data_GaBiBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68
_cell_length_b   5.68
_cell_length_c   5.68
_cell_angle_alpha   143.72
_cell_angle_beta   130.05
_cell_angle_gamma   63.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaBiBr
_chemical_formula_sum   'Ga1 Bi1 Br1'
_cell_volume   82.1
_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
  Ga  Ga2  1  0.0  0.0  0.28  1.0
  Bi  Bi0  1  0.0  0.0  0.53  1.0
  Br  Br1  1  0.0  0.0  0.54  1.0

data_GaBiBr
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   4.8
_cell_length_c   5.68
_cell_angle_alpha   114.98
_cell_angle_beta   108.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaBiBr
_chemical_formula_sum   'Ga1 Bi1 Br1'
_cell_volume   82.1
_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
  Ga  Ga0  1  0.0  0.28  0.28  1.0
  Bi  Bi1  1  0.0  0.53  0.53  1.0
  Br  Br2  1  0.0  0.54  0.54  1.0

Ga Bi Br
Ga Bi Br 0 2 o o o 0 1 o o o 1 2 o o o 
GaBiBr is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one GaBiBr cluster. Ga(1) is bonded in a single-bond geometry to one Bi(1) atom. The Ga(1)-Bi(1) bond length is 1.44 Å. Bi(1) is bonded in a distorted single-bond geometry to one Ga(1) and one Br(1) atom. The Bi(1)-Br(1) bond length is 0.09 Å. Br(1) is bonded in a single-bond geometry to one Bi(1) atom.