The crystal structure described by C2S3I is diamond structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight C2S3I clusters. There are four inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one C(4), one S(3), and one S(4) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one C(4), one S(2), and one S(6) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one S(1), one S(3), and one S(5) atom. In the fourth C site, C(4) is bonded in a trigonal planar geometry to one C(1), one C(2), and one S(1) atom. There are six inequivalent S sites. In the first S site, S(1) is bonded in an L-shaped geometry to one C(3) and one C(4) atom. In the second S site, S(2) is bonded in a water-like geometry to one C(2) and one I(1) atom. In the third S site, S(3) is bonded in an L-shaped geometry to one C(1) and one C(3) atom. In the fourth S site, S(4) is bonded in an L-shaped geometry to one C(1) and one S(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 distorted water-like geometry to one C(2) and one S(4) atom. There are two inequivalent I sites. In the first I site, I(1) is bonded in a linear geometry to one S(2) and one I(2) atom. In the second I site, I(2) is bonded in a single-bond geometry to one I(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_C2S3I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.832
_cell_length_b   9.832
_cell_length_c   16.677
_cell_angle_alpha   69.449
_cell_angle_beta   69.449
_cell_angle_gamma   63.061
_symmetry_Int_Tables_number   1
_cell_volume   1309.559
_cell_formula_units_Z   8
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
  C  C0  1  0.808  0.919  0.751  1.0
  C  C1  1  0.192  0.081  0.249  1.0
  C  C2  1  0.081  0.192  0.749  1.0
  C  C3  1  0.919  0.808  0.251  1.0
  C  C4  1  0.642  0.100  0.846  1.0
  C  C5  1  0.358  0.900  0.154  1.0
  C  C6  1  0.900  0.358  0.654  1.0
  C  C7  1  0.100  0.642  0.346  1.0
  C  C8  1  0.682  0.025  0.617  1.0
  C  C9  1  0.318  0.975  0.383  1.0
  C  C10  1  0.975  0.318  0.883  1.0
  C  C11  1  0.025  0.682  0.117  1.0
  C  C12  1  0.676  0.053  0.767  1.0
  C  C13  1  0.324  0.947  0.233  1.0
  C  C14  1  0.947  0.324  0.733  1.0
  C  C15  1  0.053  0.676  0.267  1.0
  S  S16  1  0.568  0.152  0.687  1.0
  S  S17  1  0.432  0.848  0.313  1.0
  S  S18  1  0.848  0.432  0.813  1.0
  S  S19  1  0.152  0.568  0.187  1.0
  S  S20  1  0.488  0.261  0.874  1.0
  S  S21  1  0.512  0.739  0.126  1.0
  S  S22  1  0.739  0.512  0.626  1.0
  S  S23  1  0.261  0.488  0.374  1.0
  S  S24  1  0.846  0.869  0.654  1.0
  S  S25  1  0.154  0.131  0.346  1.0
  S  S26  1  0.131  0.154  0.846  1.0
  S  S27  1  0.869  0.846  0.154  1.0
  S  S28  1  0.183  0.082  0.671  1.0
  S  S29  1  0.817  0.918  0.329  1.0
  S  S30  1  0.918  0.817  0.829  1.0
  S  S31  1  0.082  0.183  0.171  1.0
  S  S32  1  0.643  0.049  0.524  1.0
  S  S33  1  0.357  0.951  0.476  1.0
  S  S34  1  0.951  0.357  0.976  1.0
  S  S35  1  0.049  0.643  0.024  1.0
  S  S36  1  0.774  0.974  0.911  1.0
  S  S37  1  0.226  0.026  0.089  1.0
  S  S38  1  0.026  0.226  0.589  1.0
  S  S39  1  0.974  0.774  0.411  1.0
  I  I40  1  0.255  0.532  0.528  1.0
  I  I41  1  0.745  0.468  0.472  1.0
  I  I42  1  0.468  0.745  0.972  1.0
  I  I43  1  0.532  0.255  0.028  1.0
  I  I44  1  0.407  0.751  0.811  1.0
  I  I45  1  0.593  0.249  0.189  1.0
  I  I46  1  0.249  0.593  0.689  1.0
  I  I47  1  0.751  0.407  0.311  1.0
[/CIF]
.
The crystal structure described by C2S3I is diamond structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight C2S3I clusters. There are four inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one C(4), one S(3), and one S(4) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one C(4), one S(2), and one S(6) atom. In the third C site, C(3) is bonded in a trigonal planar geometry to one S(1), one S(3), and one S(5) atom. In the fourth C site, C(4) is bonded in a trigonal planar geometry to one C(1), one C(2), and one S(1) atom. There are six inequivalent S sites. In the first S site, S(1) is bonded in an L-shaped geometry to one C(3) and one C(4) atom. In the second S site, S(2) is bonded in a water-like geometry to one C(2) and one I(1) atom. In the third S site, S(3) is bonded in an L-shaped geometry to one C(1) and one C(3) atom. In the fourth S site, S(4) is bonded in an L-shaped geometry to one C(1) and one S(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 distorted water-like geometry to one C(2) and one S(4) atom. There are two inequivalent I sites. In the first I site, I(1) is bonded in a linear geometry to one S(2) and one I(2) atom. In the second I site, I(2) is bonded in a single-bond geometry to one I(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_C2S3I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.832
_cell_length_b   9.832
_cell_length_c   16.677
_cell_angle_alpha   69.449
_cell_angle_beta   69.449
_cell_angle_gamma   63.061
_symmetry_Int_Tables_number   1
_cell_volume   1309.559
_cell_formula_units_Z   8
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
  C  C0  1  0.808  0.919  0.751  1.0
  C  C1  1  0.192  0.081  0.249  1.0
  C  C2  1  0.081  0.192  0.749  1.0
  C  C3  1  0.919  0.808  0.251  1.0
  C  C4  1  0.642  0.100  0.846  1.0
  C  C5  1  0.358  0.900  0.154  1.0
  C  C6  1  0.900  0.358  0.654  1.0
  C  C7  1  0.100  0.642  0.346  1.0
  C  C8  1  0.682  0.025  0.617  1.0
  C  C9  1  0.318  0.975  0.383  1.0
  C  C10  1  0.975  0.318  0.883  1.0
  C  C11  1  0.025  0.682  0.117  1.0
  C  C12  1  0.676  0.053  0.767  1.0
  C  C13  1  0.324  0.947  0.233  1.0
  C  C14  1  0.947  0.324  0.733  1.0
  C  C15  1  0.053  0.676  0.267  1.0
  S  S16  1  0.568  0.152  0.687  1.0
  S  S17  1  0.432  0.848  0.313  1.0
  S  S18  1  0.848  0.432  0.813  1.0
  S  S19  1  0.152  0.568  0.187  1.0
  S  S20  1  0.488  0.261  0.874  1.0
  S  S21  1  0.512  0.739  0.126  1.0
  S  S22  1  0.739  0.512  0.626  1.0
  S  S23  1  0.261  0.488  0.374  1.0
  S  S24  1  0.846  0.869  0.654  1.0
  S  S25  1  0.154  0.131  0.346  1.0
  S  S26  1  0.131  0.154  0.846  1.0
  S  S27  1  0.869  0.846  0.154  1.0
  S  S28  1  0.183  0.082  0.671  1.0
  S  S29  1  0.817  0.918  0.329  1.0
  S  S30  1  0.918  0.817  0.829  1.0
  S  S31  1  0.082  0.183  0.171  1.0
  S  S32  1  0.643  0.049  0.524  1.0
  S  S33  1  0.357  0.951  0.476  1.0
  S  S34  1  0.951  0.357  0.976  1.0
  S  S35  1  0.049  0.643  0.024  1.0
  S  S36  1  0.774  0.974  0.911  1.0
  S  S37  1  0.226  0.026  0.089  1.0
  S  S38  1  0.026  0.226  0.589  1.0
  S  S39  1  0.974  0.774  0.411  1.0
  I  I40  1  0.255  0.532  0.528  1.0
  I  I41  1  0.745  0.468  0.472  1.0
  I  I42  1  0.468  0.745  0.972  1.0
  I  I43  1  0.532  0.255  0.028  1.0
  I  I44  1  0.407  0.751  0.811  1.0
  I  I45  1  0.593  0.249  0.189  1.0
  I  I46  1  0.249  0.593  0.689  1.0
  I  I47  1  0.751  0.407  0.311  1.0
[/CIF]
.