The material structure described by RbPbPS4 crystallizes in the orthorhombic Pnma space group. Rb(1) is bonded in a 7-coordinate geometry to one S(2), two equivalent S(1), and four equivalent S(3) atoms. Pb(1) is bonded in a 6-coordinate geometry to one S(1), one S(2), and four equivalent S(3) atoms. P(1) is bonded in a tetrahedral geometry to one S(1), one S(2), and two equivalent S(3) atoms. There are three inequivalent S sites. In the first S site, S(1) is bonded in a distorted single-bond geometry to two equivalent Rb(1), one Pb(1), and one P(1) atom. In the second S site, S(2) is bonded in a distorted T-shaped geometry to one Rb(1), one Pb(1), and one P(1) atom. In the third S site, S(3) is bonded in a distorted single-bond geometry to two equivalent Rb(1), two equivalent Pb(1), and one P(1) atom. is represented by the CIF card [CIF]
data_RbPPbS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.513
_cell_length_b   6.801
_cell_length_c   17.659
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   782.274
_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  0.530  0.750  0.294  1.0
  Rb  Rb1  1  0.970  0.750  0.794  1.0
  Rb  Rb2  1  0.470  0.250  0.706  1.0
  Rb  Rb3  1  0.030  0.250  0.206  1.0
  P  P4  1  0.782  0.750  0.097  1.0
  P  P5  1  0.718  0.750  0.597  1.0
  P  P6  1  0.218  0.250  0.903  1.0
  P  P7  1  0.282  0.250  0.403  1.0
  Pb  Pb8  1  0.288  0.750  0.018  1.0
  Pb  Pb9  1  0.212  0.750  0.518  1.0
  Pb  Pb10  1  0.712  0.250  0.982  1.0
  Pb  Pb11  1  0.788  0.250  0.482  1.0
  S  S12  1  0.045  0.750  0.160  1.0
  S  S13  1  0.455  0.750  0.660  1.0
  S  S14  1  0.955  0.250  0.840  1.0
  S  S15  1  0.545  0.250  0.340  1.0
  S  S16  1  0.846  0.750  0.983  1.0
  S  S17  1  0.654  0.750  0.483  1.0
  S  S18  1  0.154  0.250  0.017  1.0
  S  S19  1  0.346  0.250  0.517  1.0
  S  S20  1  0.607  0.507  0.121  1.0
  S  S21  1  0.893  0.993  0.621  1.0
  S  S22  1  0.393  0.007  0.879  1.0
  S  S23  1  0.107  0.493  0.379  1.0
  S  S24  1  0.393  0.493  0.879  1.0
  S  S25  1  0.107  0.007  0.379  1.0
  S  S26  1  0.607  0.993  0.121  1.0
  S  S27  1  0.893  0.507  0.621  1.0
[/CIF]
.
The material structure described by RbPbPS4 crystallizes in the orthorhombic Pnma space group. Rb(1) is bonded in a 7-coordinate geometry to one S(2), two equivalent S(1), and four equivalent S(3) atoms. Pb(1) is bonded in a 6-coordinate geometry to one S(1), one S(2), and four equivalent S(3) atoms. P(1) is bonded in a tetrahedral geometry to one S(1), one S(2), and two equivalent S(3) atoms. There are three inequivalent S sites. In the first S site, S(1) is bonded in a distorted single-bond geometry to two equivalent Rb(1), one Pb(1), and one P(1) atom. In the second S site, S(2) is bonded in a distorted T-shaped geometry to one Rb(1), one Pb(1), and one P(1) atom. In the third S site, S(3) is bonded in a distorted single-bond geometry to two equivalent Rb(1), two equivalent Pb(1), and one P(1) atom. is represented by the CIF card [CIF]
data_RbPPbS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.513
_cell_length_b   6.801
_cell_length_c   17.659
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   782.274
_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  0.530  0.750  0.294  1.0
  Rb  Rb1  1  0.970  0.750  0.794  1.0
  Rb  Rb2  1  0.470  0.250  0.706  1.0
  Rb  Rb3  1  0.030  0.250  0.206  1.0
  P  P4  1  0.782  0.750  0.097  1.0
  P  P5  1  0.718  0.750  0.597  1.0
  P  P6  1  0.218  0.250  0.903  1.0
  P  P7  1  0.282  0.250  0.403  1.0
  Pb  Pb8  1  0.288  0.750  0.018  1.0
  Pb  Pb9  1  0.212  0.750  0.518  1.0
  Pb  Pb10  1  0.712  0.250  0.982  1.0
  Pb  Pb11  1  0.788  0.250  0.482  1.0
  S  S12  1  0.045  0.750  0.160  1.0
  S  S13  1  0.455  0.750  0.660  1.0
  S  S14  1  0.955  0.250  0.840  1.0
  S  S15  1  0.545  0.250  0.340  1.0
  S  S16  1  0.846  0.750  0.983  1.0
  S  S17  1  0.654  0.750  0.483  1.0
  S  S18  1  0.154  0.250  0.017  1.0
  S  S19  1  0.346  0.250  0.517  1.0
  S  S20  1  0.607  0.507  0.121  1.0
  S  S21  1  0.893  0.993  0.621  1.0
  S  S22  1  0.393  0.007  0.879  1.0
  S  S23  1  0.107  0.493  0.379  1.0
  S  S24  1  0.393  0.493  0.879  1.0
  S  S25  1  0.107  0.007  0.379  1.0
  S  S26  1  0.607  0.993  0.121  1.0
  S  S27  1  0.893  0.507  0.621  1.0
[/CIF]
.