data_In2OsBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.2
_cell_length_b   5.05
_cell_length_c   5.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2OsBr
_chemical_formula_sum   'In2 Os1 Br1'
_cell_volume   84.28
_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  0.0  0.53  0.61  1.0
  In  In2  1  0.6  0.53  0.0  1.0
  Os  Os3  1  0.6  0.0  0.61  1.0
  Br  Br0  1  0.0  0.0  0.0  1.0

data_In2OsBr
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   5.05
_cell_length_c   5.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2OsBr
_chemical_formula_sum   'In2 Os1 Br1'
_cell_volume   84.28
_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  0.53  0.61  1.0
  In  In1  1  0.6  0.53  -0.0  1.0
  Os  Os2  1  0.6  0.0  0.61  1.0
  Br  Br3  1  0.0  0.0  0.0  1.0

In In Os Br
In In Os Br 0 2 - o o 0 2 - + o 0 2 o o o 0 2 o + o 0 1 - o + 0 1 o o + 0 0 + o o 0 3 o + + 1 3 o o o 1 3 o + o 1 3 + o o 1 3 + + o 1 1 + o o 1 2 o + - 2 3 o o + 2 3 + o + 2 2 + o o 3 3 + o o 
OsIn2Br crystallizes in the triclinic P1 space group. Os(1) is bonded in a 1-coordinate geometry to two equivalent In(2), four equivalent In(1), and two equivalent Br(1) atoms. There is one shorter (3.15 Å) and one longer (3.35 Å) Os(1)-In(2) bond length. There are a spread of Os(1)-In(1) bond distances ranging from 2.72-3.27 Å. There is one shorter (2.41 Å) and one longer (2.81 Å) Os(1)-Br(1) bond length. There are two inequivalent In sites. In the first In site, In(1) is bonded in a 7-coordinate geometry to four equivalent Os(1), three equivalent In(2), and one Br(1) atom. There are a spread of In(1)-In(2) bond distances ranging from 2.41-3.42 Å. The In(1)-Br(1) bond length is 3.15 Å. In the second In site, In(2) is bonded in a 11-coordinate geometry to two equivalent Os(1), two equivalent In(2), three equivalent In(1), and four equivalent Br(1) atoms. Both In(2)-In(2) bond lengths are 3.20 Å. There are a spread of In(2)-Br(1) bond distances ranging from 2.72-3.27 Å. Br(1) is bonded in a 5-coordinate geometry to two equivalent Os(1), one In(1), and four equivalent In(2) atoms.