The compound described by MnInCrS4 is Spinel-derived structured and crystallizes in the orthorhombic Imma 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 Mn(1)S4 tetrahedra, edges with two equivalent Cr(1)S6 octahedra, and edges with four equivalent In(1)S6 octahedra. Mn(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form MnS4 tetrahedra that share corners with six equivalent Cr(1)S6 octahedra and corners with six equivalent In(1)S6 octahedra. The corner-sharing octahedral tilt angles range from 51-63°. In(1) is bonded to two equivalent S(2) and four equivalent S(1) atoms to form InS6 octahedra that share corners with six equivalent Mn(1)S4 tetrahedra, edges with two equivalent In(1)S6 octahedra, and edges with four equivalent Cr(1)S6 octahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a rectangular see-saw-like geometry to one Cr(1), one Mn(1), and two equivalent In(1) atoms. In the second S site, S(2) is bonded in a rectangular see-saw-like geometry to two equivalent Cr(1), one Mn(1), and one In(1) atom. is represented by the CIF file [CIF]
data_MnCrInS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.411
_cell_length_b   7.411
_cell_length_c   7.411
_cell_angle_alpha   120.595
_cell_angle_beta   119.685
_cell_angle_gamma   89.760
_symmetry_Int_Tables_number   1
_cell_volume   287.228
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.377  0.627  0.750  1.0
  Mn  Mn1  1  0.623  0.373  0.250  1.0
  Cr  Cr2  1  0.000  0.000  0.500  1.0
  Cr  Cr3  1  0.000  0.500  0.000  1.0
  In  In4  1  0.000  0.000  0.000  1.0
  In  In5  1  0.500  0.000  0.500  1.0
  S  S6  1  0.233  0.736  0.003  1.0
  S  S7  1  0.233  0.230  0.497  1.0
  S  S8  1  0.222  0.749  0.472  1.0
  S  S9  1  0.777  0.749  0.028  1.0
  S  S10  1  0.767  0.264  0.997  1.0
  S  S11  1  0.767  0.770  0.503  1.0
  S  S12  1  0.778  0.251  0.528  1.0
  S  S13  1  0.223  0.251  0.972  1.0
[/CIF]
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The compound described by MnInCrS4 is Spinel-derived structured and crystallizes in the orthorhombic Imma 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 Mn(1)S4 tetrahedra, edges with two equivalent Cr(1)S6 octahedra, and edges with four equivalent In(1)S6 octahedra. Mn(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form MnS4 tetrahedra that share corners with six equivalent Cr(1)S6 octahedra and corners with six equivalent In(1)S6 octahedra. The corner-sharing octahedral tilt angles range from 51-63°. In(1) is bonded to two equivalent S(2) and four equivalent S(1) atoms to form InS6 octahedra that share corners with six equivalent Mn(1)S4 tetrahedra, edges with two equivalent In(1)S6 octahedra, and edges with four equivalent Cr(1)S6 octahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a rectangular see-saw-like geometry to one Cr(1), one Mn(1), and two equivalent In(1) atoms. In the second S site, S(2) is bonded in a rectangular see-saw-like geometry to two equivalent Cr(1), one Mn(1), and one In(1) atom. is represented by the CIF file [CIF]
data_MnCrInS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.411
_cell_length_b   7.411
_cell_length_c   7.411
_cell_angle_alpha   120.595
_cell_angle_beta   119.685
_cell_angle_gamma   89.760
_symmetry_Int_Tables_number   1
_cell_volume   287.228
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.377  0.627  0.750  1.0
  Mn  Mn1  1  0.623  0.373  0.250  1.0
  Cr  Cr2  1  0.000  0.000  0.500  1.0
  Cr  Cr3  1  0.000  0.500  0.000  1.0
  In  In4  1  0.000  0.000  0.000  1.0
  In  In5  1  0.500  0.000  0.500  1.0
  S  S6  1  0.233  0.736  0.003  1.0
  S  S7  1  0.233  0.230  0.497  1.0
  S  S8  1  0.222  0.749  0.472  1.0
  S  S9  1  0.777  0.749  0.028  1.0
  S  S10  1  0.767  0.264  0.997  1.0
  S  S11  1  0.767  0.770  0.503  1.0
  S  S12  1  0.778  0.251  0.528  1.0
  S  S13  1  0.223  0.251  0.972  1.0
[/CIF]
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