The material structure described by VOF is Hydrophilite-derived structured and crystallizes in the monoclinic Pc space group. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(2), one O(3), one F(1), one F(2), and one F(4) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 45-57°. In the second V site, V(2) is bonded to one O(1), one O(2), one O(4), one F(1), one F(2), and one F(3) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 46-57°. In the third V site, V(3) is bonded to one O(1), one O(3), one O(4), one F(2), one F(3), and one F(4) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 43-55°. In the fourth V site, V(4) is bonded to one O(2), one O(3), one O(4), one F(1), one F(3), and one F(4) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 43-55°. There are four inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(3) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(4) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one V(1), one V(3), and one V(4) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one V(2), one V(3), and one V(4) atom. There are four inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(4) atom. In the second F site, F(2) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(3) atom. In the third F site, F(3) is bonded in a distorted trigonal planar geometry to one V(2), one V(3), and one V(4) atom. In the fourth F site, F(4) is bonded in a distorted trigonal planar geometry to one V(1), one V(3), and one V(4) atom. is represented by the CIF card [CIF]
data_VOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.653
_cell_length_b   10.555
_cell_length_c   5.662
_cell_angle_alpha   83.631
_cell_angle_beta   90.002
_cell_angle_gamma   89.996
_symmetry_Int_Tables_number   1
_cell_volume   276.352
_cell_formula_units_Z   8
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  0.522  0.987  0.504  1.0
  V  V1  1  0.022  0.764  0.745  1.0
  V  V2  1  0.979  0.238  0.252  1.0
  V  V3  1  0.021  0.013  0.998  1.0
  V  V4  1  0.478  0.264  0.745  1.0
  V  V5  1  0.978  0.487  0.504  1.0
  V  V6  1  0.521  0.738  0.252  1.0
  V  V7  1  0.479  0.513  0.998  1.0
  O  O8  1  0.801  0.318  0.524  1.0
  O  O9  1  0.699  0.818  0.524  1.0
  O  O10  1  0.302  0.431  0.726  1.0
  O  O11  1  0.198  0.931  0.726  1.0
  O  O12  1  0.792  0.070  0.265  1.0
  O  O13  1  0.708  0.570  0.265  1.0
  O  O14  1  0.293  0.679  0.986  1.0
  O  O15  1  0.207  0.179  0.986  1.0
  F  F16  1  0.802  0.582  0.771  1.0
  F  F17  1  0.698  0.083  0.771  1.0
  F  F18  1  0.299  0.167  0.480  1.0
  F  F19  1  0.201  0.667  0.480  1.0
  F  F20  1  0.802  0.835  0.021  1.0
  F  F21  1  0.698  0.335  0.021  1.0
  F  F22  1  0.303  0.915  0.228  1.0
  F  F23  1  0.197  0.415  0.228  1.0
[/CIF]
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The material structure described by VOF is Hydrophilite-derived structured and crystallizes in the monoclinic Pc space group. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(2), one O(3), one F(1), one F(2), and one F(4) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 45-57°. In the second V site, V(2) is bonded to one O(1), one O(2), one O(4), one F(1), one F(2), and one F(3) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 46-57°. In the third V site, V(3) is bonded to one O(1), one O(3), one O(4), one F(2), one F(3), and one F(4) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 43-55°. In the fourth V site, V(4) is bonded to one O(2), one O(3), one O(4), one F(1), one F(3), and one F(4) atom to form a mixture of edge and corner-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 43-55°. There are four inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(3) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(4) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one V(1), one V(3), and one V(4) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one V(2), one V(3), and one V(4) atom. There are four inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(4) atom. In the second F site, F(2) is bonded in a trigonal planar geometry to one V(1), one V(2), and one V(3) atom. In the third F site, F(3) is bonded in a distorted trigonal planar geometry to one V(2), one V(3), and one V(4) atom. In the fourth F site, F(4) is bonded in a distorted trigonal planar geometry to one V(1), one V(3), and one V(4) atom. is represented by the CIF card [CIF]
data_VOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.653
_cell_length_b   10.555
_cell_length_c   5.662
_cell_angle_alpha   83.631
_cell_angle_beta   90.002
_cell_angle_gamma   89.996
_symmetry_Int_Tables_number   1
_cell_volume   276.352
_cell_formula_units_Z   8
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  0.522  0.987  0.504  1.0
  V  V1  1  0.022  0.764  0.745  1.0
  V  V2  1  0.979  0.238  0.252  1.0
  V  V3  1  0.021  0.013  0.998  1.0
  V  V4  1  0.478  0.264  0.745  1.0
  V  V5  1  0.978  0.487  0.504  1.0
  V  V6  1  0.521  0.738  0.252  1.0
  V  V7  1  0.479  0.513  0.998  1.0
  O  O8  1  0.801  0.318  0.524  1.0
  O  O9  1  0.699  0.818  0.524  1.0
  O  O10  1  0.302  0.431  0.726  1.0
  O  O11  1  0.198  0.931  0.726  1.0
  O  O12  1  0.792  0.070  0.265  1.0
  O  O13  1  0.708  0.570  0.265  1.0
  O  O14  1  0.293  0.679  0.986  1.0
  O  O15  1  0.207  0.179  0.986  1.0
  F  F16  1  0.802  0.582  0.771  1.0
  F  F17  1  0.698  0.083  0.771  1.0
  F  F18  1  0.299  0.167  0.480  1.0
  F  F19  1  0.201  0.667  0.480  1.0
  F  F20  1  0.802  0.835  0.021  1.0
  F  F21  1  0.698  0.335  0.021  1.0
  F  F22  1  0.303  0.915  0.228  1.0
  F  F23  1  0.197  0.415  0.228  1.0
[/CIF]
.