V3O5F is Hydrophilite-derived structured and crystallizes in the monoclinic Cm space group. There are six inequivalent V sites. In the first V site, V(1) is bonded to one O(5), two equivalent O(1), two equivalent O(7), and one F(1) atom to form VO5F octahedra that share corners with two equivalent V(3)O4F2 octahedra, corners with three equivalent V(2)O5F octahedra, corners with three equivalent V(6)O5F octahedra,  an edgeedge with one V(5)O5F octahedra, and  an edgeedge with one V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 45-54°. In the second V site, V(2) is bonded to one O(3), one O(4), one O(6), two equivalent O(1), and one F(1) atom to form VO5F octahedra that share corners with two equivalent V(4)O6 octahedra, corners with three equivalent V(1)O5F octahedra, corners with three equivalent V(5)O5F octahedra,  an edgeedge with one V(3)O4F2 octahedra, and  an edgeedge with one V(6)O5F octahedra. The corner-sharing octahedral tilt angles range from 42-54°. In the third V site, V(3) is bonded to one O(5), one O(6), two equivalent O(2), one F(1), and one F(2) atom to form VO4F2 octahedra that share corners with two equivalent V(1)O5F octahedra, corners with three equivalent V(5)O5F octahedra, corners with three equivalent V(4)O6 octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(6)O5F octahedra. The corner-sharing octahedral tilt angles range from 45-54°. In the fourth V site, V(4) is bonded to one O(3), one O(6), two equivalent O(2), and two equivalent O(7) atoms to form VO6 octahedra that share corners with two equivalent V(2)O5F octahedra, corners with three equivalent V(3)O4F2 octahedra, corners with three equivalent V(6)O5F octahedra,  an edgeedge with one V(1)O5F octahedra, and  an edgeedge with one V(5)O5F octahedra. The corner-sharing octahedral tilt angles range from 42-53°. In the fifth V site, V(5) is bonded to one O(4), two equivalent O(1), two equivalent O(2), and one F(2) atom to form VO5F octahedra that share corners with two equivalent V(6)O5F octahedra, corners with three equivalent V(3)O4F2 octahedra, corners with three equivalent V(2)O5F octahedra,  an edgeedge with one V(1)O5F octahedra, and  an edgeedge with one V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 42-49°. In the sixth V site, V(6) is bonded to one O(3), one O(4), one O(5), two equivalent O(7), and one F(2) atom to form VO5F octahedra that share corners with two equivalent V(5)O5F octahedra, corners with three equivalent V(1)O5F octahedra, corners with three equivalent V(4)O6 octahedra,  an edgeedge with one V(3)O4F2 octahedra, and  an edgeedge with one V(2)O5F octahedra. The corner-sharing octahedral tilt angles range from 42-54°. There are seven inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one V(1), one V(2), and one V(5) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one V(3), one V(4), and one V(5) atom. In the third O site, O(3) is bonded in a distorted T-shaped geometry to one V(2), one V(4), and one V(6) atom. In the fourth O site, O(4) is bonded in a distorted T-shaped geometry to one V(2), one V(5), and one V(6) atom. In the fifth O site, O(5) is bonded in a trigonal planar geometry to one V(1), one V(3), and one V(6) atom. In the sixth O site, O(6) is bonded in a trigonal planar geometry to one V(2), one V(3), and one V(4) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one V(1), one V(4), and one V(6) atom. There are two inequivalent F sites. In the first F site, F(1) is bonded in a distorted T-shaped geometry to one V(1), one V(2), and one V(3) atom. In the second F site, F(2) is bonded in a distorted trigonal planar geometry to one V(3), one V(5), and one V(6) atom.
V3O5F is Hydrophilite-derived structured and crystallizes in the monoclinic Cm space group. There are six inequivalent V sites. In the first V site, V(1) is bonded to one O(5), two equivalent O(1), two equivalent O(7), and one F(1) atom to form VO5F octahedra that share corners with two equivalent V(3)O4F2 octahedra, corners with three equivalent V(2)O5F octahedra, corners with three equivalent V(6)O5F octahedra,  an edgeedge with one V(5)O5F octahedra, and  an edgeedge with one V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 45-54°. The V(1)-O(5) bond length is 1.94 Å. Both V(1)-O(1) bond lengths are 2.01 Å. Both V(1)-O(7) bond lengths are 2.01 Å. The V(1)-F(1) bond length is 2.17 Å. In the second V site, V(2) is bonded to one O(3), one O(4), one O(6), two equivalent O(1), and one F(1) atom to form VO5F octahedra that share corners with two equivalent V(4)O6 octahedra, corners with three equivalent V(1)O5F octahedra, corners with three equivalent V(5)O5F octahedra,  an edgeedge with one V(3)O4F2 octahedra, and  an edgeedge with one V(6)O5F octahedra. The corner-sharing octahedral tilt angles range from 42-54°. The V(2)-O(3) bond length is 1.96 Å. The V(2)-O(4) bond length is 1.92 Å. The V(2)-O(6) bond length is 2.01 Å. Both V(2)-O(1) bond lengths are 1.94 Å. The V(2)-F(1) bond length is 2.09 Å. In the third V site, V(3) is bonded to one O(5), one O(6), two equivalent O(2), one F(1), and one F(2) atom to form VO4F2 octahedra that share corners with two equivalent V(1)O5F octahedra, corners with three equivalent V(5)O5F octahedra, corners with three equivalent V(4)O6 octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(6)O5F octahedra. The corner-sharing octahedral tilt angles range from 45-54°. The V(3)-O(5) bond length is 1.87 Å. The V(3)-O(6) bond length is 1.87 Å. Both V(3)-O(2) bond lengths are 1.93 Å. The V(3)-F(1) bond length is 2.10 Å. The V(3)-F(2) bond length is 2.12 Å. In the fourth V site, V(4) is bonded to one O(3), one O(6), two equivalent O(2), and two equivalent O(7) atoms to form VO6 octahedra that share corners with two equivalent V(2)O5F octahedra, corners with three equivalent V(3)O4F2 octahedra, corners with three equivalent V(6)O5F octahedra,  an edgeedge with one V(1)O5F octahedra, and  an edgeedge with one V(5)O5F octahedra. The corner-sharing octahedral tilt angles range from 42-53°. The V(4)-O(3) bond length is 1.98 Å. The V(4)-O(6) bond length is 2.04 Å. Both V(4)-O(2) bond lengths are 2.03 Å. Both V(4)-O(7) bond lengths are 1.90 Å. In the fifth V site, V(5) is bonded to one O(4), two equivalent O(1), two equivalent O(2), and one F(2) atom to form VO5F octahedra that share corners with two equivalent V(6)O5F octahedra, corners with three equivalent V(3)O4F2 octahedra, corners with three equivalent V(2)O5F octahedra,  an edgeedge with one V(1)O5F octahedra, and  an edgeedge with one V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 42-49°. The V(5)-O(4) bond length is 1.87 Å. Both V(5)-O(1) bond lengths are 1.90 Å. Both V(5)-O(2) bond lengths are 2.01 Å. The V(5)-F(2) bond length is 2.12 Å. In the sixth V site, V(6) is bonded to one O(3), one O(4), one O(5), two equivalent O(7), and one F(2) atom to form VO5F octahedra that share corners with two equivalent V(5)O5F octahedra, corners with three equivalent V(1)O5F octahedra, corners with three equivalent V(4)O6 octahedra,  an edgeedge with one V(3)O4F2 octahedra, and  an edgeedge with one V(2)O5F octahedra. The corner-sharing octahedral tilt angles range from 42-54°. The V(6)-O(3) bond length is 1.96 Å. The V(6)-O(4) bond length is 1.94 Å. The V(6)-O(5) bond length is 2.02 Å. Both V(6)-O(7) bond lengths are 1.94 Å. The V(6)-F(2) bond length is 2.08 Å. There are seven inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one V(1), one V(2), and one V(5) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one V(3), one V(4), and one V(5) atom. In the third O site, O(3) is bonded in a distorted T-shaped geometry to one V(2), one V(4), and one V(6) atom. In the fourth O site, O(4) is bonded in a distorted T-shaped geometry to one V(2), one V(5), and one V(6) atom. In the fifth O site, O(5) is bonded in a trigonal planar geometry to one V(1), one V(3), and one V(6) atom. In the sixth O site, O(6) is bonded in a trigonal planar geometry to one V(2), one V(3), and one V(4) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one V(1), one V(4), and one V(6) atom. There are two inequivalent F sites. In the first F site, F(1) is bonded in a distorted T-shaped geometry to one V(1), one V(2), and one V(3) atom. In the second F site, F(2) is bonded in a distorted trigonal planar geometry to one V(3), one V(5), and one V(6) atom.