The crystal structure described by SPSSCs crystallizes in the orthorhombic Immm space group. Cs(1) is bonded in a distorted q6 geometry to two equivalent S(1) and eight equivalent S(2) atoms. P(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form edge-sharing PS4 tetrahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a distorted L-shaped geometry to two equivalent Cs(1) and two equivalent P(1) atoms. In the second S site, S(2) is bonded in a distorted single-bond geometry to four equivalent Cs(1) and one P(1) atom. is represented by the CIF card [CIF]
data_CsPS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.245
_cell_length_b   7.531
_cell_length_c   7.531
_cell_angle_alpha   74.199
_cell_angle_beta   61.246
_cell_angle_gamma   61.246
_symmetry_Int_Tables_number   1
_cell_volume   315.358
_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
  Cs  Cs0  1  0.000  0.738  0.262  1.0
  Cs  Cs1  1  0.000  0.262  0.738  1.0
  P  P2  1  0.345  0.655  0.655  1.0
  P  P3  1  0.655  0.345  0.345  1.0
  S  S4  1  0.500  0.329  0.671  1.0
  S  S5  1  0.500  0.671  0.329  1.0
  S  S6  1  0.473  0.761  0.761  1.0
  S  S7  1  0.994  0.239  0.239  1.0
  S  S8  1  0.527  0.239  0.239  1.0
  S  S9  1  0.006  0.761  0.761  1.0
[/CIF]
.
The crystal structure described by SPSSCs crystallizes in the orthorhombic Immm space group. Cs(1) is bonded in a distorted q6 geometry to two equivalent S(1) and eight equivalent S(2) atoms. P(1) is bonded to two equivalent S(1) and two equivalent S(2) atoms to form edge-sharing PS4 tetrahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a distorted L-shaped geometry to two equivalent Cs(1) and two equivalent P(1) atoms. In the second S site, S(2) is bonded in a distorted single-bond geometry to four equivalent Cs(1) and one P(1) atom. is represented by the CIF card [CIF]
data_CsPS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.245
_cell_length_b   7.531
_cell_length_c   7.531
_cell_angle_alpha   74.199
_cell_angle_beta   61.246
_cell_angle_gamma   61.246
_symmetry_Int_Tables_number   1
_cell_volume   315.358
_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
  Cs  Cs0  1  0.000  0.738  0.262  1.0
  Cs  Cs1  1  0.000  0.262  0.738  1.0
  P  P2  1  0.345  0.655  0.655  1.0
  P  P3  1  0.655  0.345  0.345  1.0
  S  S4  1  0.500  0.329  0.671  1.0
  S  S5  1  0.500  0.671  0.329  1.0
  S  S6  1  0.473  0.761  0.761  1.0
  S  S7  1  0.994  0.239  0.239  1.0
  S  S8  1  0.527  0.239  0.239  1.0
  S  S9  1  0.006  0.761  0.761  1.0
[/CIF]
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