The material structure described by V(H2O)6(CF3)2(SO3)2 crystallizes in the monoclinic C2/m space group. The structure is zero-dimensional and consists of four sulfur trioxide molecules, four trifluoromethane molecules, and two V(H2O)6 clusters. In each V(H2O)6 cluster, V(1) is bonded in an octahedral geometry to two equivalent O(3) and four equivalent O(4) atoms. There are three inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(3) atom. In the second H site, H(2) is bonded in a single-bond geometry to one O(4) atom. In the third H site, H(3) is bonded in a single-bond geometry to one O(4) atom. There are two inequivalent O sites. In the first O site, O(3) is bonded in a distorted trigonal planar geometry to one V(1) and two equivalent H(1) atoms. In the second O site, O(4) is bonded in a distorted trigonal planar geometry to one V(1), one H(2), and one H(3) atom. is represented by the CIF file [CIF]
data_VH12C2S2(O2F)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.082
_cell_length_b   10.082
_cell_length_c   6.648
_cell_angle_alpha   77.204
_cell_angle_beta   77.204
_cell_angle_gamma   41.193
_symmetry_Int_Tables_number   1
_cell_volume   432.418
_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
  V  V0  1  0.000  0.000  0.000  1.0
  H  H1  1  0.817  0.044  0.690  1.0
  H  H2  1  0.044  0.817  0.690  1.0
  H  H3  1  0.183  0.956  0.310  1.0
  H  H4  1  0.956  0.183  0.310  1.0
  H  H5  1  0.827  0.336  0.701  1.0
  H  H6  1  0.336  0.827  0.701  1.0
  H  H7  1  0.173  0.664  0.299  1.0
  H  H8  1  0.664  0.173  0.299  1.0
  H  H9  1  0.778  0.401  0.927  1.0
  H  H10  1  0.401  0.778  0.927  1.0
  H  H11  1  0.222  0.599  0.073  1.0
  H  H12  1  0.599  0.222  0.073  1.0
  C  C13  1  0.274  0.274  0.712  1.0
  C  C14  1  0.726  0.726  0.288  1.0
  S  S15  1  0.375  0.375  0.690  1.0
  S  S16  1  0.625  0.625  0.310  1.0
  O  O17  1  0.383  0.383  0.904  1.0
  O  O18  1  0.617  0.617  0.096  1.0
  O  O19  1  0.227  0.575  0.576  1.0
  O  O20  1  0.575  0.227  0.576  1.0
  O  O21  1  0.773  0.425  0.424  1.0
  O  O22  1  0.425  0.773  0.424  1.0
  O  O23  1  0.949  0.949  0.746  1.0
  O  O24  1  0.051  0.051  0.254  1.0
  O  O25  1  0.857  0.286  0.846  1.0
  O  O26  1  0.286  0.857  0.846  1.0
  O  O27  1  0.143  0.714  0.154  1.0
  O  O28  1  0.714  0.143  0.154  1.0
  F  F29  1  0.261  0.261  0.520  1.0
  F  F30  1  0.739  0.739  0.480  1.0
  F  F31  1  0.089  0.399  0.815  1.0
  F  F32  1  0.399  0.089  0.815  1.0
  F  F33  1  0.911  0.601  0.185  1.0
  F  F34  1  0.601  0.911  0.185  1.0
[/CIF]
.
The material structure described by V(H2O)6(CF3)2(SO3)2 crystallizes in the monoclinic C2/m space group. The structure is zero-dimensional and consists of four sulfur trioxide molecules, four trifluoromethane molecules, and two V(H2O)6 clusters. In each V(H2O)6 cluster, V(1) is bonded in an octahedral geometry to two equivalent O(3) and four equivalent O(4) atoms. There are three inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(3) atom. In the second H site, H(2) is bonded in a single-bond geometry to one O(4) atom. In the third H site, H(3) is bonded in a single-bond geometry to one O(4) atom. There are two inequivalent O sites. In the first O site, O(3) is bonded in a distorted trigonal planar geometry to one V(1) and two equivalent H(1) atoms. In the second O site, O(4) is bonded in a distorted trigonal planar geometry to one V(1), one H(2), and one H(3) atom. is represented by the CIF file [CIF]
data_VH12C2S2(O2F)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.082
_cell_length_b   10.082
_cell_length_c   6.648
_cell_angle_alpha   77.204
_cell_angle_beta   77.204
_cell_angle_gamma   41.193
_symmetry_Int_Tables_number   1
_cell_volume   432.418
_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
  V  V0  1  0.000  0.000  0.000  1.0
  H  H1  1  0.817  0.044  0.690  1.0
  H  H2  1  0.044  0.817  0.690  1.0
  H  H3  1  0.183  0.956  0.310  1.0
  H  H4  1  0.956  0.183  0.310  1.0
  H  H5  1  0.827  0.336  0.701  1.0
  H  H6  1  0.336  0.827  0.701  1.0
  H  H7  1  0.173  0.664  0.299  1.0
  H  H8  1  0.664  0.173  0.299  1.0
  H  H9  1  0.778  0.401  0.927  1.0
  H  H10  1  0.401  0.778  0.927  1.0
  H  H11  1  0.222  0.599  0.073  1.0
  H  H12  1  0.599  0.222  0.073  1.0
  C  C13  1  0.274  0.274  0.712  1.0
  C  C14  1  0.726  0.726  0.288  1.0
  S  S15  1  0.375  0.375  0.690  1.0
  S  S16  1  0.625  0.625  0.310  1.0
  O  O17  1  0.383  0.383  0.904  1.0
  O  O18  1  0.617  0.617  0.096  1.0
  O  O19  1  0.227  0.575  0.576  1.0
  O  O20  1  0.575  0.227  0.576  1.0
  O  O21  1  0.773  0.425  0.424  1.0
  O  O22  1  0.425  0.773  0.424  1.0
  O  O23  1  0.949  0.949  0.746  1.0
  O  O24  1  0.051  0.051  0.254  1.0
  O  O25  1  0.857  0.286  0.846  1.0
  O  O26  1  0.286  0.857  0.846  1.0
  O  O27  1  0.143  0.714  0.154  1.0
  O  O28  1  0.714  0.143  0.154  1.0
  F  F29  1  0.261  0.261  0.520  1.0
  F  F30  1  0.739  0.739  0.480  1.0
  F  F31  1  0.089  0.399  0.815  1.0
  F  F32  1  0.399  0.089  0.815  1.0
  F  F33  1  0.911  0.601  0.185  1.0
  F  F34  1  0.601  0.911  0.185  1.0
[/CIF]
.