# generated using pymatgen
data_Sr(TiS2)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85381448
_cell_length_b   6.85381476
_cell_length_c   13.25590146
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999383
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr(TiS2)8
_chemical_formula_sum   'Sr1 Ti8 S16'
_cell_volume   539.26797817
_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
  Sr  Sr0  1  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.50178210  0.49821790  0.72330472  1.0
  Ti  Ti2  1  0.49821790  0.50178210  0.27669528  1.0
  Ti  Ti3  1  0.50178210  0.00356319  0.72330472  1.0
  Ti  Ti4  1  0.49821790  0.99643681  0.27669528  1.0
  Ti  Ti5  1  0.99643681  0.49821790  0.72330472  1.0
  Ti  Ti6  1  0.00356319  0.50178210  0.27669528  1.0
  Ti  Ti7  1  0.00000000  0.00000000  0.71952915  1.0
  Ti  Ti8  1  0.00000000  0.00000000  0.28047085  1.0
  S  S9  1  0.83302611  0.66605422  0.16798434  1.0
  S  S10  1  0.83288167  0.66576435  0.61742422  1.0
  S  S11  1  0.83302611  0.16697389  0.16798434  1.0
  S  S12  1  0.83288167  0.16711833  0.61742422  1.0
  S  S13  1  0.33333300  0.66666700  0.16770638  1.0
  S  S14  1  0.33333300  0.66666700  0.62005123  1.0
  S  S15  1  0.33394578  0.16697389  0.16798434  1.0
  S  S16  1  0.33423565  0.16711833  0.61742422  1.0
  S  S17  1  0.66605422  0.83302611  0.83201566  1.0
  S  S18  1  0.66576435  0.83288167  0.38257578  1.0
  S  S19  1  0.66666700  0.33333300  0.83229362  1.0
  S  S20  1  0.66666700  0.33333300  0.37994877  1.0
  S  S21  1  0.16697389  0.83302611  0.83201566  1.0
  S  S22  1  0.16711833  0.83288167  0.38257578  1.0
  S  S23  1  0.16697389  0.33394578  0.83201566  1.0
  S  S24  1  0.16711833  0.33423565  0.38257578  1.0