VOF is Hydrophilite-derived structured and crystallizes in the orthorhombic Pmn2_1 space group. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(2), two equivalent O(1), one F(1), and two equivalent F(2) atoms to form a mixture of corner and edge-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 47-54°. In the second V site, V(2) is bonded to one O(2), two equivalent O(1), one F(1), and two equivalent F(2) atoms to form a mixture of corner and edge-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 47-54°. There are two inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one V(2) and two equivalent V(1) atoms. In the second O site, O(2) is bonded in a trigonal planar geometry to one V(2) and two equivalent V(1) atoms. There are two inequivalent F sites. In the first F site, F(1) is bonded in a distorted trigonal planar geometry to one V(2) and two equivalent V(1) atoms. In the second F site, F(2) is bonded in a distorted trigonal planar geometry to one V(2) and two equivalent V(1) atoms.
VOF is Hydrophilite-derived structured and crystallizes in the orthorhombic Pmn2_1 space group. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(2), two equivalent O(1), one F(1), and two equivalent F(2) atoms to form a mixture of corner and edge-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 47-54°. The V(1)-O(2) bond length is 1.97 Å. There is one shorter (1.87 Å) and one longer (1.97 Å) V(1)-O(1) bond length. The V(1)-F(1) bond length is 2.07 Å. There is one shorter (2.06 Å) and one longer (2.09 Å) V(1)-F(2) bond length. In the second V site, V(2) is bonded to one O(2), two equivalent O(1), one F(1), and two equivalent F(2) atoms to form a mixture of corner and edge-sharing VO3F3 octahedra. The corner-sharing octahedral tilt angles range from 47-54°. The V(2)-O(2) bond length is 1.85 Å. Both V(2)-O(1) bond lengths are 1.92 Å. The V(2)-F(1) bond length is 2.10 Å. Both V(2)-F(2) bond lengths are 2.12 Å. There are two inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one V(2) and two equivalent V(1) atoms. In the second O site, O(2) is bonded in a trigonal planar geometry to one V(2) and two equivalent V(1) atoms. There are two inequivalent F sites. In the first F site, F(1) is bonded in a distorted trigonal planar geometry to one V(2) and two equivalent V(1) atoms. In the second F site, F(2) is bonded in a distorted trigonal planar geometry to one V(2) and two equivalent V(1) atoms.