The structure described by BSBr is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four cyclo-1,3,5-trithia-2,4,6-triborane, 2,4,6-tribromo- molecules. There are three inequivalent B sites. In the first B site, B(1) is bonded in a trigonal planar geometry to one S(1), one S(2), and one Br(1) atom. In the second B site, B(2) is bonded in a trigonal planar geometry to one S(1), one S(3), and one Br(2) atom. In the third B site, B(3) is bonded in a trigonal planar geometry to one S(2), one S(3), and one Br(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a water-like geometry to one B(1) and one B(2) atom. In the second S site, S(2) is bonded in a water-like geometry to one B(1) and one B(3) atom. In the third S site, S(3) is bonded in a water-like geometry to one B(2) and one B(3) atom. There are three inequivalent Br sites. In the first Br site, Br(3) is bonded in a single-bond geometry to one B(3) atom. In the second Br site, Br(1) is bonded in a single-bond geometry to one B(1) atom. In the third Br site, Br(2) is bonded in a single-bond geometry to one B(2) atom. is represented by the CIF card [CIF]
data_BSBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.199
_cell_length_b   14.193
_cell_length_c   18.243
_cell_angle_alpha   65.094
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   986.053
_cell_formula_units_Z   12
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
  B  B0  1  0.742  0.375  0.167  1.0
  B  B1  1  0.242  0.625  0.333  1.0
  B  B2  1  0.258  0.625  0.833  1.0
  B  B3  1  0.758  0.375  0.667  1.0
  B  B4  1  0.986  0.169  0.273  1.0
  B  B5  1  0.486  0.831  0.227  1.0
  B  B6  1  0.014  0.831  0.727  1.0
  B  B7  1  0.514  0.169  0.773  1.0
  B  B8  1  0.974  0.235  0.098  1.0
  B  B9  1  0.474  0.765  0.402  1.0
  B  B10  1  0.026  0.765  0.902  1.0
  B  B11  1  0.526  0.235  0.598  1.0
  S  S12  1  0.685  0.287  0.770  1.0
  S  S13  1  0.185  0.713  0.730  1.0
  S  S14  1  0.315  0.713  0.230  1.0
  S  S15  1  0.815  0.287  0.270  1.0
  S  S16  1  0.695  0.361  0.574  1.0
  S  S17  1  0.195  0.639  0.926  1.0
  S  S18  1  0.305  0.639  0.426  1.0
  S  S19  1  0.805  0.361  0.074  1.0
  S  S20  1  0.419  0.131  0.693  1.0
  S  S21  1  0.919  0.869  0.807  1.0
  S  S22  1  0.581  0.869  0.307  1.0
  S  S23  1  0.081  0.131  0.193  1.0
  Br  Br24  1  0.560  0.506  0.152  1.0
  Br  Br25  1  0.060  0.494  0.348  1.0
  Br  Br26  1  0.440  0.494  0.848  1.0
  Br  Br27  1  0.940  0.506  0.652  1.0
  Br  Br28  1  0.085  0.067  0.379  1.0
  Br  Br29  1  0.585  0.933  0.121  1.0
  Br  Br30  1  0.915  0.933  0.621  1.0
  Br  Br31  1  0.415  0.067  0.879  1.0
  Br  Br32  1  0.058  0.207  0.005  1.0
  Br  Br33  1  0.558  0.793  0.495  1.0
  Br  Br34  1  0.942  0.793  0.995  1.0
  Br  Br35  1  0.442  0.207  0.505  1.0
[/CIF]
.
The structure described by BSBr is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four cyclo-1,3,5-trithia-2,4,6-triborane, 2,4,6-tribromo- molecules. There are three inequivalent B sites. In the first B site, B(1) is bonded in a trigonal planar geometry to one S(1), one S(2), and one Br(1) atom. In the second B site, B(2) is bonded in a trigonal planar geometry to one S(1), one S(3), and one Br(2) atom. In the third B site, B(3) is bonded in a trigonal planar geometry to one S(2), one S(3), and one Br(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a water-like geometry to one B(1) and one B(2) atom. In the second S site, S(2) is bonded in a water-like geometry to one B(1) and one B(3) atom. In the third S site, S(3) is bonded in a water-like geometry to one B(2) and one B(3) atom. There are three inequivalent Br sites. In the first Br site, Br(3) is bonded in a single-bond geometry to one B(3) atom. In the second Br site, Br(1) is bonded in a single-bond geometry to one B(1) atom. In the third Br site, Br(2) is bonded in a single-bond geometry to one B(2) atom. is represented by the CIF card [CIF]
data_BSBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.199
_cell_length_b   14.193
_cell_length_c   18.243
_cell_angle_alpha   65.094
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   986.053
_cell_formula_units_Z   12
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
  B  B0  1  0.742  0.375  0.167  1.0
  B  B1  1  0.242  0.625  0.333  1.0
  B  B2  1  0.258  0.625  0.833  1.0
  B  B3  1  0.758  0.375  0.667  1.0
  B  B4  1  0.986  0.169  0.273  1.0
  B  B5  1  0.486  0.831  0.227  1.0
  B  B6  1  0.014  0.831  0.727  1.0
  B  B7  1  0.514  0.169  0.773  1.0
  B  B8  1  0.974  0.235  0.098  1.0
  B  B9  1  0.474  0.765  0.402  1.0
  B  B10  1  0.026  0.765  0.902  1.0
  B  B11  1  0.526  0.235  0.598  1.0
  S  S12  1  0.685  0.287  0.770  1.0
  S  S13  1  0.185  0.713  0.730  1.0
  S  S14  1  0.315  0.713  0.230  1.0
  S  S15  1  0.815  0.287  0.270  1.0
  S  S16  1  0.695  0.361  0.574  1.0
  S  S17  1  0.195  0.639  0.926  1.0
  S  S18  1  0.305  0.639  0.426  1.0
  S  S19  1  0.805  0.361  0.074  1.0
  S  S20  1  0.419  0.131  0.693  1.0
  S  S21  1  0.919  0.869  0.807  1.0
  S  S22  1  0.581  0.869  0.307  1.0
  S  S23  1  0.081  0.131  0.193  1.0
  Br  Br24  1  0.560  0.506  0.152  1.0
  Br  Br25  1  0.060  0.494  0.348  1.0
  Br  Br26  1  0.440  0.494  0.848  1.0
  Br  Br27  1  0.940  0.506  0.652  1.0
  Br  Br28  1  0.085  0.067  0.379  1.0
  Br  Br29  1  0.585  0.933  0.121  1.0
  Br  Br30  1  0.915  0.933  0.621  1.0
  Br  Br31  1  0.415  0.067  0.879  1.0
  Br  Br32  1  0.058  0.207  0.005  1.0
  Br  Br33  1  0.558  0.793  0.495  1.0
  Br  Br34  1  0.942  0.793  0.995  1.0
  Br  Br35  1  0.442  0.207  0.505  1.0
[/CIF]
.