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(3), one F(5), and two equivalent F(6) atoms to form corner-sharing VOF5 octahedra. The corner-sharing octahedral tilt angles range from 27-36°. In the second V site, V(2) is bonded to one F(10), one F(2), one F(4), one F(9), and two equivalent F(7) atoms to form corner-sharing VF6 octahedra. The corner-sharing octahedral tilt angles range from 36-38°. In the third V site, V(3) is bonded to one O(1), one F(1), one F(11), one F(12), one F(5), and one F(8) 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 27-40°. In the fourth V site, V(4) is bonded to one F(10), one F(11), one F(12), one F(2), one F(4), and one F(8) atom to form VF6 octahedra that share corners with three equivalent V(2)F6 octahedra and corners with three equivalent V(3)OF5 octahedra. The corner-sharing octahedral tilt angles range from 33-40°. O(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) 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(2) and one V(4) atom. In the second F site, F(11) is bonded in a bent 150 degrees geometry to one V(3) and one V(4) atom. In the third F site, F(12) is bonded in a bent 150 degrees geometry to one V(3) and one V(4) atom. In the fourth F site, F(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the fifth F site, F(2) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the sixth F site, F(3) is bonded in a bent 150 degrees geometry to two equivalent V(1) atoms. In the seventh F site, F(4) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the eighth F site, F(5) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the ninth F site, F(6) is bonded in a bent 150 degrees geometry to two equivalent V(1) atoms. In the tenth F site, F(7) is bonded in a bent 150 degrees geometry to two equivalent V(2) atoms. In the eleventh F site, F(8) is bonded in a bent 150 degrees geometry to one V(3) and one V(4) atom. In the twelfth F site, F(9) is bonded in a bent 150 degrees geometry to two equivalent V(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_V4OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.326
_cell_length_b   5.326
_cell_length_c   17.046
_cell_angle_alpha   78.075
_cell_angle_beta   78.075
_cell_angle_gamma   57.087
_symmetry_Int_Tables_number   1
_cell_volume   394.574
_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  0.757  0.629  0.435  1.0
  V  V1  1  0.250  0.129  0.937  1.0
  V  V2  1  0.371  0.243  0.565  1.0
  V  V3  1  0.871  0.750  0.063  1.0
  V  V4  1  0.025  0.883  0.683  1.0
  V  V5  1  0.496  0.370  0.188  1.0
  V  V6  1  0.117  0.975  0.317  1.0
  V  V7  1  0.630  0.504  0.812  1.0
  O  O8  1  0.026  0.729  0.374  1.0
  O  O9  1  0.271  0.974  0.626  1.0
  F  F10  1  0.972  0.228  0.405  1.0
  F  F11  1  0.559  0.194  0.875  1.0
  F  F12  1  0.454  0.546  0.500  1.0
  F  F13  1  0.772  0.028  0.595  1.0
  F  F14  1  0.477  0.721  0.904  1.0
  F  F15  1  0.279  0.523  0.096  1.0
  F  F16  1  0.525  0.776  0.346  1.0
  F  F17  1  0.524  0.027  0.472  1.0
  F  F18  1  0.021  0.537  0.970  1.0
  F  F19  1  0.226  0.719  0.780  1.0
  F  F20  1  0.942  0.058  0.000  1.0
  F  F21  1  0.224  0.475  0.654  1.0
  F  F22  1  0.033  0.276  0.845  1.0
  F  F23  1  0.724  0.967  0.155  1.0
  F  F24  1  0.722  0.229  0.280  1.0
  F  F25  1  0.771  0.278  0.720  1.0
  F  F26  1  0.973  0.476  0.528  1.0
  F  F27  1  0.463  0.979  0.030  1.0
  F  F28  1  0.806  0.441  0.125  1.0
  F  F29  1  0.201  0.283  0.253  1.0
  F  F30  1  0.717  0.799  0.747  1.0
  F  F31  1  0.281  0.774  0.220  1.0
[/CIF]
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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(3), one F(5), and two equivalent F(6) atoms to form corner-sharing VOF5 octahedra. The corner-sharing octahedral tilt angles range from 27-36°. In the second V site, V(2) is bonded to one F(10), one F(2), one F(4), one F(9), and two equivalent F(7) atoms to form corner-sharing VF6 octahedra. The corner-sharing octahedral tilt angles range from 36-38°. In the third V site, V(3) is bonded to one O(1), one F(1), one F(11), one F(12), one F(5), and one F(8) 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 27-40°. In the fourth V site, V(4) is bonded to one F(10), one F(11), one F(12), one F(2), one F(4), and one F(8) atom to form VF6 octahedra that share corners with three equivalent V(2)F6 octahedra and corners with three equivalent V(3)OF5 octahedra. The corner-sharing octahedral tilt angles range from 33-40°. O(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) 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(2) and one V(4) atom. In the second F site, F(11) is bonded in a bent 150 degrees geometry to one V(3) and one V(4) atom. In the third F site, F(12) is bonded in a bent 150 degrees geometry to one V(3) and one V(4) atom. In the fourth F site, F(1) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the fifth F site, F(2) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the sixth F site, F(3) is bonded in a bent 150 degrees geometry to two equivalent V(1) atoms. In the seventh F site, F(4) is bonded in a bent 150 degrees geometry to one V(2) and one V(4) atom. In the eighth F site, F(5) is bonded in a bent 150 degrees geometry to one V(1) and one V(3) atom. In the ninth F site, F(6) is bonded in a bent 150 degrees geometry to two equivalent V(1) atoms. In the tenth F site, F(7) is bonded in a bent 150 degrees geometry to two equivalent V(2) atoms. In the eleventh F site, F(8) is bonded in a bent 150 degrees geometry to one V(3) and one V(4) atom. In the twelfth F site, F(9) is bonded in a bent 150 degrees geometry to two equivalent V(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_V4OF11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.326
_cell_length_b   5.326
_cell_length_c   17.046
_cell_angle_alpha   78.075
_cell_angle_beta   78.075
_cell_angle_gamma   57.087
_symmetry_Int_Tables_number   1
_cell_volume   394.574
_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  0.757  0.629  0.435  1.0
  V  V1  1  0.250  0.129  0.937  1.0
  V  V2  1  0.371  0.243  0.565  1.0
  V  V3  1  0.871  0.750  0.063  1.0
  V  V4  1  0.025  0.883  0.683  1.0
  V  V5  1  0.496  0.370  0.188  1.0
  V  V6  1  0.117  0.975  0.317  1.0
  V  V7  1  0.630  0.504  0.812  1.0
  O  O8  1  0.026  0.729  0.374  1.0
  O  O9  1  0.271  0.974  0.626  1.0
  F  F10  1  0.972  0.228  0.405  1.0
  F  F11  1  0.559  0.194  0.875  1.0
  F  F12  1  0.454  0.546  0.500  1.0
  F  F13  1  0.772  0.028  0.595  1.0
  F  F14  1  0.477  0.721  0.904  1.0
  F  F15  1  0.279  0.523  0.096  1.0
  F  F16  1  0.525  0.776  0.346  1.0
  F  F17  1  0.524  0.027  0.472  1.0
  F  F18  1  0.021  0.537  0.970  1.0
  F  F19  1  0.226  0.719  0.780  1.0
  F  F20  1  0.942  0.058  0.000  1.0
  F  F21  1  0.224  0.475  0.654  1.0
  F  F22  1  0.033  0.276  0.845  1.0
  F  F23  1  0.724  0.967  0.155  1.0
  F  F24  1  0.722  0.229  0.280  1.0
  F  F25  1  0.771  0.278  0.720  1.0
  F  F26  1  0.973  0.476  0.528  1.0
  F  F27  1  0.463  0.979  0.030  1.0
  F  F28  1  0.806  0.441  0.125  1.0
  F  F29  1  0.201  0.283  0.253  1.0
  F  F30  1  0.717  0.799  0.747  1.0
  F  F31  1  0.281  0.774  0.220  1.0
[/CIF]
.