The material described by C2SF6 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two trifluoro-[(e)-1,1,1,4,4,4-hexafluoro-3-(trifluoro-lambda4-sulfanyl)but-2-en-2-yl]-lambda4-sulfane molecules. There are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal non-coplanar geometry to one C(2), one F(1), one F(3), and one F(4) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one C(1), one C(2), and one S(1) atom. S(1) is bonded in a distorted T-shaped geometry to one C(2), one F(2), one F(5), and one F(6) atom. There are six inequivalent F sites. In the first F site, F(6) is bonded in a single-bond geometry to one S(1) atom. In the second F site, F(1) is bonded in a single-bond geometry to one C(1) atom. In the third F site, F(2) is bonded in a single-bond geometry to one S(1) atom. In the fourth F site, F(3) is bonded in a single-bond geometry to one C(1) atom. In the fifth F site, F(4) is bonded in a single-bond geometry to one C(1) atom. In the sixth F site, F(5) is bonded in a single-bond geometry to one S(1) atom. is represented by the CIF card [CIF]
data_C2SF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.708
_cell_length_b   6.669
_cell_length_c   14.623
_cell_angle_alpha   63.195
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   496.886
_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
  C  C0  1  0.319  0.842  0.934  1.0
  C  C1  1  0.681  0.158  0.066  1.0
  C  C2  1  0.819  0.158  0.566  1.0
  C  C3  1  0.181  0.842  0.434  1.0
  C  C4  1  0.946  0.981  0.544  1.0
  C  C5  1  0.054  0.019  0.456  1.0
  C  C6  1  0.446  0.019  0.956  1.0
  C  C7  1  0.554  0.981  0.044  1.0
  S  S8  1  0.946  0.698  0.655  1.0
  S  S9  1  0.054  0.302  0.345  1.0
  S  S10  1  0.446  0.302  0.845  1.0
  S  S11  1  0.554  0.698  0.155  1.0
  F  F12  1  0.189  0.638  0.519  1.0
  F  F13  1  0.811  0.362  0.481  1.0
  F  F14  1  0.689  0.362  0.981  1.0
  F  F15  1  0.311  0.638  0.019  1.0
  F  F16  1  0.818  0.741  0.741  1.0
  F  F17  1  0.182  0.259  0.259  1.0
  F  F18  1  0.318  0.259  0.759  1.0
  F  F19  1  0.682  0.741  0.241  1.0
  F  F20  1  0.097  0.901  0.903  1.0
  F  F21  1  0.903  0.099  0.097  1.0
  F  F22  1  0.597  0.099  0.597  1.0
  F  F23  1  0.403  0.901  0.403  1.0
  F  F24  1  0.436  0.812  0.861  1.0
  F  F25  1  0.564  0.188  0.139  1.0
  F  F26  1  0.936  0.188  0.639  1.0
  F  F27  1  0.064  0.812  0.361  1.0
  F  F28  1  0.203  0.775  0.691  1.0
  F  F29  1  0.797  0.225  0.309  1.0
  F  F30  1  0.703  0.225  0.809  1.0
  F  F31  1  0.297  0.775  0.191  1.0
  F  F32  1  0.173  0.335  0.888  1.0
  F  F33  1  0.827  0.665  0.112  1.0
  F  F34  1  0.673  0.665  0.612  1.0
  F  F35  1  0.327  0.335  0.388  1.0
[/CIF]
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The material described by C2SF6 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two trifluoro-[(e)-1,1,1,4,4,4-hexafluoro-3-(trifluoro-lambda4-sulfanyl)but-2-en-2-yl]-lambda4-sulfane molecules. There are two inequivalent C sites. In the first C site, C(1) is bonded in a trigonal non-coplanar geometry to one C(2), one F(1), one F(3), and one F(4) atom. In the second C site, C(2) is bonded in a trigonal planar geometry to one C(1), one C(2), and one S(1) atom. S(1) is bonded in a distorted T-shaped geometry to one C(2), one F(2), one F(5), and one F(6) atom. There are six inequivalent F sites. In the first F site, F(6) is bonded in a single-bond geometry to one S(1) atom. In the second F site, F(1) is bonded in a single-bond geometry to one C(1) atom. In the third F site, F(2) is bonded in a single-bond geometry to one S(1) atom. In the fourth F site, F(3) is bonded in a single-bond geometry to one C(1) atom. In the fifth F site, F(4) is bonded in a single-bond geometry to one C(1) atom. In the sixth F site, F(5) is bonded in a single-bond geometry to one S(1) atom. is represented by the CIF card [CIF]
data_C2SF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.708
_cell_length_b   6.669
_cell_length_c   14.623
_cell_angle_alpha   63.195
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   496.886
_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
  C  C0  1  0.319  0.842  0.934  1.0
  C  C1  1  0.681  0.158  0.066  1.0
  C  C2  1  0.819  0.158  0.566  1.0
  C  C3  1  0.181  0.842  0.434  1.0
  C  C4  1  0.946  0.981  0.544  1.0
  C  C5  1  0.054  0.019  0.456  1.0
  C  C6  1  0.446  0.019  0.956  1.0
  C  C7  1  0.554  0.981  0.044  1.0
  S  S8  1  0.946  0.698  0.655  1.0
  S  S9  1  0.054  0.302  0.345  1.0
  S  S10  1  0.446  0.302  0.845  1.0
  S  S11  1  0.554  0.698  0.155  1.0
  F  F12  1  0.189  0.638  0.519  1.0
  F  F13  1  0.811  0.362  0.481  1.0
  F  F14  1  0.689  0.362  0.981  1.0
  F  F15  1  0.311  0.638  0.019  1.0
  F  F16  1  0.818  0.741  0.741  1.0
  F  F17  1  0.182  0.259  0.259  1.0
  F  F18  1  0.318  0.259  0.759  1.0
  F  F19  1  0.682  0.741  0.241  1.0
  F  F20  1  0.097  0.901  0.903  1.0
  F  F21  1  0.903  0.099  0.097  1.0
  F  F22  1  0.597  0.099  0.597  1.0
  F  F23  1  0.403  0.901  0.403  1.0
  F  F24  1  0.436  0.812  0.861  1.0
  F  F25  1  0.564  0.188  0.139  1.0
  F  F26  1  0.936  0.188  0.639  1.0
  F  F27  1  0.064  0.812  0.361  1.0
  F  F28  1  0.203  0.775  0.691  1.0
  F  F29  1  0.797  0.225  0.309  1.0
  F  F30  1  0.703  0.225  0.809  1.0
  F  F31  1  0.297  0.775  0.191  1.0
  F  F32  1  0.173  0.335  0.888  1.0
  F  F33  1  0.827  0.665  0.112  1.0
  F  F34  1  0.673  0.665  0.612  1.0
  F  F35  1  0.327  0.335  0.388  1.0
[/CIF]
.