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.
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°. The V(1)-O(1) bond length is 1.95 Å. The V(1)-O(2) bond length is 2.01 Å. The V(1)-O(3) bond length is 1.98 Å. The V(1)-F(1) bond length is 2.08 Å. The V(1)-F(2) bond length is 2.16 Å. The V(1)-F(4) bond length is 2.07 Å. 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°. The V(2)-O(1) bond length is 2.00 Å. The V(2)-O(2) bond length is 1.94 Å. The V(2)-O(4) bond length is 2.00 Å. The V(2)-F(1) bond length is 2.17 Å. The V(2)-F(2) bond length is 2.08 Å. The V(2)-F(3) bond length is 2.08 Å. 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°. The V(3)-O(1) bond length is 2.01 Å. The V(3)-O(3) bond length is 1.97 Å. The V(3)-O(4) bond length is 1.99 Å. The V(3)-F(2) bond length is 2.05 Å. The V(3)-F(3) bond length is 2.04 Å. The V(3)-F(4) bond length is 2.13 Å. 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°. The V(4)-O(2) bond length is 2.02 Å. The V(4)-O(3) bond length is 2.00 Å. The V(4)-O(4) bond length is 1.95 Å. The V(4)-F(1) bond length is 2.06 Å. The V(4)-F(3) bond length is 2.13 Å. The V(4)-F(4) bond length is 2.04 Å. 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.