The material described by In2Te3 crystallizes in the orthorhombic Imm2 space group. In(1) is bonded to one Te(2) and three equivalent Te(1) atoms to form corner-sharing InTe4 tetrahedra. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a trigonal non-coplanar geometry to three equivalent In(1) atoms. In the second Te site, Te(2) is bonded in a water-like geometry to two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_In2Te3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.474
_cell_length_b   6.449
_cell_length_c   7.768
_cell_angle_alpha   65.523
_cell_angle_beta   73.263
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   193.509
_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
  In  In0  1  0.505  0.745  0.989  1.0
  In  In1  1  0.828  0.068  0.344  1.0
  Te  Te2  1  0.014  0.038  0.972  1.0
  Te  Te3  1  0.667  0.640  0.667  1.0
  Te  Te4  1  0.319  0.342  0.362  1.0
[/CIF]
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The material described by In2Te3 crystallizes in the orthorhombic Imm2 space group. In(1) is bonded to one Te(2) and three equivalent Te(1) atoms to form corner-sharing InTe4 tetrahedra. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a trigonal non-coplanar geometry to three equivalent In(1) atoms. In the second Te site, Te(2) is bonded in a water-like geometry to two equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_In2Te3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.474
_cell_length_b   6.449
_cell_length_c   7.768
_cell_angle_alpha   65.523
_cell_angle_beta   73.263
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   193.509
_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
  In  In0  1  0.505  0.745  0.989  1.0
  In  In1  1  0.828  0.068  0.344  1.0
  Te  Te2  1  0.014  0.038  0.972  1.0
  Te  Te3  1  0.667  0.640  0.667  1.0
  Te  Te4  1  0.319  0.342  0.362  1.0
[/CIF]
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