The compound described by Li3SbS3 crystallizes in the monoclinic P2_1/c space group. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded in a trigonal planar geometry to one S(1), one S(2), and one S(3) atom. In the second Li site, Li(2) is bonded in a 4-coordinate geometry to one S(1), one S(2), and two equivalent S(3) atoms. In the third Li site, Li(3) is bonded in a distorted see-saw-like geometry to one S(1), one S(3), and two equivalent S(2) atoms. Sb(1) is bonded in a distorted trigonal non-coplanar geometry to one S(1), one S(2), and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), one Li(3), and one Sb(1) atom. In the second S site, S(2) is bonded to one Li(1), one Li(2), two equivalent Li(3), and one Sb(1) atom to form a mixture of distorted corner and edge-sharing SLi4Sb trigonal bipyramids. In the third S site, S(3) is bonded to one Li(1), one Li(3), two equivalent Li(2), and one Sb(1) atom to form a mixture of distorted corner and edge-sharing SLi4Sb trigonal bipyramids. is represented by the CIF file [CIF]
data_Li3SbS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.921
_cell_length_b   6.216
_cell_length_c   8.533
_cell_angle_alpha   50.490
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   610.585
_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  0.646  0.651  0.526  1.0
  Li  Li1  1  0.425  0.958  0.153  1.0
  Li  Li2  1  0.925  0.042  0.347  1.0
  Li  Li3  1  0.146  0.349  0.974  1.0
  Li  Li4  1  0.738  0.016  0.104  1.0
  Li  Li5  1  0.238  0.984  0.396  1.0
  Li  Li6  1  0.762  0.016  0.604  1.0
  Li  Li7  1  0.262  0.984  0.896  1.0
  Li  Li8  1  0.854  0.651  0.026  1.0
  Li  Li9  1  0.075  0.958  0.653  1.0
  Li  Li10  1  0.575  0.042  0.847  1.0
  Li  Li11  1  0.354  0.349  0.474  1.0
  Sb  Sb12  1  0.903  0.311  0.764  1.0
  Sb  Sb13  1  0.403  0.689  0.736  1.0
  Sb  Sb14  1  0.597  0.311  0.264  1.0
  Sb  Sb15  1  0.097  0.689  0.236  1.0
  S  S16  1  0.898  0.911  0.132  1.0
  S  S17  1  0.262  0.742  0.257  1.0
  S  S18  1  0.416  0.256  0.773  1.0
  S  S19  1  0.762  0.258  0.243  1.0
  S  S20  1  0.916  0.744  0.727  1.0
  S  S21  1  0.398  0.089  0.368  1.0
  S  S22  1  0.602  0.911  0.632  1.0
  S  S23  1  0.084  0.256  0.273  1.0
  S  S24  1  0.238  0.742  0.757  1.0
  S  S25  1  0.584  0.744  0.227  1.0
  S  S26  1  0.738  0.258  0.743  1.0
  S  S27  1  0.102  0.089  0.868  1.0
[/CIF]
.
The compound described by Li3SbS3 crystallizes in the monoclinic P2_1/c space group. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded in a trigonal planar geometry to one S(1), one S(2), and one S(3) atom. In the second Li site, Li(2) is bonded in a 4-coordinate geometry to one S(1), one S(2), and two equivalent S(3) atoms. In the third Li site, Li(3) is bonded in a distorted see-saw-like geometry to one S(1), one S(3), and two equivalent S(2) atoms. Sb(1) is bonded in a distorted trigonal non-coplanar geometry to one S(1), one S(2), and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), one Li(3), and one Sb(1) atom. In the second S site, S(2) is bonded to one Li(1), one Li(2), two equivalent Li(3), and one Sb(1) atom to form a mixture of distorted corner and edge-sharing SLi4Sb trigonal bipyramids. In the third S site, S(3) is bonded to one Li(1), one Li(3), two equivalent Li(2), and one Sb(1) atom to form a mixture of distorted corner and edge-sharing SLi4Sb trigonal bipyramids. is represented by the CIF file [CIF]
data_Li3SbS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.921
_cell_length_b   6.216
_cell_length_c   8.533
_cell_angle_alpha   50.490
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   610.585
_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  0.646  0.651  0.526  1.0
  Li  Li1  1  0.425  0.958  0.153  1.0
  Li  Li2  1  0.925  0.042  0.347  1.0
  Li  Li3  1  0.146  0.349  0.974  1.0
  Li  Li4  1  0.738  0.016  0.104  1.0
  Li  Li5  1  0.238  0.984  0.396  1.0
  Li  Li6  1  0.762  0.016  0.604  1.0
  Li  Li7  1  0.262  0.984  0.896  1.0
  Li  Li8  1  0.854  0.651  0.026  1.0
  Li  Li9  1  0.075  0.958  0.653  1.0
  Li  Li10  1  0.575  0.042  0.847  1.0
  Li  Li11  1  0.354  0.349  0.474  1.0
  Sb  Sb12  1  0.903  0.311  0.764  1.0
  Sb  Sb13  1  0.403  0.689  0.736  1.0
  Sb  Sb14  1  0.597  0.311  0.264  1.0
  Sb  Sb15  1  0.097  0.689  0.236  1.0
  S  S16  1  0.898  0.911  0.132  1.0
  S  S17  1  0.262  0.742  0.257  1.0
  S  S18  1  0.416  0.256  0.773  1.0
  S  S19  1  0.762  0.258  0.243  1.0
  S  S20  1  0.916  0.744  0.727  1.0
  S  S21  1  0.398  0.089  0.368  1.0
  S  S22  1  0.602  0.911  0.632  1.0
  S  S23  1  0.084  0.256  0.273  1.0
  S  S24  1  0.238  0.742  0.757  1.0
  S  S25  1  0.584  0.744  0.227  1.0
  S  S26  1  0.738  0.258  0.743  1.0
  S  S27  1  0.102  0.089  0.868  1.0
[/CIF]
.