The material described by KCN2H3SO crystallizes in the monoclinic P2_1/c space group. K(1) is bonded in a 10-coordinate geometry to one N(2), two equivalent H(2), two equivalent H(3), two equivalent S(1), and three equivalent O(1) atoms. C(1) is bonded in a linear geometry to one N(1) and one O(1) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a bent 150 degrees geometry to one C(1) and one H(1) atom. In the second N site, N(2) is bonded in a distorted bent 150 degrees geometry to one K(1) and one S(1) atom. There are three inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(1) atom. In the second H site, H(2) is bonded in a distorted single-bond geometry to two equivalent K(1) and one H(3) atom. In the third H site, H(3) is bonded in a distorted single-bond geometry to two equivalent K(1) and one H(2) atom. S(1) is bonded in a single-bond geometry to two equivalent K(1) and one N(2) atom. O(1) is bonded in a distorted single-bond geometry to three equivalent K(1) and one C(1) atom. is represented by the CIF file [CIF]
data_KH3CSN2O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.773
_cell_length_b   5.317
_cell_length_c   9.317
_cell_angle_alpha   85.316
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   630.668
_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
  K  K0  1  0.831  0.260  0.032  1.0
  K  K1  1  0.169  0.740  0.968  1.0
  K  K2  1  0.331  0.740  0.468  1.0
  K  K3  1  0.669  0.260  0.532  1.0
  H  H4  1  0.928  0.715  0.467  1.0
  H  H5  1  0.072  0.285  0.533  1.0
  H  H6  1  0.428  0.285  0.033  1.0
  H  H7  1  0.572  0.715  0.967  1.0
  H  H8  1  0.315  0.833  0.155  1.0
  H  H9  1  0.685  0.167  0.845  1.0
  H  H10  1  0.815  0.167  0.345  1.0
  H  H11  1  0.185  0.833  0.655  1.0
  H  H12  1  0.772  0.105  0.303  1.0
  H  H13  1  0.228  0.895  0.697  1.0
  H  H14  1  0.272  0.895  0.197  1.0
  H  H15  1  0.728  0.105  0.803  1.0
  C  C16  1  0.952  0.757  0.242  1.0
  C  C17  1  0.048  0.243  0.758  1.0
  C  C18  1  0.452  0.243  0.258  1.0
  C  C19  1  0.548  0.757  0.742  1.0
  S  S20  1  0.643  0.641  0.181  1.0
  S  S21  1  0.357  0.359  0.819  1.0
  S  S22  1  0.143  0.359  0.319  1.0
  S  S23  1  0.857  0.641  0.681  1.0
  N  N24  1  0.951  0.794  0.367  1.0
  N  N25  1  0.049  0.206  0.633  1.0
  N  N26  1  0.451  0.206  0.133  1.0
  N  N27  1  0.549  0.794  0.867  1.0
  N  N28  1  0.682  0.923  0.166  1.0
  N  N29  1  0.318  0.077  0.834  1.0
  N  N30  1  0.182  0.077  0.334  1.0
  N  N31  1  0.818  0.923  0.666  1.0
  O  O32  1  0.958  0.749  0.114  1.0
  O  O33  1  0.042  0.251  0.886  1.0
  O  O34  1  0.458  0.251  0.386  1.0
  O  O35  1  0.542  0.749  0.614  1.0
[/CIF]
.
The material described by KCN2H3SO crystallizes in the monoclinic P2_1/c space group. K(1) is bonded in a 10-coordinate geometry to one N(2), two equivalent H(2), two equivalent H(3), two equivalent S(1), and three equivalent O(1) atoms. C(1) is bonded in a linear geometry to one N(1) and one O(1) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a bent 150 degrees geometry to one C(1) and one H(1) atom. In the second N site, N(2) is bonded in a distorted bent 150 degrees geometry to one K(1) and one S(1) atom. There are three inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(1) atom. In the second H site, H(2) is bonded in a distorted single-bond geometry to two equivalent K(1) and one H(3) atom. In the third H site, H(3) is bonded in a distorted single-bond geometry to two equivalent K(1) and one H(2) atom. S(1) is bonded in a single-bond geometry to two equivalent K(1) and one N(2) atom. O(1) is bonded in a distorted single-bond geometry to three equivalent K(1) and one C(1) atom. is represented by the CIF file [CIF]
data_KH3CSN2O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.773
_cell_length_b   5.317
_cell_length_c   9.317
_cell_angle_alpha   85.316
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   630.668
_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
  K  K0  1  0.831  0.260  0.032  1.0
  K  K1  1  0.169  0.740  0.968  1.0
  K  K2  1  0.331  0.740  0.468  1.0
  K  K3  1  0.669  0.260  0.532  1.0
  H  H4  1  0.928  0.715  0.467  1.0
  H  H5  1  0.072  0.285  0.533  1.0
  H  H6  1  0.428  0.285  0.033  1.0
  H  H7  1  0.572  0.715  0.967  1.0
  H  H8  1  0.315  0.833  0.155  1.0
  H  H9  1  0.685  0.167  0.845  1.0
  H  H10  1  0.815  0.167  0.345  1.0
  H  H11  1  0.185  0.833  0.655  1.0
  H  H12  1  0.772  0.105  0.303  1.0
  H  H13  1  0.228  0.895  0.697  1.0
  H  H14  1  0.272  0.895  0.197  1.0
  H  H15  1  0.728  0.105  0.803  1.0
  C  C16  1  0.952  0.757  0.242  1.0
  C  C17  1  0.048  0.243  0.758  1.0
  C  C18  1  0.452  0.243  0.258  1.0
  C  C19  1  0.548  0.757  0.742  1.0
  S  S20  1  0.643  0.641  0.181  1.0
  S  S21  1  0.357  0.359  0.819  1.0
  S  S22  1  0.143  0.359  0.319  1.0
  S  S23  1  0.857  0.641  0.681  1.0
  N  N24  1  0.951  0.794  0.367  1.0
  N  N25  1  0.049  0.206  0.633  1.0
  N  N26  1  0.451  0.206  0.133  1.0
  N  N27  1  0.549  0.794  0.867  1.0
  N  N28  1  0.682  0.923  0.166  1.0
  N  N29  1  0.318  0.077  0.834  1.0
  N  N30  1  0.182  0.077  0.334  1.0
  N  N31  1  0.818  0.923  0.666  1.0
  O  O32  1  0.958  0.749  0.114  1.0
  O  O33  1  0.042  0.251  0.886  1.0
  O  O34  1  0.458  0.251  0.386  1.0
  O  O35  1  0.542  0.749  0.614  1.0
[/CIF]
.