# generated using pymatgen
data_Ti2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94525855
_cell_length_b   5.94525855
_cell_length_c   6.03741726
_cell_angle_alpha   80.53890807
_cell_angle_beta   80.53890807
_cell_angle_gamma   119.92062322
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2S3
_chemical_formula_sum   'Ti4 S6'
_cell_volume   174.70125583
_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
  Ti  Ti0  1  0.67301183  0.32698817  -0.00000000  1.0
  Ti  Ti1  1  0.32698817  0.67301183  -0.00000000  1.0
  Ti  Ti2  1  0.00000000  0.00000000  -0.00000000  1.0
  Ti  Ti3  1  0.50000000  0.50000000  0.50000000  1.0
  S  S4  1  0.41772942  0.08291486  0.74419496  1.0
  S  S5  1  0.08291486  0.41772942  0.74419496  1.0
  S  S6  1  0.74883802  0.74883802  0.75383890  1.0
  S  S7  1  0.58227058  0.91708514  0.25580504  1.0
  S  S8  1  0.25116198  0.25116198  0.24616110  1.0
  S  S9  1  0.91708514  0.58227058  0.25580504  1.0