LiTiS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11210829
_cell_length_b   7.11210829
_cell_length_c   7.11210829
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiS2
_chemical_formula_sum   'Li4 Ti4 S8'
_cell_volume   254.37831369
_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  0.12500000  0.12500000  0.12500000  1.0
  Li  Li1  1  0.62500000  0.12500000  0.12500000  1.0
  Li  Li2  1  0.12500000  0.62500000  0.12500000  1.0
  Li  Li3  1  0.12500000  0.12500000  0.62500000  1.0
  Ti  Ti4  1  0.62500000  0.62500000  0.12500000  1.0
  Ti  Ti5  1  0.62500000  0.62500000  0.62500000  1.0
  Ti  Ti6  1  0.62500000  0.12500000  0.62500000  1.0
  Ti  Ti7  1  0.12500000  0.62500000  0.62500000  1.0
  S  S8  1  0.87217700  0.38346800  0.87217700  1.0
  S  S9  1  0.87217700  0.87217700  0.38346800  1.0
  S  S10  1  0.87217700  0.87217700  0.87217700  1.0
  S  S11  1  0.38346800  0.87217700  0.87217700  1.0
  S  S12  1  0.37782300  0.37782300  0.37782300  1.0
  S  S13  1  0.86653200  0.37782300  0.37782300  1.0
  S  S14  1  0.37782300  0.86653200  0.37782300  1.0
  S  S15  1  0.37782300  0.37782300  0.86653200  1.0