The crystal structure described by LiCuS crystallizes in the orthorhombic Fddd space group. Li(1) is bonded to four equivalent S(1) atoms to form a mixture of distorted edge and corner-sharing LiS4 tetrahedra. Cu(1) is bonded in a linear geometry to two equivalent S(1) atoms. S(1) is bonded to four equivalent Li(1) and two equivalent Cu(1) atoms to form a mixture of distorted edge and corner-sharing SLi4Cu2 octahedra. The corner-sharing octahedral tilt angles range from 0-68°. is represented by the CIF card [CIF]
data_LiCuS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.990
_cell_length_b   6.945
_cell_length_c   5.994
_cell_angle_alpha   64.913
_cell_angle_beta   64.140
_cell_angle_gamma   50.947
_symmetry_Int_Tables_number   1
_cell_volume   198.652
_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  0.638  0.638  0.362  1.0
  Li  Li1  1  0.888  0.888  0.612  1.0
  Li  Li2  1  0.362  0.362  0.638  1.0
  Li  Li3  1  0.612  0.612  0.888  1.0
  Cu  Cu4  1  0.625  0.125  0.125  1.0
  Cu  Cu5  1  0.125  0.125  0.125  1.0
  Cu  Cu6  1  0.125  0.625  0.125  1.0
  Cu  Cu7  1  0.125  0.125  0.625  1.0
  S  S8  1  0.977  0.523  0.977  1.0
  S  S9  1  0.523  0.977  0.523  1.0
  S  S10  1  0.273  0.727  0.273  1.0
  S  S11  1  0.727  0.273  0.727  1.0
[/CIF]
.
The crystal structure described by LiCuS crystallizes in the orthorhombic Fddd space group. Li(1) is bonded to four equivalent S(1) atoms to form a mixture of distorted edge and corner-sharing LiS4 tetrahedra. Cu(1) is bonded in a linear geometry to two equivalent S(1) atoms. S(1) is bonded to four equivalent Li(1) and two equivalent Cu(1) atoms to form a mixture of distorted edge and corner-sharing SLi4Cu2 octahedra. The corner-sharing octahedral tilt angles range from 0-68°. is represented by the CIF card [CIF]
data_LiCuS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.990
_cell_length_b   6.945
_cell_length_c   5.994
_cell_angle_alpha   64.913
_cell_angle_beta   64.140
_cell_angle_gamma   50.947
_symmetry_Int_Tables_number   1
_cell_volume   198.652
_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  0.638  0.638  0.362  1.0
  Li  Li1  1  0.888  0.888  0.612  1.0
  Li  Li2  1  0.362  0.362  0.638  1.0
  Li  Li3  1  0.612  0.612  0.888  1.0
  Cu  Cu4  1  0.625  0.125  0.125  1.0
  Cu  Cu5  1  0.125  0.125  0.125  1.0
  Cu  Cu6  1  0.125  0.625  0.125  1.0
  Cu  Cu7  1  0.125  0.125  0.625  1.0
  S  S8  1  0.977  0.523  0.977  1.0
  S  S9  1  0.523  0.977  0.523  1.0
  S  S10  1  0.273  0.727  0.273  1.0
  S  S11  1  0.727  0.273  0.727  1.0
[/CIF]
.