# generated using pymatgen
data_Li3(TiS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86575083
_cell_length_b   6.86575097
_cell_length_c   8.57167195
_cell_angle_alpha   53.25463011
_cell_angle_beta   53.25462758
_cell_angle_gamma   60.01674632
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3(TiS2)4
_chemical_formula_sum   'Li3 Ti4 S8'
_cell_volume   253.02976616
_cell_formula_units_Z   1
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  0.00000000  0.50000000  0.50000000  1.0
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1.0
  Li  Li2  1  0.50000000  0.50000000  0.50000000  1.0
  Ti  Ti3  1  0.75578567  0.24421433  0.00000000  1.0
  Ti  Ti4  1  0.24421433  0.75578567  1.00000000  1.0
  Ti  Ti5  1  0.24569002  0.24569002  0.00553839  1.0
  Ti  Ti6  1  0.75430998  0.75430998  0.99446161  1.0
  S  S7  1  0.96608430  0.46904765  0.23232753  1.0
  S  S8  1  0.46904765  0.96608430  0.23232753  1.0
  S  S9  1  0.46755045  0.46755045  0.23290976  1.0
  S  S10  1  0.96479260  0.96479260  0.23799986  1.0
  S  S11  1  0.03520740  0.03520740  0.76200014  1.0
  S  S12  1  0.53244955  0.53244955  0.76709024  1.0
  S  S13  1  0.53095235  0.03391570  0.76767247  1.0
  S  S14  1  0.03391570  0.53095235  0.76767247  1.0