The material described by Rb6InP3S14 crystallizes in the monoclinic C2/c space group. There are three inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 8-coordinate geometry to one S(4), one S(5), one S(6), two equivalent S(1), and three equivalent S(7) atoms. In the second Rb site, Rb(2) is bonded in a 8-coordinate geometry to one S(1), one S(5), one S(6), one S(7), two equivalent S(3), and two equivalent S(4) atoms. In the third Rb site, Rb(3) is bonded in a 9-coordinate geometry to one S(1), one S(3), one S(4), one S(6), one S(7), two equivalent S(2), and two equivalent S(5) atoms. In(1) is bonded to two equivalent S(1), two equivalent S(2), and two equivalent S(3) atoms to form InS6 octahedra that share corners with two equivalent P(1)S4 tetrahedra and  an edgeedge with one P(2)S4 tetrahedra. There are two inequivalent P sites. In the first P site, P(2) is bonded to two equivalent S(1) and two equivalent S(7) atoms to form PS4 tetrahedra that share  an edgeedge with one In(1)S6 octahedra. In the second P site, P(1) is bonded to one S(3), one S(4), one S(5), and one S(6) atom to form PS4 tetrahedra that share  a cornercorner with one In(1)S6 octahedra and  a cornercorner with one S(2)Rb2InS tetrahedra. The corner-sharing octahedral tilt angles are 76°. There are seven inequivalent S sites. In the first S site, S(7) is bonded in a 1-coordinate geometry to one Rb(2), one Rb(3), three equivalent Rb(1), and one P(2) atom. In the second S site, S(1) is bonded in a 6-coordinate geometry to one Rb(2), one Rb(3), two equivalent Rb(1), one In(1), and one P(2) atom. In the third S site, S(2) is bonded to two equivalent Rb(3), one In(1), and one S(6) atom to form distorted SRb2InS tetrahedra that share  a cornercorner with one P(1)S4 tetrahedra,  a cornercorner with one S(2)Rb2InS tetrahedra, corners with two equivalent S(4)Rb4P trigonal bipyramids, and  an edgeedge with one S(2)Rb2InS tetrahedra. In the fourth S site, S(6) is bonded in a distorted single-bond geometry to one Rb(1), one Rb(2), one Rb(3), one P(1), and one S(2) atom. In the fifth S site, S(3) is bonded in a 2-coordinate geometry to one Rb(3), two equivalent Rb(2), one In(1), and one P(1) atom. In the sixth S site, S(4) is bonded to one Rb(1), one Rb(3), two equivalent Rb(2), and one P(1) atom to form distorted SRb4P trigonal bipyramids that share corners with two equivalent S(2)Rb2InS tetrahedra and corners with two equivalent S(4)Rb4P trigonal bipyramids. In the seventh S site, S(5) is bonded in a distorted single-bond geometry to one Rb(1), one Rb(2), two equivalent Rb(3), and one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Rb6InP3S14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.575
_cell_length_b   11.575
_cell_length_c   13.384
_cell_angle_alpha   74.200
_cell_angle_beta   74.200
_cell_angle_gamma   58.276
_symmetry_Int_Tables_number   1
_cell_volume   1449.279
_cell_formula_units_Z   2
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  0.021  0.790  0.587  1.0
  Rb  Rb1  1  0.210  0.979  0.913  1.0
  Rb  Rb2  1  0.979  0.210  0.413  1.0
  Rb  Rb3  1  0.790  0.021  0.087  1.0
  Rb  Rb4  1  0.898  0.673  0.350  1.0
  Rb  Rb5  1  0.327  0.102  0.150  1.0
  Rb  Rb6  1  0.102  0.327  0.650  1.0
  Rb  Rb7  1  0.673  0.898  0.850  1.0
  Rb  Rb8  1  0.798  0.436  0.010  1.0
  Rb  Rb9  1  0.564  0.202  0.490  1.0
  Rb  Rb10  1  0.202  0.564  0.990  1.0
  Rb  Rb11  1  0.436  0.798  0.510  1.0
  In  In12  1  0.366  0.634  0.250  1.0
  In  In13  1  0.634  0.366  0.750  1.0
  P  P14  1  0.274  0.342  0.329  1.0
  P  P15  1  0.658  0.726  0.171  1.0
  P  P16  1  0.726  0.658  0.671  1.0
  P  P17  1  0.342  0.274  0.829  1.0
  P  P18  1  0.058  0.942  0.250  1.0
  P  P19  1  0.942  0.058  0.750  1.0
  S  S20  1  0.133  0.786  0.161  1.0
  S  S21  1  0.214  0.867  0.339  1.0
  S  S22  1  0.867  0.214  0.839  1.0
  S  S23  1  0.786  0.133  0.661  1.0
  S  S24  1  0.472  0.441  0.132  1.0
  S  S25  1  0.559  0.528  0.368  1.0
  S  S26  1  0.528  0.559  0.868  1.0
  S  S27  1  0.441  0.472  0.632  1.0
  S  S28  1  0.244  0.495  0.401  1.0
  S  S29  1  0.505  0.756  0.099  1.0
  S  S30  1  0.756  0.505  0.599  1.0
  S  S31  1  0.495  0.244  0.901  1.0
  S  S32  1  0.133  0.405  0.238  1.0
  S  S33  1  0.595  0.867  0.262  1.0
  S  S34  1  0.867  0.595  0.762  1.0
  S  S35  1  0.405  0.133  0.738  1.0
  S  S36  1  0.831  0.696  0.067  1.0
  S  S37  1  0.304  0.169  0.433  1.0
  S  S38  1  0.169  0.304  0.933  1.0
  S  S39  1  0.696  0.831  0.567  1.0
  S  S40  1  0.726  0.522  0.260  1.0
  S  S41  1  0.478  0.274  0.240  1.0
  S  S42  1  0.274  0.478  0.740  1.0
  S  S43  1  0.522  0.726  0.760  1.0
  S  S44  1  0.030  0.120  0.152  1.0
  S  S45  1  0.880  0.970  0.348  1.0
  S  S46  1  0.970  0.880  0.848  1.0
  S  S47  1  0.120  0.030  0.652  1.0
[/CIF]
.
The material described by Rb6InP3S14 crystallizes in the monoclinic C2/c space group. There are three inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 8-coordinate geometry to one S(4), one S(5), one S(6), two equivalent S(1), and three equivalent S(7) atoms. In the second Rb site, Rb(2) is bonded in a 8-coordinate geometry to one S(1), one S(5), one S(6), one S(7), two equivalent S(3), and two equivalent S(4) atoms. In the third Rb site, Rb(3) is bonded in a 9-coordinate geometry to one S(1), one S(3), one S(4), one S(6), one S(7), two equivalent S(2), and two equivalent S(5) atoms. In(1) is bonded to two equivalent S(1), two equivalent S(2), and two equivalent S(3) atoms to form InS6 octahedra that share corners with two equivalent P(1)S4 tetrahedra and  an edgeedge with one P(2)S4 tetrahedra. There are two inequivalent P sites. In the first P site, P(2) is bonded to two equivalent S(1) and two equivalent S(7) atoms to form PS4 tetrahedra that share  an edgeedge with one In(1)S6 octahedra. In the second P site, P(1) is bonded to one S(3), one S(4), one S(5), and one S(6) atom to form PS4 tetrahedra that share  a cornercorner with one In(1)S6 octahedra and  a cornercorner with one S(2)Rb2InS tetrahedra. The corner-sharing octahedral tilt angles are 76°. There are seven inequivalent S sites. In the first S site, S(7) is bonded in a 1-coordinate geometry to one Rb(2), one Rb(3), three equivalent Rb(1), and one P(2) atom. In the second S site, S(1) is bonded in a 6-coordinate geometry to one Rb(2), one Rb(3), two equivalent Rb(1), one In(1), and one P(2) atom. In the third S site, S(2) is bonded to two equivalent Rb(3), one In(1), and one S(6) atom to form distorted SRb2InS tetrahedra that share  a cornercorner with one P(1)S4 tetrahedra,  a cornercorner with one S(2)Rb2InS tetrahedra, corners with two equivalent S(4)Rb4P trigonal bipyramids, and  an edgeedge with one S(2)Rb2InS tetrahedra. In the fourth S site, S(6) is bonded in a distorted single-bond geometry to one Rb(1), one Rb(2), one Rb(3), one P(1), and one S(2) atom. In the fifth S site, S(3) is bonded in a 2-coordinate geometry to one Rb(3), two equivalent Rb(2), one In(1), and one P(1) atom. In the sixth S site, S(4) is bonded to one Rb(1), one Rb(3), two equivalent Rb(2), and one P(1) atom to form distorted SRb4P trigonal bipyramids that share corners with two equivalent S(2)Rb2InS tetrahedra and corners with two equivalent S(4)Rb4P trigonal bipyramids. In the seventh S site, S(5) is bonded in a distorted single-bond geometry to one Rb(1), one Rb(2), two equivalent Rb(3), and one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Rb6InP3S14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.575
_cell_length_b   11.575
_cell_length_c   13.384
_cell_angle_alpha   74.200
_cell_angle_beta   74.200
_cell_angle_gamma   58.276
_symmetry_Int_Tables_number   1
_cell_volume   1449.279
_cell_formula_units_Z   2
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  0.021  0.790  0.587  1.0
  Rb  Rb1  1  0.210  0.979  0.913  1.0
  Rb  Rb2  1  0.979  0.210  0.413  1.0
  Rb  Rb3  1  0.790  0.021  0.087  1.0
  Rb  Rb4  1  0.898  0.673  0.350  1.0
  Rb  Rb5  1  0.327  0.102  0.150  1.0
  Rb  Rb6  1  0.102  0.327  0.650  1.0
  Rb  Rb7  1  0.673  0.898  0.850  1.0
  Rb  Rb8  1  0.798  0.436  0.010  1.0
  Rb  Rb9  1  0.564  0.202  0.490  1.0
  Rb  Rb10  1  0.202  0.564  0.990  1.0
  Rb  Rb11  1  0.436  0.798  0.510  1.0
  In  In12  1  0.366  0.634  0.250  1.0
  In  In13  1  0.634  0.366  0.750  1.0
  P  P14  1  0.274  0.342  0.329  1.0
  P  P15  1  0.658  0.726  0.171  1.0
  P  P16  1  0.726  0.658  0.671  1.0
  P  P17  1  0.342  0.274  0.829  1.0
  P  P18  1  0.058  0.942  0.250  1.0
  P  P19  1  0.942  0.058  0.750  1.0
  S  S20  1  0.133  0.786  0.161  1.0
  S  S21  1  0.214  0.867  0.339  1.0
  S  S22  1  0.867  0.214  0.839  1.0
  S  S23  1  0.786  0.133  0.661  1.0
  S  S24  1  0.472  0.441  0.132  1.0
  S  S25  1  0.559  0.528  0.368  1.0
  S  S26  1  0.528  0.559  0.868  1.0
  S  S27  1  0.441  0.472  0.632  1.0
  S  S28  1  0.244  0.495  0.401  1.0
  S  S29  1  0.505  0.756  0.099  1.0
  S  S30  1  0.756  0.505  0.599  1.0
  S  S31  1  0.495  0.244  0.901  1.0
  S  S32  1  0.133  0.405  0.238  1.0
  S  S33  1  0.595  0.867  0.262  1.0
  S  S34  1  0.867  0.595  0.762  1.0
  S  S35  1  0.405  0.133  0.738  1.0
  S  S36  1  0.831  0.696  0.067  1.0
  S  S37  1  0.304  0.169  0.433  1.0
  S  S38  1  0.169  0.304  0.933  1.0
  S  S39  1  0.696  0.831  0.567  1.0
  S  S40  1  0.726  0.522  0.260  1.0
  S  S41  1  0.478  0.274  0.240  1.0
  S  S42  1  0.274  0.478  0.740  1.0
  S  S43  1  0.522  0.726  0.760  1.0
  S  S44  1  0.030  0.120  0.152  1.0
  S  S45  1  0.880  0.970  0.348  1.0
  S  S46  1  0.970  0.880  0.848  1.0
  S  S47  1  0.120  0.030  0.652  1.0
[/CIF]
.