The structure described by NiC4H16S4(N4Cl)2 is Indium-like structured and crystallizes in the tetragonal I4 space group. The structure is zero-dimensional and consists of two NiC4H16S4(N4Cl)2 clusters. Ni(1) is bonded in an octahedral geometry to four equivalent S(1), one Cl(1), and one Cl(2) atom. C(1) is bonded in a distorted trigonal planar geometry to one N(1), one N(2), and one S(1) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one C(1), one H(1), and one H(2) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one C(1), one H(3), and one H(4) atom. There are four 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. In the third H site, H(3) is bonded in a single-bond geometry to one N(2) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one N(2) atom. S(1) is bonded in a bent 120 degrees geometry to one Ni(1) and one C(1) atom. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Ni(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one Ni(1) atom. is represented by the CIF file [CIF]
data_NiH16C4S4(N4Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.213
_cell_length_b   8.213
_cell_length_c   8.213
_cell_angle_alpha   107.627
_cell_angle_beta   107.627
_cell_angle_gamma   113.225
_symmetry_Int_Tables_number   1
_cell_volume   425.033
_cell_formula_units_Z   1
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
  Ni  Ni0  1  0.000  0.000  0.000  1.0
  H  H1  1  0.546  0.886  0.352  1.0
  H  H2  1  0.535  0.194  0.648  1.0
  H  H3  1  0.886  0.535  0.341  1.0
  H  H4  1  0.194  0.546  0.659  1.0
  H  H5  1  0.394  0.621  0.216  1.0
  H  H6  1  0.405  0.177  0.784  1.0
  H  H7  1  0.621  0.405  0.228  1.0
  H  H8  1  0.177  0.394  0.772  1.0
  H  H9  1  0.040  0.459  0.020  1.0
  H  H10  1  0.439  0.020  0.980  1.0
  H  H11  1  0.459  0.439  0.420  1.0
  H  H12  1  0.020  0.040  0.580  1.0
  H  H13  1  0.945  0.614  0.993  1.0
  H  H14  1  0.620  0.952  0.007  1.0
  H  H15  1  0.614  0.620  0.669  1.0
  H  H16  1  0.952  0.945  0.331  1.0
  C  C17  1  0.247  0.769  0.175  1.0
  C  C18  1  0.594  0.072  0.825  1.0
  C  C19  1  0.769  0.594  0.523  1.0
  C  C20  1  0.072  0.247  0.477  1.0
  S  S21  1  0.280  0.002  0.220  1.0
  S  S22  1  0.782  0.060  0.780  1.0
  S  S23  1  0.002  0.782  0.722  1.0
  S  S24  1  0.060  0.280  0.278  1.0
  N  N25  1  0.406  0.758  0.261  1.0
  N  N26  1  0.497  0.144  0.739  1.0
  N  N27  1  0.758  0.497  0.352  1.0
  N  N28  1  0.144  0.406  0.648  1.0
  N  N29  1  0.065  0.600  0.054  1.0
  N  N30  1  0.546  0.011  0.946  1.0
  N  N31  1  0.600  0.546  0.536  1.0
  N  N32  1  0.011  0.065  0.464  1.0
  Cl  Cl33  1  0.734  0.734  0.000  1.0
  Cl  Cl34  1  0.281  0.281  0.000  1.0
[/CIF]
.
The structure described by NiC4H16S4(N4Cl)2 is Indium-like structured and crystallizes in the tetragonal I4 space group. The structure is zero-dimensional and consists of two NiC4H16S4(N4Cl)2 clusters. Ni(1) is bonded in an octahedral geometry to four equivalent S(1), one Cl(1), and one Cl(2) atom. C(1) is bonded in a distorted trigonal planar geometry to one N(1), one N(2), and one S(1) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one C(1), one H(1), and one H(2) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one C(1), one H(3), and one H(4) atom. There are four 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. In the third H site, H(3) is bonded in a single-bond geometry to one N(2) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one N(2) atom. S(1) is bonded in a bent 120 degrees geometry to one Ni(1) and one C(1) atom. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Ni(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one Ni(1) atom. is represented by the CIF file [CIF]
data_NiH16C4S4(N4Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.213
_cell_length_b   8.213
_cell_length_c   8.213
_cell_angle_alpha   107.627
_cell_angle_beta   107.627
_cell_angle_gamma   113.225
_symmetry_Int_Tables_number   1
_cell_volume   425.033
_cell_formula_units_Z   1
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
  Ni  Ni0  1  0.000  0.000  0.000  1.0
  H  H1  1  0.546  0.886  0.352  1.0
  H  H2  1  0.535  0.194  0.648  1.0
  H  H3  1  0.886  0.535  0.341  1.0
  H  H4  1  0.194  0.546  0.659  1.0
  H  H5  1  0.394  0.621  0.216  1.0
  H  H6  1  0.405  0.177  0.784  1.0
  H  H7  1  0.621  0.405  0.228  1.0
  H  H8  1  0.177  0.394  0.772  1.0
  H  H9  1  0.040  0.459  0.020  1.0
  H  H10  1  0.439  0.020  0.980  1.0
  H  H11  1  0.459  0.439  0.420  1.0
  H  H12  1  0.020  0.040  0.580  1.0
  H  H13  1  0.945  0.614  0.993  1.0
  H  H14  1  0.620  0.952  0.007  1.0
  H  H15  1  0.614  0.620  0.669  1.0
  H  H16  1  0.952  0.945  0.331  1.0
  C  C17  1  0.247  0.769  0.175  1.0
  C  C18  1  0.594  0.072  0.825  1.0
  C  C19  1  0.769  0.594  0.523  1.0
  C  C20  1  0.072  0.247  0.477  1.0
  S  S21  1  0.280  0.002  0.220  1.0
  S  S22  1  0.782  0.060  0.780  1.0
  S  S23  1  0.002  0.782  0.722  1.0
  S  S24  1  0.060  0.280  0.278  1.0
  N  N25  1  0.406  0.758  0.261  1.0
  N  N26  1  0.497  0.144  0.739  1.0
  N  N27  1  0.758  0.497  0.352  1.0
  N  N28  1  0.144  0.406  0.648  1.0
  N  N29  1  0.065  0.600  0.054  1.0
  N  N30  1  0.546  0.011  0.946  1.0
  N  N31  1  0.600  0.546  0.536  1.0
  N  N32  1  0.011  0.065  0.464  1.0
  Cl  Cl33  1  0.734  0.734  0.000  1.0
  Cl  Cl34  1  0.281  0.281  0.000  1.0
[/CIF]
.