The structure described by Cr3In(CoS4)2 is Spinel-derived structured and crystallizes in the trigonal R-3m space group. Cr(1) is bonded to two equivalent S(1) and four equivalent S(2) atoms to form CrS6 octahedra that share corners with six equivalent Co(1)S4 tetrahedra, edges with two equivalent In(1)S6 octahedra, and edges with four equivalent Cr(1)S6 octahedra. Co(1) is bonded to one S(1) and three equivalent S(2) atoms to form CoS4 tetrahedra that share corners with three equivalent In(1)S6 octahedra and corners with nine equivalent Cr(1)S6 octahedra. The corner-sharing octahedral tilt angles range from 54-62°. In(1) is bonded to six equivalent S(2) atoms to form InS6 octahedra that share corners with six equivalent Co(1)S4 tetrahedra and edges with six equivalent Cr(1)S6 octahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a distorted rectangular see-saw-like geometry to three equivalent Cr(1) and one Co(1) atom. In the second S site, S(2) is bonded in a rectangular see-saw-like geometry to two equivalent Cr(1), one Co(1), and one In(1) atom. is represented by the CIF file [CIF]
data_Cr3In(CoS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.168
_cell_length_b   7.168
_cell_length_c   7.168
_cell_angle_alpha   59.364
_cell_angle_beta   59.364
_cell_angle_gamma   59.364
_symmetry_Int_Tables_number   1
_cell_volume   256.632
_cell_formula_units_Z   1
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
  Cr  Cr0  1  0.000  0.500  0.500  1.0
  Cr  Cr1  1  0.500  0.500  0.000  1.0
  Cr  Cr2  1  0.500  0.000  0.500  1.0
  In  In3  1  0.500  0.500  0.500  1.0
  Co  Co4  1  0.126  0.126  0.126  1.0
  Co  Co5  1  0.874  0.874  0.874  1.0
  S  S6  1  0.258  0.258  0.258  1.0
  S  S7  1  0.735  0.244  0.244  1.0
  S  S8  1  0.244  0.244  0.735  1.0
  S  S9  1  0.244  0.735  0.244  1.0
  S  S10  1  0.742  0.742  0.742  1.0
  S  S11  1  0.265  0.756  0.756  1.0
  S  S12  1  0.756  0.756  0.265  1.0
  S  S13  1  0.756  0.265  0.756  1.0
[/CIF]
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The structure described by Cr3In(CoS4)2 is Spinel-derived structured and crystallizes in the trigonal R-3m space group. Cr(1) is bonded to two equivalent S(1) and four equivalent S(2) atoms to form CrS6 octahedra that share corners with six equivalent Co(1)S4 tetrahedra, edges with two equivalent In(1)S6 octahedra, and edges with four equivalent Cr(1)S6 octahedra. Co(1) is bonded to one S(1) and three equivalent S(2) atoms to form CoS4 tetrahedra that share corners with three equivalent In(1)S6 octahedra and corners with nine equivalent Cr(1)S6 octahedra. The corner-sharing octahedral tilt angles range from 54-62°. In(1) is bonded to six equivalent S(2) atoms to form InS6 octahedra that share corners with six equivalent Co(1)S4 tetrahedra and edges with six equivalent Cr(1)S6 octahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a distorted rectangular see-saw-like geometry to three equivalent Cr(1) and one Co(1) atom. In the second S site, S(2) is bonded in a rectangular see-saw-like geometry to two equivalent Cr(1), one Co(1), and one In(1) atom. is represented by the CIF file [CIF]
data_Cr3In(CoS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.168
_cell_length_b   7.168
_cell_length_c   7.168
_cell_angle_alpha   59.364
_cell_angle_beta   59.364
_cell_angle_gamma   59.364
_symmetry_Int_Tables_number   1
_cell_volume   256.632
_cell_formula_units_Z   1
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
  Cr  Cr0  1  0.000  0.500  0.500  1.0
  Cr  Cr1  1  0.500  0.500  0.000  1.0
  Cr  Cr2  1  0.500  0.000  0.500  1.0
  In  In3  1  0.500  0.500  0.500  1.0
  Co  Co4  1  0.126  0.126  0.126  1.0
  Co  Co5  1  0.874  0.874  0.874  1.0
  S  S6  1  0.258  0.258  0.258  1.0
  S  S7  1  0.735  0.244  0.244  1.0
  S  S8  1  0.244  0.244  0.735  1.0
  S  S9  1  0.244  0.735  0.244  1.0
  S  S10  1  0.742  0.742  0.742  1.0
  S  S11  1  0.265  0.756  0.756  1.0
  S  S12  1  0.756  0.756  0.265  1.0
  S  S13  1  0.756  0.265  0.756  1.0
[/CIF]
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