The material structure described by Li(CrS2)2 crystallizes in the orthorhombic Pnma space group. Li(1) is bonded to one S(3), two equivalent S(1), and two equivalent S(2) atoms to form LiS5 trigonal bipyramids that share corners with six equivalent Cr(1)S6 octahedra, corners with three equivalent Cr(2)S4 tetrahedra, corners with two equivalent Li(1)S5 trigonal bipyramids, and  an edgeedge with one Cr(2)S4 tetrahedra. The corner-sharing octahedral tilt angles range from 29-43°. There are two inequivalent Cr sites. In the first Cr site, Cr(1) is bonded to two equivalent S(3) and four equivalent S(1) atoms to form distorted CrS6 octahedra that share  a cornercorner with one Cr(2)S4 tetrahedra, corners with six equivalent Li(1)S5 trigonal bipyramids,  an edgeedge with one Cr(2)S4 tetrahedra, faces with two equivalent Cr(1)S6 octahedra, and  a faceface with one Cr(2)S4 tetrahedra. In the second Cr site, Cr(2) is bonded to one S(2), one S(3), and two equivalent S(1) atoms to form distorted CrS4 tetrahedra that share  a cornercorner with one Cr(1)S6 octahedra, corners with three equivalent Li(1)S5 trigonal bipyramids,  an edgeedge with one Cr(1)S6 octahedra,  an edgeedge with one Li(1)S5 trigonal bipyramid, and  a faceface with one Cr(1)S6 octahedra. The corner-sharing octahedral tilt angles are 46°. 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 Cr(2), and two equivalent Cr(1) atoms. In the second S site, S(2) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one Cr(2) atom. In the third S site, S(3) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Cr(2), and two equivalent Cr(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li(CrS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.408
_cell_length_b   8.150
_cell_length_c   12.931
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   569.912
_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  0.231  0.250  0.397  1.0
  Li  Li1  1  0.769  0.750  0.603  1.0
  Li  Li2  1  0.269  0.750  0.897  1.0
  Li  Li3  1  0.731  0.250  0.103  1.0
  Cr  Cr4  1  0.022  0.750  0.268  1.0
  Cr  Cr5  1  0.978  0.250  0.732  1.0
  Cr  Cr6  1  0.478  0.250  0.768  1.0
  Cr  Cr7  1  0.522  0.750  0.232  1.0
  Cr  Cr8  1  0.134  0.250  0.924  1.0
  Cr  Cr9  1  0.866  0.750  0.076  1.0
  Cr  Cr10  1  0.366  0.750  0.424  1.0
  Cr  Cr11  1  0.634  0.250  0.576  1.0
  S  S12  1  0.220  0.455  0.822  1.0
  S  S13  1  0.780  0.545  0.178  1.0
  S  S14  1  0.280  0.545  0.322  1.0
  S  S15  1  0.720  0.455  0.678  1.0
  S  S16  1  0.720  0.045  0.678  1.0
  S  S17  1  0.280  0.955  0.322  1.0
  S  S18  1  0.780  0.955  0.178  1.0
  S  S19  1  0.220  0.045  0.822  1.0
  S  S20  1  0.740  0.250  0.421  1.0
  S  S21  1  0.260  0.750  0.579  1.0
  S  S22  1  0.760  0.750  0.921  1.0
  S  S23  1  0.240  0.250  0.079  1.0
  S  S24  1  0.261  0.750  0.093  1.0
  S  S25  1  0.739  0.250  0.907  1.0
  S  S26  1  0.239  0.250  0.593  1.0
  S  S27  1  0.761  0.750  0.407  1.0
[/CIF]
.
The material structure described by Li(CrS2)2 crystallizes in the orthorhombic Pnma space group. Li(1) is bonded to one S(3), two equivalent S(1), and two equivalent S(2) atoms to form LiS5 trigonal bipyramids that share corners with six equivalent Cr(1)S6 octahedra, corners with three equivalent Cr(2)S4 tetrahedra, corners with two equivalent Li(1)S5 trigonal bipyramids, and  an edgeedge with one Cr(2)S4 tetrahedra. The corner-sharing octahedral tilt angles range from 29-43°. There are two inequivalent Cr sites. In the first Cr site, Cr(1) is bonded to two equivalent S(3) and four equivalent S(1) atoms to form distorted CrS6 octahedra that share  a cornercorner with one Cr(2)S4 tetrahedra, corners with six equivalent Li(1)S5 trigonal bipyramids,  an edgeedge with one Cr(2)S4 tetrahedra, faces with two equivalent Cr(1)S6 octahedra, and  a faceface with one Cr(2)S4 tetrahedra. In the second Cr site, Cr(2) is bonded to one S(2), one S(3), and two equivalent S(1) atoms to form distorted CrS4 tetrahedra that share  a cornercorner with one Cr(1)S6 octahedra, corners with three equivalent Li(1)S5 trigonal bipyramids,  an edgeedge with one Cr(1)S6 octahedra,  an edgeedge with one Li(1)S5 trigonal bipyramid, and  a faceface with one Cr(1)S6 octahedra. The corner-sharing octahedral tilt angles are 46°. 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 Cr(2), and two equivalent Cr(1) atoms. In the second S site, S(2) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one Cr(2) atom. In the third S site, S(3) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Cr(2), and two equivalent Cr(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li(CrS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.408
_cell_length_b   8.150
_cell_length_c   12.931
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   569.912
_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  0.231  0.250  0.397  1.0
  Li  Li1  1  0.769  0.750  0.603  1.0
  Li  Li2  1  0.269  0.750  0.897  1.0
  Li  Li3  1  0.731  0.250  0.103  1.0
  Cr  Cr4  1  0.022  0.750  0.268  1.0
  Cr  Cr5  1  0.978  0.250  0.732  1.0
  Cr  Cr6  1  0.478  0.250  0.768  1.0
  Cr  Cr7  1  0.522  0.750  0.232  1.0
  Cr  Cr8  1  0.134  0.250  0.924  1.0
  Cr  Cr9  1  0.866  0.750  0.076  1.0
  Cr  Cr10  1  0.366  0.750  0.424  1.0
  Cr  Cr11  1  0.634  0.250  0.576  1.0
  S  S12  1  0.220  0.455  0.822  1.0
  S  S13  1  0.780  0.545  0.178  1.0
  S  S14  1  0.280  0.545  0.322  1.0
  S  S15  1  0.720  0.455  0.678  1.0
  S  S16  1  0.720  0.045  0.678  1.0
  S  S17  1  0.280  0.955  0.322  1.0
  S  S18  1  0.780  0.955  0.178  1.0
  S  S19  1  0.220  0.045  0.822  1.0
  S  S20  1  0.740  0.250  0.421  1.0
  S  S21  1  0.260  0.750  0.579  1.0
  S  S22  1  0.760  0.750  0.921  1.0
  S  S23  1  0.240  0.250  0.079  1.0
  S  S24  1  0.261  0.750  0.093  1.0
  S  S25  1  0.739  0.250  0.907  1.0
  S  S26  1  0.239  0.250  0.593  1.0
  S  S27  1  0.761  0.750  0.407  1.0
[/CIF]
.