Li2VO3F crystallizes in the triclinic P1 space group. There are eight inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(3), one O(4), one O(5), one F(1), and one F(4) atom to form LiO4F2 octahedra that share corners with two equivalent Li(4)O4F2 octahedra, corners with two equivalent V(2)O5F octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. In the second Li site, Li(2) is bonded to one O(10), one O(2), one O(3), one O(7), one F(3), and one F(4) atom to form distorted LiO4F2 octahedra that share corners with two equivalent V(1)O5F octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(2)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 5-11°. In the third Li site, Li(3) is bonded in a 6-coordinate geometry to one O(3), one O(4), one O(6), one O(7), one O(8), and one F(2) atom. In the fourth Li site, Li(4) is bonded to one O(10), one O(12), one O(6), one O(8), one F(1), and one F(4) atom to form LiO4F2 octahedra that share corners with two equivalent Li(1)O4F2 octahedra, corners with two equivalent V(2)O5F octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-13°. In the fifth Li site, Li(5) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(4), one O(8), one O(9), and one F(3) atom. In the sixth Li site, Li(6) is bonded to one O(10), one O(11), one O(2), one O(4), one O(5), and one O(6) atom to form LiO6 octahedra that share corners with two equivalent Li(8)O6 octahedra, corners with two equivalent V(4)O5F octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. In the seventh Li site, Li(7) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(3), one O(9), one F(1), and one F(2) atom. In the eighth Li site, Li(8) is bonded to one O(1), one O(11), one O(12), one O(2), one O(3), and one O(8) atom to form LiO6 octahedra that share corners with two equivalent Li(6)O6 octahedra, corners with two equivalent V(4)O5F octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(2), one O(5), one O(7), one O(8), one O(9), and one F(1) atom to form distorted VO5F octahedra that share corners with two equivalent Li(2)O4F2 octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(2)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 5-11°. In the second V site, V(2) is bonded to one O(12), one O(3), one O(5), one O(6), one O(9), and one F(3) atom to form distorted VO5F octahedra that share corners with two equivalent Li(1)O4F2 octahedra, corners with two equivalent Li(4)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. In the third V site, V(3) is bonded to one O(11), one O(12), one O(4), one O(7), one O(9), and one F(4) atom to form distorted VO5F octahedra that share  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. In the fourth V site, V(4) is bonded to one O(1), one O(10), one O(12), one O(5), one O(7), and one F(2) atom to form distorted VO5F octahedra that share corners with two equivalent Li(6)O6 octahedra, corners with two equivalent Li(8)O6 octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(5), one Li(8), and one V(4) atom. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(6), one Li(8), and one V(1) atom. In the third O site, O(3) is bonded to one Li(1), one Li(2), one Li(3), one Li(7), one Li(8), and one V(2) atom to form distorted OLi5V octahedra that share corners with two equivalent O(10)Li5V octahedra, corners with two equivalent O(5)Li2V3 square pyramids, corners with two equivalent O(8)Li4V trigonal bipyramids,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 14-19°. In the fourth O site, O(4) is bonded to one Li(1), one Li(3), one Li(5), one Li(6), and one V(3) atom to form distorted OLi4V trigonal bipyramids that share  a cornercorner with one O(12)Li2V3 square pyramid,  an edgeedge with one O(10)Li5V octahedra,  an edgeedge with one O(3)Li5V octahedra,  an edgeedge with one O(5)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(8)Li4V trigonal bipyramid. In the fifth O site, O(5) is bonded to one Li(1), one Li(6), one V(1), one V(2), and one V(4) atom to form OLi2V3 square pyramids that share corners with two equivalent O(10)Li5V octahedra, corners with two equivalent O(3)Li5V octahedra,  a cornercorner with one O(8)Li4V trigonal bipyramid,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 7-15°. In the sixth O site, O(6) is bonded in a rectangular see-saw-like geometry to one Li(3), one Li(4), one Li(6), and one V(2) atom. In the seventh O site, O(7) is bonded to one Li(2), one Li(3), one V(1), one V(3), and one V(4) atom to form distorted OLi2V3 square pyramids that share  an edgeedge with one O(10)Li5V octahedra,  an edgeedge with one O(3)Li5V octahedra,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(5)Li2V3 square pyramid,  an edgeedge with one O(4)Li4V trigonal bipyramid, and  an edgeedge with one O(8)Li4V trigonal bipyramid. In the eighth O site, O(8) is bonded to one Li(3), one Li(4), one Li(5), one Li(8), and one V(1) atom to form distorted OLi4V trigonal bipyramids that share corners with two equivalent O(10)Li5V octahedra, corners with two equivalent O(3)Li5V octahedra,  a cornercorner with one O(5)Li2V3 square pyramid,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 14-25°. In the ninth O site, O(9) is bonded in a 5-coordinate geometry to one Li(5), one Li(7), one V(1), one V(2), and one V(3) atom. In the tenth O site, O(10) is bonded to one Li(2), one Li(4), one Li(5), one Li(6), one Li(7), and one V(4) atom to form OLi5V octahedra that share corners with two equivalent O(3)Li5V octahedra, corners with two equivalent O(5)Li2V3 square pyramids, corners with two equivalent O(8)Li4V trigonal bipyramids,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 14-19°. In the eleventh O site, O(11) is bonded in a see-saw-like geometry to one Li(6), one Li(7), one Li(8), and one V(3) atom. In the twelfth O site, O(12) is bonded to one Li(4), one Li(8), one V(2), one V(3), and one V(4) atom to form OLi2V3 square pyramids that share  a cornercorner with one O(4)Li4V trigonal bipyramid,  an edgeedge with one O(10)Li5V octahedra,  an edgeedge with one O(3)Li5V octahedra,  an edgeedge with one O(5)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(8)Li4V trigonal bipyramid. There are four inequivalent F sites. In the first F site, F(1) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(4), one Li(7), and one V(1) atom. In the second F site, F(2) is bonded in a T-shaped geometry to one Li(3), one Li(7), and one V(4) atom. In the third F site, F(3) is bonded in a T-shaped geometry to one Li(2), one Li(5), and one V(2) atom. In the fourth F site, F(4) is bonded in a see-saw-like geometry to one Li(1), one Li(2), one Li(4), and one V(3) atom.
Li2VO3F crystallizes in the triclinic P1 space group. There are eight inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(3), one O(4), one O(5), one F(1), and one F(4) atom to form LiO4F2 octahedra that share corners with two equivalent Li(4)O4F2 octahedra, corners with two equivalent V(2)O5F octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. The Li(1)-O(1) bond length is 2.04 Å. The Li(1)-O(3) bond length is 2.28 Å. The Li(1)-O(4) bond length is 2.09 Å. The Li(1)-O(5) bond length is 2.22 Å. The Li(1)-F(1) bond length is 2.05 Å. The Li(1)-F(4) bond length is 2.10 Å. In the second Li site, Li(2) is bonded to one O(10), one O(2), one O(3), one O(7), one F(3), and one F(4) atom to form distorted LiO4F2 octahedra that share corners with two equivalent V(1)O5F octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(2)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 5-11°. The Li(2)-O(10) bond length is 2.08 Å. The Li(2)-O(2) bond length is 2.06 Å. The Li(2)-O(3) bond length is 2.15 Å. The Li(2)-O(7) bond length is 2.29 Å. The Li(2)-F(3) bond length is 1.99 Å. The Li(2)-F(4) bond length is 1.98 Å. In the third Li site, Li(3) is bonded in a 6-coordinate geometry to one O(3), one O(4), one O(6), one O(7), one O(8), and one F(2) atom. The Li(3)-O(3) bond length is 2.14 Å. The Li(3)-O(4) bond length is 2.02 Å. The Li(3)-O(6) bond length is 2.19 Å. The Li(3)-O(7) bond length is 2.54 Å. The Li(3)-O(8) bond length is 2.04 Å. The Li(3)-F(2) bond length is 2.05 Å. In the fourth Li site, Li(4) is bonded to one O(10), one O(12), one O(6), one O(8), one F(1), and one F(4) atom to form LiO4F2 octahedra that share corners with two equivalent Li(1)O4F2 octahedra, corners with two equivalent V(2)O5F octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-13°. The Li(4)-O(10) bond length is 2.10 Å. The Li(4)-O(12) bond length is 2.23 Å. The Li(4)-O(6) bond length is 2.16 Å. The Li(4)-O(8) bond length is 2.08 Å. The Li(4)-F(1) bond length is 2.24 Å. The Li(4)-F(4) bond length is 2.01 Å. In the fifth Li site, Li(5) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(4), one O(8), one O(9), and one F(3) atom. The Li(5)-O(1) bond length is 2.13 Å. The Li(5)-O(10) bond length is 2.17 Å. The Li(5)-O(4) bond length is 2.11 Å. The Li(5)-O(8) bond length is 2.09 Å. The Li(5)-O(9) bond length is 2.54 Å. The Li(5)-F(3) bond length is 1.96 Å. In the sixth Li site, Li(6) is bonded to one O(10), one O(11), one O(2), one O(4), one O(5), and one O(6) atom to form LiO6 octahedra that share corners with two equivalent Li(8)O6 octahedra, corners with two equivalent V(4)O5F octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. The Li(6)-O(10) bond length is 2.19 Å. The Li(6)-O(11) bond length is 2.06 Å. The Li(6)-O(2) bond length is 2.12 Å. The Li(6)-O(4) bond length is 2.13 Å. The Li(6)-O(5) bond length is 2.19 Å. The Li(6)-O(6) bond length is 2.08 Å. In the seventh Li site, Li(7) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(3), one O(9), one F(1), and one F(2) atom. The Li(7)-O(10) bond length is 2.10 Å. The Li(7)-O(11) bond length is 2.07 Å. The Li(7)-O(3) bond length is 2.15 Å. The Li(7)-O(9) bond length is 2.43 Å. The Li(7)-F(1) bond length is 1.99 Å. The Li(7)-F(2) bond length is 1.89 Å. In the eighth Li site, Li(8) is bonded to one O(1), one O(11), one O(12), one O(2), one O(3), and one O(8) atom to form LiO6 octahedra that share corners with two equivalent Li(6)O6 octahedra, corners with two equivalent V(4)O5F octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. The Li(8)-O(1) bond length is 2.18 Å. The Li(8)-O(11) bond length is 2.03 Å. The Li(8)-O(12) bond length is 2.23 Å. The Li(8)-O(2) bond length is 2.21 Å. The Li(8)-O(3) bond length is 2.10 Å. The Li(8)-O(8) bond length is 2.09 Å. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(2), one O(5), one O(7), one O(8), one O(9), and one F(1) atom to form distorted VO5F octahedra that share corners with two equivalent Li(2)O4F2 octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(2)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 5-11°. The V(1)-O(2) bond length is 1.68 Å. The V(1)-O(5) bond length is 2.03 Å. The V(1)-O(7) bond length is 2.19 Å. The V(1)-O(8) bond length is 1.74 Å. The V(1)-O(9) bond length is 1.96 Å. The V(1)-F(1) bond length is 1.96 Å. In the second V site, V(2) is bonded to one O(12), one O(3), one O(5), one O(6), one O(9), and one F(3) atom to form distorted VO5F octahedra that share corners with two equivalent Li(1)O4F2 octahedra, corners with two equivalent Li(4)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(3)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. The V(2)-O(12) bond length is 2.16 Å. The V(2)-O(3) bond length is 1.76 Å. The V(2)-O(5) bond length is 2.06 Å. The V(2)-O(6) bond length is 1.69 Å. The V(2)-O(9) bond length is 2.02 Å. The V(2)-F(3) bond length is 1.90 Å. In the third V site, V(3) is bonded to one O(11), one O(12), one O(4), one O(7), one O(9), and one F(4) atom to form distorted VO5F octahedra that share  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one Li(6)O6 octahedra,  an edgeedge with one Li(8)O6 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(4)O5F octahedra. The V(3)-O(11) bond length is 1.69 Å. The V(3)-O(12) bond length is 1.93 Å. The V(3)-O(4) bond length is 1.76 Å. The V(3)-O(7) bond length is 2.19 Å. The V(3)-O(9) bond length is 1.95 Å. The V(3)-F(4) bond length is 1.97 Å. In the fourth V site, V(4) is bonded to one O(1), one O(10), one O(12), one O(5), one O(7), and one F(2) atom to form distorted VO5F octahedra that share corners with two equivalent Li(6)O6 octahedra, corners with two equivalent Li(8)O6 octahedra,  an edgeedge with one Li(1)O4F2 octahedra,  an edgeedge with one Li(2)O4F2 octahedra,  an edgeedge with one Li(4)O4F2 octahedra,  an edgeedge with one V(1)O5F octahedra,  an edgeedge with one V(2)O5F octahedra, and  an edgeedge with one V(3)O5F octahedra. The corner-sharing octahedral tilt angles range from 7-15°. The V(4)-O(1) bond length is 1.70 Å. The V(4)-O(10) bond length is 1.78 Å. The V(4)-O(12) bond length is 2.18 Å. The V(4)-O(5) bond length is 2.09 Å. The V(4)-O(7) bond length is 1.84 Å. The V(4)-F(2) bond length is 2.00 Å. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(5), one Li(8), and one V(4) atom. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Li(2), one Li(6), one Li(8), and one V(1) atom. In the third O site, O(3) is bonded to one Li(1), one Li(2), one Li(3), one Li(7), one Li(8), and one V(2) atom to form distorted OLi5V octahedra that share corners with two equivalent O(10)Li5V octahedra, corners with two equivalent O(5)Li2V3 square pyramids, corners with two equivalent O(8)Li4V trigonal bipyramids,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 14-19°. In the fourth O site, O(4) is bonded to one Li(1), one Li(3), one Li(5), one Li(6), and one V(3) atom to form distorted OLi4V trigonal bipyramids that share  a cornercorner with one O(12)Li2V3 square pyramid,  an edgeedge with one O(10)Li5V octahedra,  an edgeedge with one O(3)Li5V octahedra,  an edgeedge with one O(5)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(8)Li4V trigonal bipyramid. In the fifth O site, O(5) is bonded to one Li(1), one Li(6), one V(1), one V(2), and one V(4) atom to form OLi2V3 square pyramids that share corners with two equivalent O(10)Li5V octahedra, corners with two equivalent O(3)Li5V octahedra,  a cornercorner with one O(8)Li4V trigonal bipyramid,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 7-15°. In the sixth O site, O(6) is bonded in a rectangular see-saw-like geometry to one Li(3), one Li(4), one Li(6), and one V(2) atom. In the seventh O site, O(7) is bonded to one Li(2), one Li(3), one V(1), one V(3), and one V(4) atom to form distorted OLi2V3 square pyramids that share  an edgeedge with one O(10)Li5V octahedra,  an edgeedge with one O(3)Li5V octahedra,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(5)Li2V3 square pyramid,  an edgeedge with one O(4)Li4V trigonal bipyramid, and  an edgeedge with one O(8)Li4V trigonal bipyramid. In the eighth O site, O(8) is bonded to one Li(3), one Li(4), one Li(5), one Li(8), and one V(1) atom to form distorted OLi4V trigonal bipyramids that share corners with two equivalent O(10)Li5V octahedra, corners with two equivalent O(3)Li5V octahedra,  a cornercorner with one O(5)Li2V3 square pyramid,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 14-25°. In the ninth O site, O(9) is bonded in a 5-coordinate geometry to one Li(5), one Li(7), one V(1), one V(2), and one V(3) atom. In the tenth O site, O(10) is bonded to one Li(2), one Li(4), one Li(5), one Li(6), one Li(7), and one V(4) atom to form OLi5V octahedra that share corners with two equivalent O(3)Li5V octahedra, corners with two equivalent O(5)Li2V3 square pyramids, corners with two equivalent O(8)Li4V trigonal bipyramids,  an edgeedge with one O(12)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(4)Li4V trigonal bipyramid. The corner-sharing octahedral tilt angles range from 14-19°. In the eleventh O site, O(11) is bonded in a see-saw-like geometry to one Li(6), one Li(7), one Li(8), and one V(3) atom. In the twelfth O site, O(12) is bonded to one Li(4), one Li(8), one V(2), one V(3), and one V(4) atom to form OLi2V3 square pyramids that share  a cornercorner with one O(4)Li4V trigonal bipyramid,  an edgeedge with one O(10)Li5V octahedra,  an edgeedge with one O(3)Li5V octahedra,  an edgeedge with one O(5)Li2V3 square pyramid,  an edgeedge with one O(7)Li2V3 square pyramid, and  an edgeedge with one O(8)Li4V trigonal bipyramid. There are four inequivalent F sites. In the first F site, F(1) is bonded in a rectangular see-saw-like geometry to one Li(1), one Li(4), one Li(7), and one V(1) atom. In the second F site, F(2) is bonded in a T-shaped geometry to one Li(3), one Li(7), and one V(4) atom. In the third F site, F(3) is bonded in a T-shaped geometry to one Li(2), one Li(5), and one V(2) atom. In the fourth F site, F(4) is bonded in a see-saw-like geometry to one Li(1), one Li(2), one Li(4), and one V(3) atom.