The material structure described by In2TeO6 is Hydrophilite-derived structured and crystallizes in the trigonal P321 space group. There are two inequivalent In sites. In the first In site, In(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form InO6 octahedra that share corners with four equivalent Te(2)O6 octahedra, corners with six equivalent In(2)O6 octahedra, and  an edgeedge with one Te(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 50-55°. In the second In site, In(2) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form InO6 octahedra that share corners with two equivalent Te(1)O6 octahedra, corners with six equivalent In(1)O6 octahedra, and edges with two equivalent Te(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 54-55°. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to six equivalent O(1) atoms to form TeO6 octahedra that share corners with six equivalent In(2)O6 octahedra and edges with three equivalent In(1)O6 octahedra. The corner-sharing octahedral tilt angles are 55°. In the second Te site, Te(2) is bonded to three equivalent O(2) and three equivalent O(3) atoms to form TeO6 octahedra that share corners with six equivalent In(1)O6 octahedra and edges with three equivalent In(2)O6 octahedra. The corner-sharing octahedral tilt angles are 50°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one In(1), one In(2), and one Te(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one In(1), one In(2), and one Te(2) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one In(1), one In(2), and one Te(2) atom. is represented by the CIF file [CIF]
data_In2TeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.924
_cell_length_b   8.924
_cell_length_c   4.846
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   334.237
_cell_formula_units_Z   3
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
  In  In0  1  0.630  0.000  1.000  1.0
  In  In1  1  0.000  0.630  0.000  1.0
  In  In2  1  0.370  0.370  1.000  1.0
  In  In3  1  0.293  1.000  0.500  1.0
  In  In4  1  1.000  0.293  0.500  1.0
  In  In5  1  0.707  0.707  0.500  1.0
  Te  Te6  1  0.000  1.000  0.000  1.0
  Te  Te7  1  0.333  0.667  0.510  1.0
  Te  Te8  1  0.667  0.333  0.490  1.0
  O  O9  1  0.086  0.881  0.781  1.0
  O  O10  1  0.119  0.205  0.781  1.0
  O  O11  1  0.795  0.914  0.781  1.0
  O  O12  1  0.205  0.119  0.219  1.0
  O  O13  1  0.914  0.795  0.219  1.0
  O  O14  1  0.881  0.086  0.219  1.0
  O  O15  1  0.460  0.589  0.733  1.0
  O  O16  1  0.411  0.871  0.733  1.0
  O  O17  1  0.129  0.540  0.733  1.0
  O  O18  1  0.871  0.411  0.267  1.0
  O  O19  1  0.540  0.129  0.267  1.0
  O  O20  1  0.589  0.460  0.267  1.0
  O  O21  1  0.220  0.760  0.286  1.0
  O  O22  1  0.240  0.460  0.286  1.0
  O  O23  1  0.540  0.780  0.286  1.0
  O  O24  1  0.460  0.240  0.714  1.0
  O  O25  1  0.780  0.540  0.714  1.0
  O  O26  1  0.760  0.220  0.714  1.0
[/CIF]
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The material structure described by In2TeO6 is Hydrophilite-derived structured and crystallizes in the trigonal P321 space group. There are two inequivalent In sites. In the first In site, In(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form InO6 octahedra that share corners with four equivalent Te(2)O6 octahedra, corners with six equivalent In(2)O6 octahedra, and  an edgeedge with one Te(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 50-55°. In the second In site, In(2) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form InO6 octahedra that share corners with two equivalent Te(1)O6 octahedra, corners with six equivalent In(1)O6 octahedra, and edges with two equivalent Te(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 54-55°. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to six equivalent O(1) atoms to form TeO6 octahedra that share corners with six equivalent In(2)O6 octahedra and edges with three equivalent In(1)O6 octahedra. The corner-sharing octahedral tilt angles are 55°. In the second Te site, Te(2) is bonded to three equivalent O(2) and three equivalent O(3) atoms to form TeO6 octahedra that share corners with six equivalent In(1)O6 octahedra and edges with three equivalent In(2)O6 octahedra. The corner-sharing octahedral tilt angles are 50°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one In(1), one In(2), and one Te(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one In(1), one In(2), and one Te(2) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one In(1), one In(2), and one Te(2) atom. is represented by the CIF file [CIF]
data_In2TeO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.924
_cell_length_b   8.924
_cell_length_c   4.846
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   334.237
_cell_formula_units_Z   3
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
  In  In0  1  0.630  0.000  1.000  1.0
  In  In1  1  0.000  0.630  0.000  1.0
  In  In2  1  0.370  0.370  1.000  1.0
  In  In3  1  0.293  1.000  0.500  1.0
  In  In4  1  1.000  0.293  0.500  1.0
  In  In5  1  0.707  0.707  0.500  1.0
  Te  Te6  1  0.000  1.000  0.000  1.0
  Te  Te7  1  0.333  0.667  0.510  1.0
  Te  Te8  1  0.667  0.333  0.490  1.0
  O  O9  1  0.086  0.881  0.781  1.0
  O  O10  1  0.119  0.205  0.781  1.0
  O  O11  1  0.795  0.914  0.781  1.0
  O  O12  1  0.205  0.119  0.219  1.0
  O  O13  1  0.914  0.795  0.219  1.0
  O  O14  1  0.881  0.086  0.219  1.0
  O  O15  1  0.460  0.589  0.733  1.0
  O  O16  1  0.411  0.871  0.733  1.0
  O  O17  1  0.129  0.540  0.733  1.0
  O  O18  1  0.871  0.411  0.267  1.0
  O  O19  1  0.540  0.129  0.267  1.0
  O  O20  1  0.589  0.460  0.267  1.0
  O  O21  1  0.220  0.760  0.286  1.0
  O  O22  1  0.240  0.460  0.286  1.0
  O  O23  1  0.540  0.780  0.286  1.0
  O  O24  1  0.460  0.240  0.714  1.0
  O  O25  1  0.780  0.540  0.714  1.0
  O  O26  1  0.760  0.220  0.714  1.0
[/CIF]
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