The structure described by CoH4S(NO2)2 crystallizes in the orthorhombic Pccn space group. Co(1) is bonded to two equivalent N(1), two equivalent O(1), and two equivalent O(2) atoms to form CoN2O4 octahedra that share corners with four equivalent S(1)O4 tetrahedra. N(1) is bonded in a distorted water-like geometry to one Co(1), one H(1), and one H(2) atom. There are two 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 single-bond geometry to one N(1) atom. S(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form SO4 tetrahedra that share corners with four equivalent Co(1)N2O4 octahedra. The corner-sharing octahedral tilt angles range from 37-47°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Co(1) and one S(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one Co(1) and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CoH4S(NO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.570
_cell_length_b   7.714
_cell_length_c   8.969
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   454.586
_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
  Co  Co0  1  0.000  0.500  0.500  1.0
  Co  Co1  1  0.500  0.000  0.500  1.0
  Co  Co2  1  0.500  0.500  0.000  1.0
  Co  Co3  1  0.000  0.000  0.000  1.0
  H  H4  1  0.303  0.381  0.674  1.0
  H  H5  1  0.197  0.119  0.674  1.0
  H  H6  1  0.803  0.619  0.826  1.0
  H  H7  1  0.697  0.881  0.826  1.0
  H  H8  1  0.697  0.619  0.326  1.0
  H  H9  1  0.803  0.881  0.326  1.0
  H  H10  1  0.197  0.381  0.174  1.0
  H  H11  1  0.303  0.119  0.174  1.0
  H  H12  1  0.373  0.374  0.498  1.0
  H  H13  1  0.127  0.126  0.498  1.0
  H  H14  1  0.873  0.626  0.002  1.0
  H  H15  1  0.627  0.874  0.002  1.0
  H  H16  1  0.627  0.626  0.502  1.0
  H  H17  1  0.873  0.874  0.502  1.0
  H  H18  1  0.127  0.374  0.998  1.0
  H  H19  1  0.373  0.126  0.998  1.0
  S  S20  1  0.750  0.250  0.758  1.0
  S  S21  1  0.250  0.750  0.742  1.0
  S  S22  1  0.250  0.750  0.242  1.0
  S  S23  1  0.750  0.250  0.258  1.0
  N  N24  1  0.256  0.345  0.569  1.0
  N  N25  1  0.244  0.155  0.569  1.0
  N  N26  1  0.756  0.655  0.931  1.0
  N  N27  1  0.744  0.845  0.931  1.0
  N  N28  1  0.744  0.655  0.431  1.0
  N  N29  1  0.756  0.845  0.431  1.0
  N  N30  1  0.244  0.345  0.069  1.0
  N  N31  1  0.256  0.155  0.069  1.0
  O  O32  1  0.931  0.208  0.852  1.0
  O  O33  1  0.569  0.292  0.852  1.0
  O  O34  1  0.431  0.792  0.648  1.0
  O  O35  1  0.069  0.708  0.648  1.0
  O  O36  1  0.069  0.792  0.148  1.0
  O  O37  1  0.431  0.708  0.148  1.0
  O  O38  1  0.569  0.208  0.352  1.0
  O  O39  1  0.931  0.292  0.352  1.0
  O  O40  1  0.797  0.404  0.664  1.0
  O  O41  1  0.703  0.096  0.664  1.0
  O  O42  1  0.297  0.596  0.836  1.0
  O  O43  1  0.203  0.904  0.836  1.0
  O  O44  1  0.203  0.596  0.336  1.0
  O  O45  1  0.297  0.904  0.336  1.0
  O  O46  1  0.703  0.404  0.164  1.0
  O  O47  1  0.797  0.096  0.164  1.0
[/CIF]
.
The structure described by CoH4S(NO2)2 crystallizes in the orthorhombic Pccn space group. Co(1) is bonded to two equivalent N(1), two equivalent O(1), and two equivalent O(2) atoms to form CoN2O4 octahedra that share corners with four equivalent S(1)O4 tetrahedra. N(1) is bonded in a distorted water-like geometry to one Co(1), one H(1), and one H(2) atom. There are two 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 single-bond geometry to one N(1) atom. S(1) is bonded to two equivalent O(1) and two equivalent O(2) atoms to form SO4 tetrahedra that share corners with four equivalent Co(1)N2O4 octahedra. The corner-sharing octahedral tilt angles range from 37-47°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Co(1) and one S(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one Co(1) and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CoH4S(NO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.570
_cell_length_b   7.714
_cell_length_c   8.969
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   454.586
_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
  Co  Co0  1  0.000  0.500  0.500  1.0
  Co  Co1  1  0.500  0.000  0.500  1.0
  Co  Co2  1  0.500  0.500  0.000  1.0
  Co  Co3  1  0.000  0.000  0.000  1.0
  H  H4  1  0.303  0.381  0.674  1.0
  H  H5  1  0.197  0.119  0.674  1.0
  H  H6  1  0.803  0.619  0.826  1.0
  H  H7  1  0.697  0.881  0.826  1.0
  H  H8  1  0.697  0.619  0.326  1.0
  H  H9  1  0.803  0.881  0.326  1.0
  H  H10  1  0.197  0.381  0.174  1.0
  H  H11  1  0.303  0.119  0.174  1.0
  H  H12  1  0.373  0.374  0.498  1.0
  H  H13  1  0.127  0.126  0.498  1.0
  H  H14  1  0.873  0.626  0.002  1.0
  H  H15  1  0.627  0.874  0.002  1.0
  H  H16  1  0.627  0.626  0.502  1.0
  H  H17  1  0.873  0.874  0.502  1.0
  H  H18  1  0.127  0.374  0.998  1.0
  H  H19  1  0.373  0.126  0.998  1.0
  S  S20  1  0.750  0.250  0.758  1.0
  S  S21  1  0.250  0.750  0.742  1.0
  S  S22  1  0.250  0.750  0.242  1.0
  S  S23  1  0.750  0.250  0.258  1.0
  N  N24  1  0.256  0.345  0.569  1.0
  N  N25  1  0.244  0.155  0.569  1.0
  N  N26  1  0.756  0.655  0.931  1.0
  N  N27  1  0.744  0.845  0.931  1.0
  N  N28  1  0.744  0.655  0.431  1.0
  N  N29  1  0.756  0.845  0.431  1.0
  N  N30  1  0.244  0.345  0.069  1.0
  N  N31  1  0.256  0.155  0.069  1.0
  O  O32  1  0.931  0.208  0.852  1.0
  O  O33  1  0.569  0.292  0.852  1.0
  O  O34  1  0.431  0.792  0.648  1.0
  O  O35  1  0.069  0.708  0.648  1.0
  O  O36  1  0.069  0.792  0.148  1.0
  O  O37  1  0.431  0.708  0.148  1.0
  O  O38  1  0.569  0.208  0.352  1.0
  O  O39  1  0.931  0.292  0.352  1.0
  O  O40  1  0.797  0.404  0.664  1.0
  O  O41  1  0.703  0.096  0.664  1.0
  O  O42  1  0.297  0.596  0.836  1.0
  O  O43  1  0.203  0.904  0.836  1.0
  O  O44  1  0.203  0.596  0.336  1.0
  O  O45  1  0.297  0.904  0.336  1.0
  O  O46  1  0.703  0.404  0.164  1.0
  O  O47  1  0.797  0.096  0.164  1.0
[/CIF]
.