The structure described by Ti2CrIn3O6 crystallizes in the monoclinic C2/m space group. Ti(1) is bonded in a linear geometry to two equivalent O(1) atoms. Cr(1) is bonded in a linear geometry to two equivalent O(2) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form edge-sharing InO6 octahedra. In the second In site, In(2) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form edge-sharing InO6 octahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded to one Ti(1), one In(1), and two equivalent In(2) atoms to form distorted OTiIn3 tetrahedra that share corners with four equivalent O(2)CrIn3 tetrahedra, corners with six equivalent O(1)TiIn3 tetrahedra,  an edgeedge with one O(2)CrIn3 tetrahedra, and edges with two equivalent O(1)TiIn3 tetrahedra. In the second O site, O(2) is bonded to one Cr(1), one In(1), and two equivalent In(2) atoms to form OCrIn3 tetrahedra that share corners with two equivalent O(2)CrIn3 tetrahedra, corners with eight equivalent O(1)TiIn3 tetrahedra,  an edgeedge with one O(2)CrIn3 tetrahedra, and edges with two equivalent O(1)TiIn3 tetrahedra. is represented by the CIF file [CIF]
data_Ti2CrIn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.822
_cell_length_b   5.822
_cell_length_c   6.426
_cell_angle_alpha   81.430
_cell_angle_beta   81.430
_cell_angle_gamma   120.103
_symmetry_Int_Tables_number   1
_cell_volume   179.862
_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
  Ti  Ti0  1  0.168  0.832  0.500  1.0
  Ti  Ti1  1  0.832  0.168  0.500  1.0
  Cr  Cr2  1  0.500  0.500  0.500  1.0
  In  In3  1  0.000  0.000  0.000  1.0
  In  In4  1  0.336  0.664  0.000  1.0
  In  In5  1  0.664  0.336  0.000  1.0
  O  O6  1  0.726  0.064  0.818  1.0
  O  O7  1  0.064  0.726  0.818  1.0
  O  O8  1  0.384  0.384  0.831  1.0
  O  O9  1  0.936  0.274  0.182  1.0
  O  O10  1  0.274  0.936  0.182  1.0
  O  O11  1  0.616  0.616  0.169  1.0
[/CIF]
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The structure described by Ti2CrIn3O6 crystallizes in the monoclinic C2/m space group. Ti(1) is bonded in a linear geometry to two equivalent O(1) atoms. Cr(1) is bonded in a linear geometry to two equivalent O(2) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form edge-sharing InO6 octahedra. In the second In site, In(2) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form edge-sharing InO6 octahedra. There are two inequivalent O sites. In the first O site, O(1) is bonded to one Ti(1), one In(1), and two equivalent In(2) atoms to form distorted OTiIn3 tetrahedra that share corners with four equivalent O(2)CrIn3 tetrahedra, corners with six equivalent O(1)TiIn3 tetrahedra,  an edgeedge with one O(2)CrIn3 tetrahedra, and edges with two equivalent O(1)TiIn3 tetrahedra. In the second O site, O(2) is bonded to one Cr(1), one In(1), and two equivalent In(2) atoms to form OCrIn3 tetrahedra that share corners with two equivalent O(2)CrIn3 tetrahedra, corners with eight equivalent O(1)TiIn3 tetrahedra,  an edgeedge with one O(2)CrIn3 tetrahedra, and edges with two equivalent O(1)TiIn3 tetrahedra. is represented by the CIF file [CIF]
data_Ti2CrIn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.822
_cell_length_b   5.822
_cell_length_c   6.426
_cell_angle_alpha   81.430
_cell_angle_beta   81.430
_cell_angle_gamma   120.103
_symmetry_Int_Tables_number   1
_cell_volume   179.862
_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
  Ti  Ti0  1  0.168  0.832  0.500  1.0
  Ti  Ti1  1  0.832  0.168  0.500  1.0
  Cr  Cr2  1  0.500  0.500  0.500  1.0
  In  In3  1  0.000  0.000  0.000  1.0
  In  In4  1  0.336  0.664  0.000  1.0
  In  In5  1  0.664  0.336  0.000  1.0
  O  O6  1  0.726  0.064  0.818  1.0
  O  O7  1  0.064  0.726  0.818  1.0
  O  O8  1  0.384  0.384  0.831  1.0
  O  O9  1  0.936  0.274  0.182  1.0
  O  O10  1  0.274  0.936  0.182  1.0
  O  O11  1  0.616  0.616  0.169  1.0
[/CIF]
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