The material structure described by NSOCl is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four NSOCl clusters. There are three inequivalent N sites. In the first N site, N(1) is bonded in a bent 120 degrees geometry to one S(1) and one S(2) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one S(1) and one S(3) atom. In the third N site, N(3) is bonded in a bent 120 degrees geometry to one S(2) and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded to one N(1), one N(2), one O(2), and one Cl(2) atom to form corner-sharing SN2ClO tetrahedra. In the second S site, S(2) is bonded to one N(1), one N(3), one O(3), and one Cl(3) atom to form corner-sharing SN2ClO tetrahedra. In the third S site, S(3) is bonded to one N(2), one N(3), one O(1), and one Cl(1) atom to form corner-sharing SN2ClO tetrahedra. There are three inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one S(3) atom. In the second O site, O(3) is bonded in a single-bond geometry to one S(2) atom. In the third O site, O(2) is bonded in a single-bond geometry to one S(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one S(3) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one S(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one S(2) atom. is represented by the CIF file [CIF]
data_SNClO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.617
_cell_length_b   5.831
_cell_length_c   14.286
_cell_angle_alpha   71.955
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   920.092
_cell_formula_units_Z   12
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
  S  S0  1  0.524  0.282  0.856  1.0
  S  S1  1  0.024  0.718  0.644  1.0
  S  S2  1  0.476  0.718  0.144  1.0
  S  S3  1  0.901  0.550  0.819  1.0
  S  S4  1  0.787  0.742  0.642  1.0
  S  S5  1  0.713  0.742  0.142  1.0
  S  S6  1  0.287  0.258  0.858  1.0
  S  S7  1  0.401  0.450  0.681  1.0
  S  S8  1  0.213  0.258  0.358  1.0
  S  S9  1  0.099  0.450  0.181  1.0
  S  S10  1  0.976  0.282  0.356  1.0
  S  S11  1  0.599  0.550  0.319  1.0
  N  N12  1  0.006  0.528  0.751  1.0
  N  N13  1  0.408  0.152  0.903  1.0
  N  N14  1  0.092  0.152  0.403  1.0
  N  N15  1  0.994  0.472  0.249  1.0
  N  N16  1  0.714  0.646  0.259  1.0
  N  N17  1  0.908  0.848  0.597  1.0
  N  N18  1  0.592  0.848  0.097  1.0
  N  N19  1  0.214  0.354  0.241  1.0
  N  N20  1  0.506  0.472  0.749  1.0
  N  N21  1  0.286  0.354  0.741  1.0
  N  N22  1  0.786  0.646  0.759  1.0
  N  N23  1  0.494  0.528  0.251  1.0
  Cl  Cl24  1  0.244  0.555  0.402  1.0
  Cl  Cl25  1  0.756  0.445  0.598  1.0
  Cl  Cl26  1  0.617  0.002  0.838  1.0
  Cl  Cl27  1  0.117  0.998  0.662  1.0
  Cl  Cl28  1  0.060  0.188  0.119  1.0
  Cl  Cl29  1  0.440  0.188  0.619  1.0
  Cl  Cl30  1  0.383  0.998  0.162  1.0
  Cl  Cl31  1  0.940  0.812  0.881  1.0
  Cl  Cl32  1  0.883  0.002  0.338  1.0
  Cl  Cl33  1  0.256  0.555  0.902  1.0
  Cl  Cl34  1  0.560  0.812  0.381  1.0
  Cl  Cl35  1  0.744  0.445  0.098  1.0
  O  O36  1  0.696  0.908  0.604  1.0
  O  O37  1  0.089  0.615  0.583  1.0
  O  O38  1  0.386  0.669  0.602  1.0
  O  O39  1  0.196  0.092  0.896  1.0
  O  O40  1  0.114  0.669  0.102  1.0
  O  O41  1  0.886  0.331  0.898  1.0
  O  O42  1  0.589  0.385  0.917  1.0
  O  O43  1  0.804  0.908  0.104  1.0
  O  O44  1  0.411  0.615  0.083  1.0
  O  O45  1  0.614  0.331  0.398  1.0
  O  O46  1  0.911  0.385  0.417  1.0
  O  O47  1  0.304  0.092  0.396  1.0
[/CIF]
.
The material structure described by NSOCl is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four NSOCl clusters. There are three inequivalent N sites. In the first N site, N(1) is bonded in a bent 120 degrees geometry to one S(1) and one S(2) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one S(1) and one S(3) atom. In the third N site, N(3) is bonded in a bent 120 degrees geometry to one S(2) and one S(3) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded to one N(1), one N(2), one O(2), and one Cl(2) atom to form corner-sharing SN2ClO tetrahedra. In the second S site, S(2) is bonded to one N(1), one N(3), one O(3), and one Cl(3) atom to form corner-sharing SN2ClO tetrahedra. In the third S site, S(3) is bonded to one N(2), one N(3), one O(1), and one Cl(1) atom to form corner-sharing SN2ClO tetrahedra. There are three inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one S(3) atom. In the second O site, O(3) is bonded in a single-bond geometry to one S(2) atom. In the third O site, O(2) is bonded in a single-bond geometry to one S(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one S(3) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one S(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one S(2) atom. is represented by the CIF file [CIF]
data_SNClO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.617
_cell_length_b   5.831
_cell_length_c   14.286
_cell_angle_alpha   71.955
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   920.092
_cell_formula_units_Z   12
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
  S  S0  1  0.524  0.282  0.856  1.0
  S  S1  1  0.024  0.718  0.644  1.0
  S  S2  1  0.476  0.718  0.144  1.0
  S  S3  1  0.901  0.550  0.819  1.0
  S  S4  1  0.787  0.742  0.642  1.0
  S  S5  1  0.713  0.742  0.142  1.0
  S  S6  1  0.287  0.258  0.858  1.0
  S  S7  1  0.401  0.450  0.681  1.0
  S  S8  1  0.213  0.258  0.358  1.0
  S  S9  1  0.099  0.450  0.181  1.0
  S  S10  1  0.976  0.282  0.356  1.0
  S  S11  1  0.599  0.550  0.319  1.0
  N  N12  1  0.006  0.528  0.751  1.0
  N  N13  1  0.408  0.152  0.903  1.0
  N  N14  1  0.092  0.152  0.403  1.0
  N  N15  1  0.994  0.472  0.249  1.0
  N  N16  1  0.714  0.646  0.259  1.0
  N  N17  1  0.908  0.848  0.597  1.0
  N  N18  1  0.592  0.848  0.097  1.0
  N  N19  1  0.214  0.354  0.241  1.0
  N  N20  1  0.506  0.472  0.749  1.0
  N  N21  1  0.286  0.354  0.741  1.0
  N  N22  1  0.786  0.646  0.759  1.0
  N  N23  1  0.494  0.528  0.251  1.0
  Cl  Cl24  1  0.244  0.555  0.402  1.0
  Cl  Cl25  1  0.756  0.445  0.598  1.0
  Cl  Cl26  1  0.617  0.002  0.838  1.0
  Cl  Cl27  1  0.117  0.998  0.662  1.0
  Cl  Cl28  1  0.060  0.188  0.119  1.0
  Cl  Cl29  1  0.440  0.188  0.619  1.0
  Cl  Cl30  1  0.383  0.998  0.162  1.0
  Cl  Cl31  1  0.940  0.812  0.881  1.0
  Cl  Cl32  1  0.883  0.002  0.338  1.0
  Cl  Cl33  1  0.256  0.555  0.902  1.0
  Cl  Cl34  1  0.560  0.812  0.381  1.0
  Cl  Cl35  1  0.744  0.445  0.098  1.0
  O  O36  1  0.696  0.908  0.604  1.0
  O  O37  1  0.089  0.615  0.583  1.0
  O  O38  1  0.386  0.669  0.602  1.0
  O  O39  1  0.196  0.092  0.896  1.0
  O  O40  1  0.114  0.669  0.102  1.0
  O  O41  1  0.886  0.331  0.898  1.0
  O  O42  1  0.589  0.385  0.917  1.0
  O  O43  1  0.804  0.908  0.104  1.0
  O  O44  1  0.411  0.615  0.083  1.0
  O  O45  1  0.614  0.331  0.398  1.0
  O  O46  1  0.911  0.385  0.417  1.0
  O  O47  1  0.304  0.092  0.396  1.0
[/CIF]
.