# generated using pymatgen
data_Li2TeS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.51506732
_cell_length_b   5.39049373
_cell_length_c   7.86950775
_cell_angle_alpha   88.50643025
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TeS3
_chemical_formula_sum   'Li8 Te4 S12'
_cell_volume   488.30932724
_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  0.72864124  0.25912211  0.64557760  1
  Li  Li1  1  0.77135876  0.25912211  0.14557760  1
  Li  Li2  1  0.27135876  0.74087789  0.35442240  1
  Li  Li3  1  0.22864124  0.74087789  0.85442240  1
  Li  Li4  1  0.58684058  0.76041471  0.86958082  1
  Li  Li5  1  0.91315942  0.76041471  0.36958082  1
  Li  Li6  1  0.41315942  0.23958529  0.13041918  1
  Li  Li7  1  0.08684058  0.23958529  0.63041918  1
  Te  Te8  1  0.91316832  0.71905080  0.81672096  1
  Te  Te9  1  0.08683168  0.28094920  0.18327904  1
  Te  Te10  1  0.41316832  0.28094920  0.68327904  1
  Te  Te11  1  0.58683168  0.71905080  0.31672096  1
  S  S12  1  0.40226356  0.71899079  0.63658751  1
  S  S13  1  0.09773644  0.71899079  0.13658751  1
  S  S14  1  0.42706088  0.74506120  0.12998252  1
  S  S15  1  0.57293912  0.25493880  0.87001748  1
  S  S16  1  0.74444263  0.76823057  0.12231853  1
  S  S17  1  0.25555737  0.23176943  0.87768147  1
  S  S18  1  0.59773644  0.28100921  0.36341249  1
  S  S19  1  0.90226356  0.28100921  0.86341249  1
  S  S20  1  0.07293912  0.74506120  0.62998252  1
  S  S21  1  0.92706088  0.25493880  0.37001748  1
  S  S22  1  0.75555737  0.76823057  0.62231853  1
  S  S23  1  0.24444263  0.23176943  0.37768147  1
