The compound described by LiSH crystallizes in the orthorhombic Pmc2_1 space group. Li(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form a mixture of corner and edge-sharing LiS4 tetrahedra. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one S(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded to four equivalent Li(1) and one H(1) atom to form a mixture of distorted corner and edge-sharing SLi4H square pyramids. In the second S site, S(2) is bonded to four equivalent Li(1) and one H(2) atom to form a mixture of distorted corner and edge-sharing SLi4H square pyramids. is represented by the CIF file [CIF]
data_LiHS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.101
_cell_length_b   3.923
_cell_length_c   7.833
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   187.496
_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  0.250  0.497  0.249  1.0
  Li  Li1  1  0.750  0.497  0.249  1.0
  Li  Li2  1  0.750  0.503  0.749  1.0
  Li  Li3  1  0.250  0.503  0.749  1.0
  H  H4  1  0.000  0.011  0.934  1.0
  H  H5  1  0.000  0.989  0.434  1.0
  H  H6  1  0.500  0.875  0.499  1.0
  H  H7  1  0.500  0.125  0.999  1.0
  S  S8  1  0.000  0.003  0.763  1.0
  S  S9  1  0.000  0.997  0.263  1.0
  S  S10  1  0.500  0.533  0.500  1.0
  S  S11  1  0.500  0.467  1.000  1.0
[/CIF]
.
The compound described by LiSH crystallizes in the orthorhombic Pmc2_1 space group. Li(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form a mixture of corner and edge-sharing LiS4 tetrahedra. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one S(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded to four equivalent Li(1) and one H(1) atom to form a mixture of distorted corner and edge-sharing SLi4H square pyramids. In the second S site, S(2) is bonded to four equivalent Li(1) and one H(2) atom to form a mixture of distorted corner and edge-sharing SLi4H square pyramids. is represented by the CIF file [CIF]
data_LiHS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.101
_cell_length_b   3.923
_cell_length_c   7.833
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   187.496
_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  0.250  0.497  0.249  1.0
  Li  Li1  1  0.750  0.497  0.249  1.0
  Li  Li2  1  0.750  0.503  0.749  1.0
  Li  Li3  1  0.250  0.503  0.749  1.0
  H  H4  1  0.000  0.011  0.934  1.0
  H  H5  1  0.000  0.989  0.434  1.0
  H  H6  1  0.500  0.875  0.499  1.0
  H  H7  1  0.500  0.125  0.999  1.0
  S  S8  1  0.000  0.003  0.763  1.0
  S  S9  1  0.000  0.997  0.263  1.0
  S  S10  1  0.500  0.533  0.500  1.0
  S  S11  1  0.500  0.467  1.000  1.0
[/CIF]
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