data_InTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11
_cell_length_b   7.11
_cell_length_c   7.11
_cell_angle_alpha   105.15
_cell_angle_beta   105.15
_cell_angle_gamma   118.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InTe
_chemical_formula_sum   'In4 Te4'
_cell_volume   271.3
_cell_formula_units_Z   4
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  0.0  0.0  0.45  1.0
  In  In1  1  0.0  0.0  0.82  1.0
  In  In2  1  0.0  0.32  0.82  1.0
  In  In3  1  0.32  0.0  0.82  1.0
  Te  Te4  1  0.88  0.56  0.0  1.0
  Te  Te5  1  0.44  0.76  0.63  1.0
  Te  Te6  1  0.76  0.56  0.63  1.0
  Te  Te7  1  0.56  0.76  0.0  1.0

data_InTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.11
_cell_length_b   7.11
_cell_length_c   7.11
_cell_angle_alpha   105.15
_cell_angle_beta   105.15
_cell_angle_gamma   118.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InTe
_chemical_formula_sum   'In4 Te4'
_cell_volume   271.3
_cell_formula_units_Z   4
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  0.45  0.45  0.45  1.0
  In  In1  1  0.5  0.82  0.82  1.0
  In  In2  1  0.82  0.5  0.82  1.0
  In  In3  1  0.82  0.82  0.82  1.0
  Te  Te4  1  0.12  0.44  0.0  1.0
  Te  Te5  1  0.2  0.88  0.63  1.0
  Te  Te6  1  0.44  0.24  0.0  1.0
  Te  Te7  1  0.88  0.07  0.63  1.0

In In In In Te Te Te Te
InTe crystallizes in the triclinic P1 space group. There are four inequivalent In sites. In the first In site, In(1) is bonded in a 6-coordinate geometry to one In(2), one In(3), one In(4), one Te(1), one Te(3), and one Te(4) atom. The In(1)-In(2) bond length is 2.60 Å. The In(1)-In(3) bond length is 2.98 Å. The In(1)-In(4) bond length is 2.98 Å. The In(1)-Te(1) bond length is 3.40 Å. The In(1)-Te(3) bond length is 3.53 Å. The In(1)-Te(4) bond length is 3.10 Å. In the second In site, In(2) is bonded in a 1-coordinate geometry to one In(1) and one Te(3) atom. The In(2)-Te(3) bond length is 2.42 Å. In the third In site, In(3) is bonded in a 1-coordinate geometry to one In(1), one Te(1), and one Te(4) atom. The In(3)-Te(1) bond length is 2.47 Å. The In(3)-Te(4) bond length is 3.27 Å. In the fourth In site, In(4) is bonded in a 1-coordinate geometry to one In(1), one Te(2), and one Te(4) atom. The In(4)-Te(2) bond length is 2.47 Å. The In(4)-Te(4) bond length is 3.25 Å. There are four inequivalent Te sites. In the first Te site, Te(1) is bonded in a 1-coordinate geometry to one In(1), one In(3), and one Te(4) atom. The Te(1)-Te(4) bond length is 3.16 Å. In the second Te site, Te(2) is bonded in a 1-coordinate geometry to one In(4) and one Te(4) atom. The Te(2)-Te(4) bond length is 2.52 Å. In the third Te site, Te(3) is bonded in a distorted single-bond geometry to one In(1) and one In(2) atom. In the fourth Te site, Te(4) is bonded in a 5-coordinate geometry to one In(1), one In(3), one In(4), one Te(1), and one Te(2) atom.