The material described by P4S3 is beta Np structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four phosphorus sesquisulfide molecules. There are three inequivalent P sites. In the first P site, P(1) is bonded in a distorted single-bond geometry to one S(1) atom. In the second P site, P(2) is bonded in a distorted trigonal non-coplanar geometry to one S(2) and two equivalent S(1) atoms. In the third P site, P(3) is bonded in a distorted single-bond geometry to one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a water-like geometry to one P(1) and one P(2) atom. In the second S site, S(2) is bonded in a water-like geometry to one P(2) and one P(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_P4S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.828
_cell_length_b   9.933
_cell_length_c   11.111
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   753.518
_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
  P  P0  1  0.757  0.863  0.078  1.0
  P  P1  1  0.257  0.137  0.422  1.0
  P  P2  1  0.243  0.363  0.922  1.0
  P  P3  1  0.743  0.637  0.578  1.0
  P  P4  1  0.845  0.250  0.309  1.0
  P  P5  1  0.345  0.750  0.191  1.0
  P  P6  1  0.155  0.750  0.691  1.0
  P  P7  1  0.655  0.250  0.809  1.0
  P  P8  1  0.090  0.250  0.563  1.0
  P  P9  1  0.590  0.750  0.937  1.0
  P  P10  1  0.910  0.750  0.437  1.0
  P  P11  1  0.410  0.250  0.063  1.0
  P  P12  1  0.243  0.137  0.922  1.0
  P  P13  1  0.743  0.863  0.578  1.0
  P  P14  1  0.257  0.363  0.422  1.0
  P  P15  1  0.757  0.637  0.078  1.0
  S  S16  1  0.956  0.912  0.706  1.0
  S  S17  1  0.456  0.412  0.794  1.0
  S  S18  1  0.044  0.088  0.294  1.0
  S  S19  1  0.544  0.912  0.206  1.0
  S  S20  1  0.456  0.088  0.794  1.0
  S  S21  1  0.956  0.588  0.706  1.0
  S  S22  1  0.544  0.588  0.206  1.0
  S  S23  1  0.044  0.412  0.294  1.0
  S  S24  1  0.697  0.250  0.996  1.0
  S  S25  1  0.197  0.750  0.504  1.0
  S  S26  1  0.303  0.750  0.004  1.0
  S  S27  1  0.803  0.250  0.496  1.0
[/CIF]
.
The material described by P4S3 is beta Np structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four phosphorus sesquisulfide molecules. There are three inequivalent P sites. In the first P site, P(1) is bonded in a distorted single-bond geometry to one S(1) atom. In the second P site, P(2) is bonded in a distorted trigonal non-coplanar geometry to one S(2) and two equivalent S(1) atoms. In the third P site, P(3) is bonded in a distorted single-bond geometry to one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a water-like geometry to one P(1) and one P(2) atom. In the second S site, S(2) is bonded in a water-like geometry to one P(2) and one P(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_P4S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.828
_cell_length_b   9.933
_cell_length_c   11.111
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   753.518
_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
  P  P0  1  0.757  0.863  0.078  1.0
  P  P1  1  0.257  0.137  0.422  1.0
  P  P2  1  0.243  0.363  0.922  1.0
  P  P3  1  0.743  0.637  0.578  1.0
  P  P4  1  0.845  0.250  0.309  1.0
  P  P5  1  0.345  0.750  0.191  1.0
  P  P6  1  0.155  0.750  0.691  1.0
  P  P7  1  0.655  0.250  0.809  1.0
  P  P8  1  0.090  0.250  0.563  1.0
  P  P9  1  0.590  0.750  0.937  1.0
  P  P10  1  0.910  0.750  0.437  1.0
  P  P11  1  0.410  0.250  0.063  1.0
  P  P12  1  0.243  0.137  0.922  1.0
  P  P13  1  0.743  0.863  0.578  1.0
  P  P14  1  0.257  0.363  0.422  1.0
  P  P15  1  0.757  0.637  0.078  1.0
  S  S16  1  0.956  0.912  0.706  1.0
  S  S17  1  0.456  0.412  0.794  1.0
  S  S18  1  0.044  0.088  0.294  1.0
  S  S19  1  0.544  0.912  0.206  1.0
  S  S20  1  0.456  0.088  0.794  1.0
  S  S21  1  0.956  0.588  0.706  1.0
  S  S22  1  0.544  0.588  0.206  1.0
  S  S23  1  0.044  0.412  0.294  1.0
  S  S24  1  0.697  0.250  0.996  1.0
  S  S25  1  0.197  0.750  0.504  1.0
  S  S26  1  0.303  0.750  0.004  1.0
  S  S27  1  0.803  0.250  0.496  1.0
[/CIF]
.