The compound described by V4OF11 crystallizes in the monoclinic C2 space group. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one F(1), one F(10), one F(2), one F(3), and one F(6) atom to form VOF5 octahedra that share corners with three equivalent V(3)F6 octahedra and corners with three equivalent V(2)OF5 octahedra. The corner-sharing octahedral tilt angles range from 23-34°. In the second V site, V(2) is bonded to one O(1), one F(1), one F(11), one F(2), one F(7), and one F(9) atom to form VOF5 octahedra that share corners with three equivalent V(4)F6 octahedra and corners with three equivalent V(1)OF5 octahedra. The corner-sharing octahedral tilt angles range from 23-34°. In the third V site, V(3) is bonded to one F(10), one F(3), one F(6), one F(8), and two equivalent F(4) atoms to form VF6 octahedra that share corners with three equivalent V(3)F6 octahedra and corners with three equivalent V(1)OF5 octahedra. The corner-sharing octahedral tilt angles range from 27-31°. In the fourth V site, V(4) is bonded to one F(11), one F(12), one F(7), one F(9), and two equivalent F(5) atoms to form VF6 octahedra that share corners with three equivalent V(4)F6 octahedra and corners with three equivalent V(2)OF5 octahedra. The corner-sharing octahedral tilt angles range from 30-32°. O(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(2) atom. There are twelve inequivalent F sites. In the first F site, F(10) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the second F site, F(11) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the third F site, F(12) is bonded in a bent 150 degrees geometry to two equivalent V(4) atoms. In the fourth F site, F(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(2) atom. In the fifth F site, F(2) is bonded in a bent 150 degrees geometry to one V(1) and one V(2) atom. In the sixth F site, F(3) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the seventh F site, F(4) is bonded in a bent 150 degrees geometry to two equivalent V(3) atoms. In the eighth F site, F(5) is bonded in a bent 150 degrees geometry to two equivalent V(4) atoms. In the ninth F site, F(6) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the tenth F site, F(7) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the eleventh F site, F(8) is bonded in a bent 150 degrees geometry to two equivalent V(3) atoms. In the twelfth F site, F(9) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. is represented by the CIF card [CIF]
data_V4OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.465
_cell_length_b   5.465
_cell_length_c   17.701
_cell_angle_alpha   79.406
_cell_angle_beta   79.406
_cell_angle_gamma   57.500
_symmetry_Int_Tables_number   1
_cell_volume   435.926
_cell_formula_units_Z   2
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  0.604  0.517  0.806  1.0
  V  V1  1  0.132  0.992  0.311  1.0
  V  V2  1  0.239  0.137  0.937  1.0
  V  V3  1  0.756  0.619  0.438  1.0
  V  V4  1  0.863  0.761  0.063  1.0
  V  V5  1  0.381  0.244  0.562  1.0
  V  V6  1  0.008  0.868  0.689  1.0
  V  V7  1  0.482  0.396  0.194  1.0
  O  O8  1  0.339  0.622  0.266  1.0
  O  O9  1  0.378  0.661  0.734  1.0
  F  F10  1  0.833  0.117  0.776  1.0
  F  F11  1  0.913  0.583  0.749  1.0
  F  F12  1  0.417  0.087  0.251  1.0
  F  F13  1  0.339  0.421  0.877  1.0
  F  F14  1  0.628  0.924  0.976  1.0
  F  F15  1  0.145  0.411  0.475  1.0
  F  F16  1  0.416  0.891  0.850  1.0
  F  F17  1  0.920  0.378  0.350  1.0
  F  F18  1  0.109  0.584  0.150  1.0
  F  F19  1  0.150  0.850  0.000  1.0
  F  F20  1  0.841  0.908  0.375  1.0
  F  F21  1  0.076  0.372  0.024  1.0
  F  F22  1  0.883  0.167  0.224  1.0
  F  F23  1  0.589  0.855  0.525  1.0
  F  F24  1  0.622  0.080  0.650  1.0
  F  F25  1  0.655  0.148  0.106  1.0
  F  F26  1  0.852  0.345  0.894  1.0
  F  F27  1  0.366  0.829  0.400  1.0
  F  F28  1  0.672  0.328  0.500  1.0
  F  F29  1  0.092  0.159  0.625  1.0
  F  F30  1  0.579  0.661  0.123  1.0
  F  F31  1  0.171  0.634  0.600  1.0
[/CIF]
.
The compound described by V4OF11 crystallizes in the monoclinic C2 space group. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one F(1), one F(10), one F(2), one F(3), and one F(6) atom to form VOF5 octahedra that share corners with three equivalent V(3)F6 octahedra and corners with three equivalent V(2)OF5 octahedra. The corner-sharing octahedral tilt angles range from 23-34°. In the second V site, V(2) is bonded to one O(1), one F(1), one F(11), one F(2), one F(7), and one F(9) atom to form VOF5 octahedra that share corners with three equivalent V(4)F6 octahedra and corners with three equivalent V(1)OF5 octahedra. The corner-sharing octahedral tilt angles range from 23-34°. In the third V site, V(3) is bonded to one F(10), one F(3), one F(6), one F(8), and two equivalent F(4) atoms to form VF6 octahedra that share corners with three equivalent V(3)F6 octahedra and corners with three equivalent V(1)OF5 octahedra. The corner-sharing octahedral tilt angles range from 27-31°. In the fourth V site, V(4) is bonded to one F(11), one F(12), one F(7), one F(9), and two equivalent F(5) atoms to form VF6 octahedra that share corners with three equivalent V(4)F6 octahedra and corners with three equivalent V(2)OF5 octahedra. The corner-sharing octahedral tilt angles range from 30-32°. O(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(2) atom. There are twelve inequivalent F sites. In the first F site, F(10) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the second F site, F(11) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the third F site, F(12) is bonded in a bent 150 degrees geometry to two equivalent V(4) atoms. In the fourth F site, F(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(2) atom. In the fifth F site, F(2) is bonded in a bent 150 degrees geometry to one V(1) and one V(2) atom. In the sixth F site, F(3) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the seventh F site, F(4) is bonded in a bent 150 degrees geometry to two equivalent V(3) atoms. In the eighth F site, F(5) is bonded in a bent 150 degrees geometry to two equivalent V(4) atoms. In the ninth F site, F(6) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the tenth F site, F(7) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the eleventh F site, F(8) is bonded in a bent 150 degrees geometry to two equivalent V(3) atoms. In the twelfth F site, F(9) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. is represented by the CIF card [CIF]
data_V4OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.465
_cell_length_b   5.465
_cell_length_c   17.701
_cell_angle_alpha   79.406
_cell_angle_beta   79.406
_cell_angle_gamma   57.500
_symmetry_Int_Tables_number   1
_cell_volume   435.926
_cell_formula_units_Z   2
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  0.604  0.517  0.806  1.0
  V  V1  1  0.132  0.992  0.311  1.0
  V  V2  1  0.239  0.137  0.937  1.0
  V  V3  1  0.756  0.619  0.438  1.0
  V  V4  1  0.863  0.761  0.063  1.0
  V  V5  1  0.381  0.244  0.562  1.0
  V  V6  1  0.008  0.868  0.689  1.0
  V  V7  1  0.482  0.396  0.194  1.0
  O  O8  1  0.339  0.622  0.266  1.0
  O  O9  1  0.378  0.661  0.734  1.0
  F  F10  1  0.833  0.117  0.776  1.0
  F  F11  1  0.913  0.583  0.749  1.0
  F  F12  1  0.417  0.087  0.251  1.0
  F  F13  1  0.339  0.421  0.877  1.0
  F  F14  1  0.628  0.924  0.976  1.0
  F  F15  1  0.145  0.411  0.475  1.0
  F  F16  1  0.416  0.891  0.850  1.0
  F  F17  1  0.920  0.378  0.350  1.0
  F  F18  1  0.109  0.584  0.150  1.0
  F  F19  1  0.150  0.850  0.000  1.0
  F  F20  1  0.841  0.908  0.375  1.0
  F  F21  1  0.076  0.372  0.024  1.0
  F  F22  1  0.883  0.167  0.224  1.0
  F  F23  1  0.589  0.855  0.525  1.0
  F  F24  1  0.622  0.080  0.650  1.0
  F  F25  1  0.655  0.148  0.106  1.0
  F  F26  1  0.852  0.345  0.894  1.0
  F  F27  1  0.366  0.829  0.400  1.0
  F  F28  1  0.672  0.328  0.500  1.0
  F  F29  1  0.092  0.159  0.625  1.0
  F  F30  1  0.579  0.661  0.123  1.0
  F  F31  1  0.171  0.634  0.600  1.0
[/CIF]
.