# generated using pymatgen
data_Li(TiS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04861960
_cell_length_b   7.04861960
_cell_length_c   5.92328324
_cell_angle_alpha   65.66318787
_cell_angle_beta   65.66318787
_cell_angle_gamma   28.11488743
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li(TiS2)2
_chemical_formula_sum   'Li1 Ti2 S4'
_cell_volume   125.54377792
_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  0.50000000  0.50000000  0.50000000  1
  Ti  Ti1  1  0.24639673  0.24639673  0.75953969  1
  Ti  Ti2  1  0.75360327  0.75360327  0.24046031  1
  S  S3  1  0.36753762  0.36753762  0.96589474  1
  S  S4  1  0.86443859  0.86443859  0.47314480  1
  S  S5  1  0.13556141  0.13556141  0.52685520  1
  S  S6  1  0.63246238  0.63246238  0.03410526  1
