The material structure described by CsRe3(S2Br)2 crystallizes in the monoclinic P2_1/c space group. Cs(1) is bonded in a 9-coordinate geometry to one S(2), one S(3), two equivalent S(1), two equivalent Br(1), and three equivalent Br(2) atoms. There are three inequivalent Re sites. In the first Re site, Re(1) is bonded to one S(1), one S(2), one S(3), and two equivalent S(4) atoms to form distorted ReS5 square pyramids that share  a cornercorner with one Re(2)S4Br square pyramid,  a cornercorner with one Re(3)S4Br square pyramid,  an edgeedge with one Re(1)S5 square pyramid, edges with two equivalent Re(2)S4Br square pyramids, and edges with two equivalent Re(3)S4Br square pyramids. In the second Re site, Re(2) is bonded to one S(1), one S(2), one S(3), one S(4), and one Br(1) atom to form ReS4Br square pyramids that share  a cornercorner with one Re(1)S5 square pyramid, edges with two equivalent Re(3)S4Br square pyramids, and edges with two equivalent Re(1)S5 square pyramids. In the third Re site, Re(3) is bonded to one S(1), one S(2), one S(3), one S(4), and one Br(2) atom to form ReS4Br square pyramids that share  a cornercorner with one Re(1)S5 square pyramid, edges with two equivalent Re(2)S4Br square pyramids, and edges with two equivalent Re(1)S5 square pyramids. There are four inequivalent S sites. In the first S site, S(1) is bonded in a 3-coordinate geometry to two equivalent Cs(1), one Re(1), one Re(2), and one Re(3) atom. In the second S site, S(2) is bonded in a 3-coordinate geometry to one Cs(1), one Re(1), one Re(2), and one Re(3) atom. In the third S site, S(3) is bonded in a 4-coordinate geometry to one Cs(1), one Re(1), one Re(2), and one Re(3) atom. In the fourth S site, S(4) is bonded in a distorted rectangular see-saw-like geometry to one Re(2), one Re(3), and two equivalent Re(1) atoms. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a 3-coordinate geometry to two equivalent Cs(1) and one Re(2) atom. In the second Br site, Br(2) is bonded in a distorted rectangular see-saw-like geometry to three equivalent Cs(1) and one Re(3) atom. is represented by the CIF card [CIF]
data_CsRe3(S2Br)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.925
_cell_length_b   6.471
_cell_length_c   10.148
_cell_angle_alpha   65.753
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1133.124
_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
  Cs  Cs0  1  0.690  0.050  0.941  1.0
  Cs  Cs1  1  0.190  0.950  0.559  1.0
  Cs  Cs2  1  0.810  0.050  0.441  1.0
  Cs  Cs3  1  0.310  0.950  0.059  1.0
  Re  Re4  1  0.494  0.780  0.428  1.0
  Re  Re5  1  0.058  0.826  0.155  1.0
  Re  Re6  1  0.506  0.220  0.572  1.0
  Re  Re7  1  0.580  0.860  0.605  1.0
  Re  Re8  1  0.920  0.860  0.105  1.0
  Re  Re9  1  0.006  0.780  0.928  1.0
  Re  Re10  1  0.080  0.140  0.895  1.0
  Re  Re11  1  0.442  0.826  0.655  1.0
  Re  Re12  1  0.420  0.140  0.395  1.0
  Re  Re13  1  0.994  0.220  0.072  1.0
  Re  Re14  1  0.558  0.174  0.345  1.0
  Re  Re15  1  0.942  0.174  0.845  1.0
  S  S16  1  0.369  0.767  0.478  1.0
  S  S17  1  0.120  0.171  0.114  1.0
  S  S18  1  0.631  0.233  0.522  1.0
  S  S19  1  0.026  0.085  0.695  1.0
  S  S20  1  0.516  0.503  0.684  1.0
  S  S21  1  0.869  0.233  0.022  1.0
  S  S22  1  0.526  0.915  0.805  1.0
  S  S23  1  0.131  0.767  0.978  1.0
  S  S24  1  0.474  0.085  0.195  1.0
  S  S25  1  0.620  0.829  0.386  1.0
  S  S26  1  0.974  0.915  0.305  1.0
  S  S27  1  0.484  0.497  0.316  1.0
  S  S28  1  0.880  0.829  0.886  1.0
  S  S29  1  0.984  0.503  0.184  1.0
  S  S30  1  0.016  0.497  0.816  1.0
  S  S31  1  0.380  0.171  0.614  1.0
  Br  Br32  1  0.361  0.593  0.868  1.0
  Br  Br33  1  0.639  0.407  0.132  1.0
  Br  Br34  1  0.861  0.407  0.632  1.0
  Br  Br35  1  0.696  0.681  0.742  1.0
  Br  Br36  1  0.804  0.681  0.242  1.0
  Br  Br37  1  0.196  0.319  0.758  1.0
  Br  Br38  1  0.304  0.319  0.258  1.0
  Br  Br39  1  0.139  0.593  0.368  1.0
[/CIF]
.
The material structure described by CsRe3(S2Br)2 crystallizes in the monoclinic P2_1/c space group. Cs(1) is bonded in a 9-coordinate geometry to one S(2), one S(3), two equivalent S(1), two equivalent Br(1), and three equivalent Br(2) atoms. There are three inequivalent Re sites. In the first Re site, Re(1) is bonded to one S(1), one S(2), one S(3), and two equivalent S(4) atoms to form distorted ReS5 square pyramids that share  a cornercorner with one Re(2)S4Br square pyramid,  a cornercorner with one Re(3)S4Br square pyramid,  an edgeedge with one Re(1)S5 square pyramid, edges with two equivalent Re(2)S4Br square pyramids, and edges with two equivalent Re(3)S4Br square pyramids. In the second Re site, Re(2) is bonded to one S(1), one S(2), one S(3), one S(4), and one Br(1) atom to form ReS4Br square pyramids that share  a cornercorner with one Re(1)S5 square pyramid, edges with two equivalent Re(3)S4Br square pyramids, and edges with two equivalent Re(1)S5 square pyramids. In the third Re site, Re(3) is bonded to one S(1), one S(2), one S(3), one S(4), and one Br(2) atom to form ReS4Br square pyramids that share  a cornercorner with one Re(1)S5 square pyramid, edges with two equivalent Re(2)S4Br square pyramids, and edges with two equivalent Re(1)S5 square pyramids. There are four inequivalent S sites. In the first S site, S(1) is bonded in a 3-coordinate geometry to two equivalent Cs(1), one Re(1), one Re(2), and one Re(3) atom. In the second S site, S(2) is bonded in a 3-coordinate geometry to one Cs(1), one Re(1), one Re(2), and one Re(3) atom. In the third S site, S(3) is bonded in a 4-coordinate geometry to one Cs(1), one Re(1), one Re(2), and one Re(3) atom. In the fourth S site, S(4) is bonded in a distorted rectangular see-saw-like geometry to one Re(2), one Re(3), and two equivalent Re(1) atoms. There are two inequivalent Br sites. In the first Br site, Br(1) is bonded in a 3-coordinate geometry to two equivalent Cs(1) and one Re(2) atom. In the second Br site, Br(2) is bonded in a distorted rectangular see-saw-like geometry to three equivalent Cs(1) and one Re(3) atom. is represented by the CIF card [CIF]
data_CsRe3(S2Br)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.925
_cell_length_b   6.471
_cell_length_c   10.148
_cell_angle_alpha   65.753
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1133.124
_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
  Cs  Cs0  1  0.690  0.050  0.941  1.0
  Cs  Cs1  1  0.190  0.950  0.559  1.0
  Cs  Cs2  1  0.810  0.050  0.441  1.0
  Cs  Cs3  1  0.310  0.950  0.059  1.0
  Re  Re4  1  0.494  0.780  0.428  1.0
  Re  Re5  1  0.058  0.826  0.155  1.0
  Re  Re6  1  0.506  0.220  0.572  1.0
  Re  Re7  1  0.580  0.860  0.605  1.0
  Re  Re8  1  0.920  0.860  0.105  1.0
  Re  Re9  1  0.006  0.780  0.928  1.0
  Re  Re10  1  0.080  0.140  0.895  1.0
  Re  Re11  1  0.442  0.826  0.655  1.0
  Re  Re12  1  0.420  0.140  0.395  1.0
  Re  Re13  1  0.994  0.220  0.072  1.0
  Re  Re14  1  0.558  0.174  0.345  1.0
  Re  Re15  1  0.942  0.174  0.845  1.0
  S  S16  1  0.369  0.767  0.478  1.0
  S  S17  1  0.120  0.171  0.114  1.0
  S  S18  1  0.631  0.233  0.522  1.0
  S  S19  1  0.026  0.085  0.695  1.0
  S  S20  1  0.516  0.503  0.684  1.0
  S  S21  1  0.869  0.233  0.022  1.0
  S  S22  1  0.526  0.915  0.805  1.0
  S  S23  1  0.131  0.767  0.978  1.0
  S  S24  1  0.474  0.085  0.195  1.0
  S  S25  1  0.620  0.829  0.386  1.0
  S  S26  1  0.974  0.915  0.305  1.0
  S  S27  1  0.484  0.497  0.316  1.0
  S  S28  1  0.880  0.829  0.886  1.0
  S  S29  1  0.984  0.503  0.184  1.0
  S  S30  1  0.016  0.497  0.816  1.0
  S  S31  1  0.380  0.171  0.614  1.0
  Br  Br32  1  0.361  0.593  0.868  1.0
  Br  Br33  1  0.639  0.407  0.132  1.0
  Br  Br34  1  0.861  0.407  0.632  1.0
  Br  Br35  1  0.696  0.681  0.742  1.0
  Br  Br36  1  0.804  0.681  0.242  1.0
  Br  Br37  1  0.196  0.319  0.758  1.0
  Br  Br38  1  0.304  0.319  0.258  1.0
  Br  Br39  1  0.139  0.593  0.368  1.0
[/CIF]
.