The material described by Rb3BS3 crystallizes in the monoclinic P2_1/c space group. There are three inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 6-coordinate geometry to two equivalent S(1), two equivalent S(2), and two equivalent S(3) atoms. In the second Rb site, Rb(2) is bonded in a 6-coordinate geometry to one S(1), one S(3), and four equivalent S(2) atoms. In the third Rb site, Rb(3) is bonded in a 7-coordinate geometry to one B(1), one S(2), two equivalent S(3), and three equivalent S(1) atoms. B(1) is bonded in a trigonal planar geometry to one Rb(3), one S(1), one S(2), and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a distorted single-bond geometry to one Rb(2), two equivalent Rb(1), three equivalent Rb(3), and one B(1) atom. In the second S site, S(2) is bonded in a distorted single-bond geometry to one Rb(3), two equivalent Rb(1), four equivalent Rb(2), and one B(1) atom. In the third S site, S(3) is bonded in a distorted single-bond geometry to one Rb(2), two equivalent Rb(1), two equivalent Rb(3), and one B(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Rb3BS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.411
_cell_length_b   10.419
_cell_length_c   13.124
_cell_angle_alpha   75.378
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   848.261
_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
  Rb  Rb0  1  0.643  0.251  0.508  1.0
  Rb  Rb1  1  0.143  0.749  0.992  1.0
  Rb  Rb2  1  0.357  0.749  0.492  1.0
  Rb  Rb3  1  0.857  0.251  0.008  1.0
  Rb  Rb4  1  0.285  0.028  0.141  1.0
  Rb  Rb5  1  0.785  0.972  0.359  1.0
  Rb  Rb6  1  0.715  0.972  0.859  1.0
  Rb  Rb7  1  0.215  0.028  0.641  1.0
  Rb  Rb8  1  0.437  0.405  0.196  1.0
  Rb  Rb9  1  0.937  0.595  0.304  1.0
  Rb  Rb10  1  0.563  0.595  0.804  1.0
  Rb  Rb11  1  0.063  0.405  0.696  1.0
  B  B12  1  0.117  0.234  0.372  1.0
  B  B13  1  0.617  0.766  0.128  1.0
  B  B14  1  0.883  0.766  0.628  1.0
  B  B15  1  0.383  0.234  0.872  1.0
  S  S16  1  0.924  0.286  0.266  1.0
  S  S17  1  0.424  0.714  0.234  1.0
  S  S18  1  0.076  0.714  0.734  1.0
  S  S19  1  0.576  0.286  0.766  1.0
  S  S20  1  0.286  0.090  0.378  1.0
  S  S21  1  0.786  0.910  0.122  1.0
  S  S22  1  0.714  0.910  0.622  1.0
  S  S23  1  0.214  0.090  0.878  1.0
  S  S24  1  0.354  0.331  0.970  1.0
  S  S25  1  0.854  0.669  0.530  1.0
  S  S26  1  0.646  0.669  0.030  1.0
  S  S27  1  0.146  0.331  0.470  1.0
[/CIF]
.
The material described by Rb3BS3 crystallizes in the monoclinic P2_1/c space group. There are three inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 6-coordinate geometry to two equivalent S(1), two equivalent S(2), and two equivalent S(3) atoms. In the second Rb site, Rb(2) is bonded in a 6-coordinate geometry to one S(1), one S(3), and four equivalent S(2) atoms. In the third Rb site, Rb(3) is bonded in a 7-coordinate geometry to one B(1), one S(2), two equivalent S(3), and three equivalent S(1) atoms. B(1) is bonded in a trigonal planar geometry to one Rb(3), one S(1), one S(2), and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a distorted single-bond geometry to one Rb(2), two equivalent Rb(1), three equivalent Rb(3), and one B(1) atom. In the second S site, S(2) is bonded in a distorted single-bond geometry to one Rb(3), two equivalent Rb(1), four equivalent Rb(2), and one B(1) atom. In the third S site, S(3) is bonded in a distorted single-bond geometry to one Rb(2), two equivalent Rb(1), two equivalent Rb(3), and one B(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Rb3BS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.411
_cell_length_b   10.419
_cell_length_c   13.124
_cell_angle_alpha   75.378
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   848.261
_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
  Rb  Rb0  1  0.643  0.251  0.508  1.0
  Rb  Rb1  1  0.143  0.749  0.992  1.0
  Rb  Rb2  1  0.357  0.749  0.492  1.0
  Rb  Rb3  1  0.857  0.251  0.008  1.0
  Rb  Rb4  1  0.285  0.028  0.141  1.0
  Rb  Rb5  1  0.785  0.972  0.359  1.0
  Rb  Rb6  1  0.715  0.972  0.859  1.0
  Rb  Rb7  1  0.215  0.028  0.641  1.0
  Rb  Rb8  1  0.437  0.405  0.196  1.0
  Rb  Rb9  1  0.937  0.595  0.304  1.0
  Rb  Rb10  1  0.563  0.595  0.804  1.0
  Rb  Rb11  1  0.063  0.405  0.696  1.0
  B  B12  1  0.117  0.234  0.372  1.0
  B  B13  1  0.617  0.766  0.128  1.0
  B  B14  1  0.883  0.766  0.628  1.0
  B  B15  1  0.383  0.234  0.872  1.0
  S  S16  1  0.924  0.286  0.266  1.0
  S  S17  1  0.424  0.714  0.234  1.0
  S  S18  1  0.076  0.714  0.734  1.0
  S  S19  1  0.576  0.286  0.766  1.0
  S  S20  1  0.286  0.090  0.378  1.0
  S  S21  1  0.786  0.910  0.122  1.0
  S  S22  1  0.714  0.910  0.622  1.0
  S  S23  1  0.214  0.090  0.878  1.0
  S  S24  1  0.354  0.331  0.970  1.0
  S  S25  1  0.854  0.669  0.530  1.0
  S  S26  1  0.646  0.669  0.030  1.0
  S  S27  1  0.146  0.331  0.470  1.0
[/CIF]
.