The crystal structure described by Re3S4Br3 is Copper structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two Re3S4Br3 clusters. In one of the Re3S4Br3 clusters, there are three inequivalent Re sites. In the first Re site, Re(1) is bonded to one S(1), one S(3), one S(6), one S(8), and one Br(4) atom to form distorted edge-sharing ReS4Br square pyramids. In the second Re site, Re(2) is bonded to one S(1), one S(3), one S(6), one S(8), and one Br(5) atom to form distorted edge-sharing ReS4Br square pyramids. In the third Re site, Re(3) is bonded to one S(1), one S(3), one S(6), one S(8), and one Br(1) atom to form edge-sharing ReS4Br square pyramids. There are four inequivalent S sites. In the first S site, S(1) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. In the second S site, S(3) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. In the third S site, S(6) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. In the fourth S site, S(8) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. There are three inequivalent Br sites. In the first Br site, Br(4) is bonded in a single-bond geometry to one Re(1) atom. In the second Br site, Br(5) is bonded in a single-bond geometry to one Re(2) atom. In the third Br site, Br(1) is bonded in a single-bond geometry to one Re(3) atom. In one of the Re3S4Br3 clusters, there are three inequivalent Re sites. In the first Re site, Re(4) is bonded to one S(2), one S(4), one S(5), one S(7), and one Br(6) atom to form edge-sharing ReS4Br square pyramids. In the second Re site, Re(5) is bonded to one S(2), one S(4), one S(5), one S(7), and one Br(3) atom to form distorted edge-sharing ReS4Br square pyramids. In the third Re site, Re(6) is bonded to one S(2), one S(4), one S(5), one S(7), and one Br(2) atom to form distorted edge-sharing ReS4Br square pyramids. There are four inequivalent S sites. In the first S site, S(2) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. In the second S site, S(4) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. In the third S site, S(5) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. In the fourth S site, S(7) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. There are three inequivalent Br sites. In the first Br site, Br(3) is bonded in a single-bond geometry to one Re(5) atom. In the second Br site, Br(6) is bonded in a single-bond geometry to one Re(4) atom. In the third Br site, Br(2) is bonded in a single-bond geometry to one Re(6) atom. is represented by the CIF file [CIF]
data_Re3S4Br3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.234
_cell_length_b   9.250
_cell_length_c   12.992
_cell_angle_alpha   83.294
_cell_angle_beta   83.231
_cell_angle_gamma   82.664
_symmetry_Int_Tables_number   1
_cell_volume   1087.176
_cell_formula_units_Z   4
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
  Re  Re0  1  0.694  0.473  0.944  1.0
  Re  Re1  1  0.306  0.527  0.056  1.0
  Re  Re2  1  0.479  0.689  0.932  1.0
  Re  Re3  1  0.521  0.311  0.068  1.0
  Re  Re4  1  0.441  0.423  0.881  1.0
  Re  Re5  1  0.559  0.577  0.119  1.0
  Re  Re6  1  0.887  0.191  0.500  1.0
  Re  Re7  1  0.113  0.809  0.500  1.0
  Re  Re8  1  0.830  0.915  0.508  1.0
  Re  Re9  1  0.170  0.085  0.492  1.0
  Re  Re10  1  0.988  0.986  0.646  1.0
  Re  Re11  1  0.012  0.014  0.354  1.0
  S  S12  1  0.601  0.579  0.780  1.0
  S  S13  1  0.399  0.421  0.220  1.0
  S  S14  1  0.957  0.762  0.376  1.0
  S  S15  1  0.043  0.238  0.624  1.0
  S  S16  1  0.638  0.233  0.904  1.0
  S  S17  1  0.362  0.767  0.096  1.0
  S  S18  1  0.270  0.923  0.361  1.0
  S  S19  1  0.730  0.077  0.639  1.0
  S  S20  1  0.247  0.893  0.625  1.0
  S  S21  1  0.753  0.107  0.375  1.0
  S  S22  1  0.248  0.626  0.884  1.0
  S  S23  1  0.752  0.374  0.116  1.0
  S  S24  1  0.935  0.737  0.640  1.0
  S  S25  1  0.065  0.263  0.360  1.0
  S  S26  1  0.716  0.713  0.989  1.0
  S  S27  1  0.284  0.287  0.011  1.0
  Br  Br28  1  0.644  0.680  0.267  1.0
  Br  Br29  1  0.356  0.320  0.733  1.0
  Br  Br30  1  0.976  0.968  0.841  1.0
  Br  Br31  1  0.024  0.032  0.159  1.0
  Br  Br32  1  0.597  0.796  0.517  1.0
  Br  Br33  1  0.403  0.204  0.483  1.0
  Br  Br34  1  0.956  0.425  0.863  1.0
  Br  Br35  1  0.044  0.575  0.137  1.0
  Br  Br36  1  0.447  0.946  0.844  1.0
  Br  Br37  1  0.553  0.054  0.156  1.0
  Br  Br38  1  0.735  0.435  0.503  1.0
  Br  Br39  1  0.265  0.565  0.497  1.0
[/CIF]
.
The crystal structure described by Re3S4Br3 is Copper structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two Re3S4Br3 clusters. In one of the Re3S4Br3 clusters, there are three inequivalent Re sites. In the first Re site, Re(1) is bonded to one S(1), one S(3), one S(6), one S(8), and one Br(4) atom to form distorted edge-sharing ReS4Br square pyramids. In the second Re site, Re(2) is bonded to one S(1), one S(3), one S(6), one S(8), and one Br(5) atom to form distorted edge-sharing ReS4Br square pyramids. In the third Re site, Re(3) is bonded to one S(1), one S(3), one S(6), one S(8), and one Br(1) atom to form edge-sharing ReS4Br square pyramids. There are four inequivalent S sites. In the first S site, S(1) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. In the second S site, S(3) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. In the third S site, S(6) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. In the fourth S site, S(8) is bonded in a 3-coordinate geometry to one Re(1), one Re(2), and one Re(3) atom. There are three inequivalent Br sites. In the first Br site, Br(4) is bonded in a single-bond geometry to one Re(1) atom. In the second Br site, Br(5) is bonded in a single-bond geometry to one Re(2) atom. In the third Br site, Br(1) is bonded in a single-bond geometry to one Re(3) atom. In one of the Re3S4Br3 clusters, there are three inequivalent Re sites. In the first Re site, Re(4) is bonded to one S(2), one S(4), one S(5), one S(7), and one Br(6) atom to form edge-sharing ReS4Br square pyramids. In the second Re site, Re(5) is bonded to one S(2), one S(4), one S(5), one S(7), and one Br(3) atom to form distorted edge-sharing ReS4Br square pyramids. In the third Re site, Re(6) is bonded to one S(2), one S(4), one S(5), one S(7), and one Br(2) atom to form distorted edge-sharing ReS4Br square pyramids. There are four inequivalent S sites. In the first S site, S(2) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. In the second S site, S(4) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. In the third S site, S(5) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. In the fourth S site, S(7) is bonded in a 3-coordinate geometry to one Re(4), one Re(5), and one Re(6) atom. There are three inequivalent Br sites. In the first Br site, Br(3) is bonded in a single-bond geometry to one Re(5) atom. In the second Br site, Br(6) is bonded in a single-bond geometry to one Re(4) atom. In the third Br site, Br(2) is bonded in a single-bond geometry to one Re(6) atom. is represented by the CIF file [CIF]
data_Re3S4Br3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.234
_cell_length_b   9.250
_cell_length_c   12.992
_cell_angle_alpha   83.294
_cell_angle_beta   83.231
_cell_angle_gamma   82.664
_symmetry_Int_Tables_number   1
_cell_volume   1087.176
_cell_formula_units_Z   4
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
  Re  Re0  1  0.694  0.473  0.944  1.0
  Re  Re1  1  0.306  0.527  0.056  1.0
  Re  Re2  1  0.479  0.689  0.932  1.0
  Re  Re3  1  0.521  0.311  0.068  1.0
  Re  Re4  1  0.441  0.423  0.881  1.0
  Re  Re5  1  0.559  0.577  0.119  1.0
  Re  Re6  1  0.887  0.191  0.500  1.0
  Re  Re7  1  0.113  0.809  0.500  1.0
  Re  Re8  1  0.830  0.915  0.508  1.0
  Re  Re9  1  0.170  0.085  0.492  1.0
  Re  Re10  1  0.988  0.986  0.646  1.0
  Re  Re11  1  0.012  0.014  0.354  1.0
  S  S12  1  0.601  0.579  0.780  1.0
  S  S13  1  0.399  0.421  0.220  1.0
  S  S14  1  0.957  0.762  0.376  1.0
  S  S15  1  0.043  0.238  0.624  1.0
  S  S16  1  0.638  0.233  0.904  1.0
  S  S17  1  0.362  0.767  0.096  1.0
  S  S18  1  0.270  0.923  0.361  1.0
  S  S19  1  0.730  0.077  0.639  1.0
  S  S20  1  0.247  0.893  0.625  1.0
  S  S21  1  0.753  0.107  0.375  1.0
  S  S22  1  0.248  0.626  0.884  1.0
  S  S23  1  0.752  0.374  0.116  1.0
  S  S24  1  0.935  0.737  0.640  1.0
  S  S25  1  0.065  0.263  0.360  1.0
  S  S26  1  0.716  0.713  0.989  1.0
  S  S27  1  0.284  0.287  0.011  1.0
  Br  Br28  1  0.644  0.680  0.267  1.0
  Br  Br29  1  0.356  0.320  0.733  1.0
  Br  Br30  1  0.976  0.968  0.841  1.0
  Br  Br31  1  0.024  0.032  0.159  1.0
  Br  Br32  1  0.597  0.796  0.517  1.0
  Br  Br33  1  0.403  0.204  0.483  1.0
  Br  Br34  1  0.956  0.425  0.863  1.0
  Br  Br35  1  0.044  0.575  0.137  1.0
  Br  Br36  1  0.447  0.946  0.844  1.0
  Br  Br37  1  0.553  0.054  0.156  1.0
  Br  Br38  1  0.735  0.435  0.503  1.0
  Br  Br39  1  0.265  0.565  0.497  1.0
[/CIF]
.