data_In2GeBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06
_cell_length_b   6.06
_cell_length_c   3.42
_cell_angle_alpha   97.07
_cell_angle_beta   97.07
_cell_angle_gamma   118.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2GeBi
_chemical_formula_sum   'In2 Ge1 Bi1'
_cell_volume   106.47
_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  In2  1  0.12  0.39  0.66  1.0
  In  In3  1  0.12  0.61  0.66  1.0
  Ge  Ge1  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.08  0.0  0.0  1.0

data_In2GeBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   6.06
_cell_length_c   6.06
_cell_angle_alpha   118.93
_cell_angle_beta   97.07
_cell_angle_gamma   97.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2GeBi
_chemical_formula_sum   'In2 Ge1 Bi1'
_cell_volume   106.47
_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  0.66  0.12  0.39  1.0
  In  In1  1  0.66  0.12  0.61  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Bi  Bi3  1  0.0  0.08  0.0  1.0

In In Ge Bi
In In Ge Bi 0 1 o o o 2 3 o o o 
In2GeBi crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one In2GeBi cluster. There are two inequivalent In sites. In the first In site, In(1) is bonded in a 1-coordinate geometry to one In(2) atom. The In(1)-In(2) bond length is 1.31 Å. In the second In site, In(2) is bonded in a bent 150 degrees geometry to one In(1) and one Bi(1) atom. The In(2)-Bi(1) bond length is 2.67 Å. Ge(1) is bonded in a single-bond geometry to one Bi(1) atom. The Ge(1)-Bi(1) bond length is 0.46 Å. Bi(1) is bonded in a single-bond geometry to one In(2) and one Ge(1) atom.