data_In2GeTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.9
_cell_length_b   5.9
_cell_length_c   5.91
_cell_angle_alpha   105.31
_cell_angle_beta   105.31
_cell_angle_gamma   33.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2GeTe
_chemical_formula_sum   'In2 Ge1 Te1'
_cell_volume   107.85
_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  In1  1  0.13  0.0  0.04  1.0
  In  In2  1  0.99  0.0  0.4  1.0
  Ge  Ge0  1  0.83  0.0  0.01  1.0
  Te  Te3  1  0.88  0.0  0.07  1.0

data_In2GeTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   5.9
_cell_length_c   5.91
_cell_angle_alpha   105.31
_cell_angle_beta   90.0
_cell_angle_gamma   106.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2GeTe
_chemical_formula_sum   'In2 Ge1 Te1'
_cell_volume   107.85
_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  0.0  0.01  0.6  1.0
  In  In1  1  0.0  0.87  0.96  1.0
  Ge  Ge2  1  0.0  0.17  0.99  1.0
  Te  Te3  1  0.0  0.12  0.93  1.0

In In Ge Te
In In Ge Te 0 3 - o o 0 2 - o o 1 3 o o o 1 2 o o o 2 3 o o o 
In2GeTe crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one In2GeTe cluster. There are two inequivalent In sites. In the first In site, In(1) is bonded in a single-bond geometry to one Te(1) atom. The In(1)-Te(1) bond length is 1.51 Å. In the second In site, In(2) is bonded in a single-bond geometry to one Te(1) atom. The In(2)-Te(1) bond length is 1.85 Å. Ge(1) is bonded in a single-bond geometry to one Te(1) atom. The Ge(1)-Te(1) bond length is 0.42 Å. Te(1) is bonded in a 3-coordinate geometry to one In(1), one In(2), and one Ge(1) atom.