The material described by C2PN3S2 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two C2PN3S2 clusters. There are six inequivalent C sites. In the first C site, C(1) is bonded in a distorted linear geometry to one N(9) and one S(3) atom. In the second C site, C(2) is bonded in a distorted linear geometry to one N(4) and one S(1) atom. In the third C site, C(3) is bonded in a distorted linear geometry to one N(1) and one S(5) atom. In the fourth C site, C(4) is bonded in a distorted linear geometry to one N(7) and one S(2) atom. In the fifth C site, C(5) is bonded in a distorted linear geometry to one N(8) and one S(6) atom. In the sixth C site, C(6) is bonded in a distorted linear geometry to one N(6) and one S(4) atom. There are three inequivalent P sites. In the first P site, P(1) is bonded to one N(1), one N(2), one N(5), and one N(7) atom to form corner-sharing PN4 tetrahedra. In the second P site, P(2) is bonded to one N(2), one N(3), one N(4), and one N(8) atom to form corner-sharing PN4 tetrahedra. In the third P site, P(3) is bonded to one N(3), one N(5), one N(6), and one N(9) atom to form corner-sharing PN4 tetrahedra. There are nine inequivalent N sites. In the first N site, N(1) is bonded in a linear geometry to one C(3) and one P(1) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one P(1) and one P(2) atom. In the third N site, N(3) is bonded in a bent 120 degrees geometry to one P(2) and one P(3) atom. In the fourth N site, N(4) is bonded in a bent 150 degrees geometry to one C(2) and one P(2) atom. In the fifth N site, N(5) is bonded in a bent 120 degrees geometry to one P(1) and one P(3) atom. In the sixth N site, N(6) is bonded in a bent 150 degrees geometry to one C(6) and one P(3) atom. In the seventh N site, N(7) is bonded in a bent 150 degrees geometry to one C(4) and one P(1) atom. In the eighth N site, N(8) is bonded in a bent 150 degrees geometry to one C(5) and one P(2) atom. In the ninth N site, N(9) is bonded in a bent 150 degrees geometry to one C(1) and one P(3) atom. There are six inequivalent S sites. In the first S site, S(1) is bonded in a single-bond geometry to one C(2) atom. In the second S site, S(2) is bonded in a single-bond geometry to one C(4) atom. In the third S site, S(3) is bonded in a single-bond geometry to one C(1) atom. In the fourth S site, S(4) is bonded in a single-bond geometry to one C(6) atom. In the fifth S site, S(5) is bonded in a single-bond geometry to one C(3) atom. In the sixth S site, S(6) is bonded in a single-bond geometry to one C(5) atom. is represented by the CIF file [CIF]
data_PC2S2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.198
_cell_length_b   10.513
_cell_length_c   11.988
_cell_angle_alpha   99.406
_cell_angle_beta   97.108
_cell_angle_gamma   95.819
_symmetry_Int_Tables_number   1
_cell_volume   1003.621
_cell_formula_units_Z   6
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  0.819  0.152  0.361  1.0
  P  P1  1  0.035  0.747  0.809  1.0
  P  P2  1  0.914  0.985  0.182  1.0
  P  P3  1  0.181  0.848  0.639  1.0
  P  P4  1  0.086  0.015  0.818  1.0
  P  P5  1  0.965  0.253  0.191  1.0
  C  C6  1  0.802  0.140  0.795  1.0
  C  C7  1  0.267  0.408  0.280  1.0
  C  C8  1  0.493  0.144  0.416  1.0
  C  C9  1  0.994  0.269  0.564  1.0
  C  C10  1  0.813  0.420  0.066  1.0
  C  C11  1  0.733  0.592  0.720  1.0
  C  C12  1  0.187  0.580  0.934  1.0
  C  C13  1  0.198  0.860  0.205  1.0
  C  C14  1  0.507  0.856  0.584  1.0
  C  C15  1  0.667  0.869  0.003  1.0
  C  C16  1  0.006  0.731  0.436  1.0
  C  C17  1  0.333  0.131  0.997  1.0
  S  S18  1  0.421  0.499  0.349  1.0
  S  S19  1  0.579  0.501  0.651  1.0
  S  S20  1  0.102  0.380  0.652  1.0
  S  S21  1  0.376  0.818  0.222  1.0
  S  S22  1  0.532  0.832  0.895  1.0
  S  S23  1  0.898  0.620  0.348  1.0
  S  S24  1  0.468  0.168  0.105  1.0
  S  S25  1  0.678  0.869  0.539  1.0
  S  S26  1  0.272  0.467  0.977  1.0
  S  S27  1  0.322  0.131  0.461  1.0
  S  S28  1  0.728  0.533  0.023  1.0
  S  S29  1  0.624  0.182  0.778  1.0
  N  N30  1  0.623  0.155  0.379  1.0
  N  N31  1  0.871  0.271  0.300  1.0
  N  N32  1  0.020  0.892  0.869  1.0
  N  N33  1  0.848  0.664  0.778  1.0
  N  N34  1  0.847  0.010  0.302  1.0
  N  N35  1  0.980  0.108  0.131  1.0
  N  N36  1  0.231  0.110  0.912  1.0
  N  N37  1  0.129  0.729  0.700  1.0
  N  N38  1  0.911  0.179  0.497  1.0
  N  N39  1  0.878  0.329  0.094  1.0
  N  N40  1  0.122  0.671  0.906  1.0
  N  N41  1  0.769  0.890  0.088  1.0
  N  N42  1  0.153  0.990  0.698  1.0
  N  N43  1  0.057  0.886  0.192  1.0
  N  N44  1  0.377  0.845  0.621  1.0
  N  N45  1  0.943  0.114  0.808  1.0
  N  N46  1  0.089  0.821  0.503  1.0
  N  N47  1  0.152  0.336  0.222  1.0
[/CIF]
.
The material described by C2PN3S2 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two C2PN3S2 clusters. There are six inequivalent C sites. In the first C site, C(1) is bonded in a distorted linear geometry to one N(9) and one S(3) atom. In the second C site, C(2) is bonded in a distorted linear geometry to one N(4) and one S(1) atom. In the third C site, C(3) is bonded in a distorted linear geometry to one N(1) and one S(5) atom. In the fourth C site, C(4) is bonded in a distorted linear geometry to one N(7) and one S(2) atom. In the fifth C site, C(5) is bonded in a distorted linear geometry to one N(8) and one S(6) atom. In the sixth C site, C(6) is bonded in a distorted linear geometry to one N(6) and one S(4) atom. There are three inequivalent P sites. In the first P site, P(1) is bonded to one N(1), one N(2), one N(5), and one N(7) atom to form corner-sharing PN4 tetrahedra. In the second P site, P(2) is bonded to one N(2), one N(3), one N(4), and one N(8) atom to form corner-sharing PN4 tetrahedra. In the third P site, P(3) is bonded to one N(3), one N(5), one N(6), and one N(9) atom to form corner-sharing PN4 tetrahedra. There are nine inequivalent N sites. In the first N site, N(1) is bonded in a linear geometry to one C(3) and one P(1) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one P(1) and one P(2) atom. In the third N site, N(3) is bonded in a bent 120 degrees geometry to one P(2) and one P(3) atom. In the fourth N site, N(4) is bonded in a bent 150 degrees geometry to one C(2) and one P(2) atom. In the fifth N site, N(5) is bonded in a bent 120 degrees geometry to one P(1) and one P(3) atom. In the sixth N site, N(6) is bonded in a bent 150 degrees geometry to one C(6) and one P(3) atom. In the seventh N site, N(7) is bonded in a bent 150 degrees geometry to one C(4) and one P(1) atom. In the eighth N site, N(8) is bonded in a bent 150 degrees geometry to one C(5) and one P(2) atom. In the ninth N site, N(9) is bonded in a bent 150 degrees geometry to one C(1) and one P(3) atom. There are six inequivalent S sites. In the first S site, S(1) is bonded in a single-bond geometry to one C(2) atom. In the second S site, S(2) is bonded in a single-bond geometry to one C(4) atom. In the third S site, S(3) is bonded in a single-bond geometry to one C(1) atom. In the fourth S site, S(4) is bonded in a single-bond geometry to one C(6) atom. In the fifth S site, S(5) is bonded in a single-bond geometry to one C(3) atom. In the sixth S site, S(6) is bonded in a single-bond geometry to one C(5) atom. is represented by the CIF file [CIF]
data_PC2S2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.198
_cell_length_b   10.513
_cell_length_c   11.988
_cell_angle_alpha   99.406
_cell_angle_beta   97.108
_cell_angle_gamma   95.819
_symmetry_Int_Tables_number   1
_cell_volume   1003.621
_cell_formula_units_Z   6
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  0.819  0.152  0.361  1.0
  P  P1  1  0.035  0.747  0.809  1.0
  P  P2  1  0.914  0.985  0.182  1.0
  P  P3  1  0.181  0.848  0.639  1.0
  P  P4  1  0.086  0.015  0.818  1.0
  P  P5  1  0.965  0.253  0.191  1.0
  C  C6  1  0.802  0.140  0.795  1.0
  C  C7  1  0.267  0.408  0.280  1.0
  C  C8  1  0.493  0.144  0.416  1.0
  C  C9  1  0.994  0.269  0.564  1.0
  C  C10  1  0.813  0.420  0.066  1.0
  C  C11  1  0.733  0.592  0.720  1.0
  C  C12  1  0.187  0.580  0.934  1.0
  C  C13  1  0.198  0.860  0.205  1.0
  C  C14  1  0.507  0.856  0.584  1.0
  C  C15  1  0.667  0.869  0.003  1.0
  C  C16  1  0.006  0.731  0.436  1.0
  C  C17  1  0.333  0.131  0.997  1.0
  S  S18  1  0.421  0.499  0.349  1.0
  S  S19  1  0.579  0.501  0.651  1.0
  S  S20  1  0.102  0.380  0.652  1.0
  S  S21  1  0.376  0.818  0.222  1.0
  S  S22  1  0.532  0.832  0.895  1.0
  S  S23  1  0.898  0.620  0.348  1.0
  S  S24  1  0.468  0.168  0.105  1.0
  S  S25  1  0.678  0.869  0.539  1.0
  S  S26  1  0.272  0.467  0.977  1.0
  S  S27  1  0.322  0.131  0.461  1.0
  S  S28  1  0.728  0.533  0.023  1.0
  S  S29  1  0.624  0.182  0.778  1.0
  N  N30  1  0.623  0.155  0.379  1.0
  N  N31  1  0.871  0.271  0.300  1.0
  N  N32  1  0.020  0.892  0.869  1.0
  N  N33  1  0.848  0.664  0.778  1.0
  N  N34  1  0.847  0.010  0.302  1.0
  N  N35  1  0.980  0.108  0.131  1.0
  N  N36  1  0.231  0.110  0.912  1.0
  N  N37  1  0.129  0.729  0.700  1.0
  N  N38  1  0.911  0.179  0.497  1.0
  N  N39  1  0.878  0.329  0.094  1.0
  N  N40  1  0.122  0.671  0.906  1.0
  N  N41  1  0.769  0.890  0.088  1.0
  N  N42  1  0.153  0.990  0.698  1.0
  N  N43  1  0.057  0.886  0.192  1.0
  N  N44  1  0.377  0.845  0.621  1.0
  N  N45  1  0.943  0.114  0.808  1.0
  N  N46  1  0.089  0.821  0.503  1.0
  N  N47  1  0.152  0.336  0.222  1.0
[/CIF]
.