The compound described by Li4V5Mn2O12 crystallizes in the monoclinic P2_1 space group. There are four inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(3), one O(4), one O(5), one O(6), one O(8), and one O(9) atom to form LiO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, edges with two equivalent Li(4)O6 octahedra, and edges with two equivalent V(5)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-17°. In the second Li site, Li(2) is bonded to one O(1), one O(10), one O(11), one O(12), one O(2), and one O(7) atom to form LiO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one V(5)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-17°. In the third Li site, Li(3) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(8) atom to form LiO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(2)O6 octahedra, and edges with three equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-17°. In the fourth Li site, Li(4) is bonded to one O(10), one O(5), one O(6), one O(7), one O(8), and one O(9) atom to form LiO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one V(5)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, edges with two equivalent Li(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 2-10°. There are five inequivalent V sites. In the first V site, V(1) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(4)O6 octahedra, and edges with three equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-12°. In the second V site, V(2) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(8) atom to form VO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent Li(3)O6 octahedra, and edges with three equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 6-13°. In the third V site, V(3) is bonded to one O(1), one O(10), one O(2), one O(7), one O(8), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, edges with two equivalent Li(2)O6 octahedra, and edges with two equivalent Li(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-12°. In the fourth V site, V(4) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(1)O6 octahedra, and edges with three equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 2-12°. In the fifth V site, V(5) is bonded to one O(11), one O(12), one O(3), one O(4), one O(5), and one O(6) atom to form VO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, and edges with two equivalent Li(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-14°. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(8) atom to form MnO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent Li(3)O6 octahedra, and edges with three equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-14°. In the second Mn site, Mn(2) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(1)O6 octahedra, and edges with three equivalent V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-17°. There are twelve inequivalent O sites. In the first O site, O(1) is bonded to one Li(2), one Li(3), one V(2), one V(3), and one Mn(1) atom to form OLi2MnV2 square pyramids that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid, corners with two equivalent O(12)Li2MnV2 square pyramids, corners with two equivalent O(2)LiMnV3 square pyramids,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(6)Li3MnV2 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(12)Li2MnV2 square pyramid, and  an edgeedge with one O(4)Li2MnV2 square pyramid. The corner-sharing octahedral tilt angles range from 5-11°. In the second O site, O(2) is bonded to one Li(2), one V(1), one V(3), one V(4), and one Mn(2) atom to form OLiMnV3 square pyramids that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid, corners with two equivalent O(1)Li2MnV2 square pyramids, corners with two equivalent O(11)LiMnV3 square pyramids,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(7)Li3MnV2 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(11)LiMnV3 square pyramid, and  an edgeedge with one O(3)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 6-8°. In the third O site, O(3) is bonded to one Li(1), one V(1), one V(4), one V(5), and one Mn(2) atom to form OLiMnV3 square pyramids that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid, corners with two equivalent O(4)Li2MnV2 square pyramids, corners with two equivalent O(11)LiMnV3 square pyramids,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(6)Li3MnV2 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(11)LiMnV3 square pyramid, and  an edgeedge with one O(2)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 4-10°. In the fourth O site, O(4) is bonded to one Li(1), one Li(3), one V(2), one V(5), and one Mn(1) atom to form OLi2MnV2 square pyramids that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid, corners with two equivalent O(12)Li2MnV2 square pyramids, corners with two equivalent O(3)LiMnV3 square pyramids,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(7)Li3MnV2 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid, and  an edgeedge with one O(12)Li2MnV2 square pyramid. The corner-sharing octahedral tilt angles range from 8-13°. In the fifth O site, O(5) is bonded to one Li(1), one Li(4), one V(1), one V(4), one V(5), and one Mn(2) atom to form OLi2MnV3 octahedra that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid,  an edgeedge with one O(6)Li3MnV2 octahedra,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(4)Li2MnV2 square pyramid,  an edgeedge with one O(2)LiMnV3 square pyramid, edges with two equivalent O(11)LiMnV3 square pyramids, and edges with two equivalent O(3)LiMnV3 square pyramids. The corner-sharing octahedral tilt angles range from 4-9°. In the sixth O site, O(6) is bonded to one Li(1), one Li(3), one Li(4), one V(2), one V(5), and one Mn(1) atom to form OLi3MnV2 octahedra that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid,  an edgeedge with one O(3)LiMnV3 square pyramid, edges with two equivalent O(12)Li2MnV2 square pyramids, and edges with two equivalent O(4)Li2MnV2 square pyramids. The corner-sharing octahedral tilt angles range from 4-8°. In the seventh O site, O(7) is bonded to one Li(2), one Li(3), one Li(4), one V(2), one V(3), and one Mn(1) atom to form OLi3MnV2 octahedra that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(4)Li2MnV2 square pyramid,  an edgeedge with one O(2)LiMnV3 square pyramid, edges with two equivalent O(1)Li2MnV2 square pyramids, and edges with two equivalent O(12)Li2MnV2 square pyramids. The corner-sharing octahedral tilt angles range from 5-9°. In the eighth O site, O(8) is bonded to one Li(1), one Li(3), one Li(4), one V(2), one V(3), and one Mn(1) atom to form OLi3MnV2 octahedra that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra,  an edgeedge with one O(12)Li2MnV2 square pyramid, edges with two equivalent O(1)Li2MnV2 square pyramids, and edges with two equivalent O(4)Li2MnV2 square pyramids. The corner-sharing octahedral tilt angles range from 2-5°. In the ninth O site, O(9) is bonded to one Li(1), one Li(4), one V(1), one V(3), one V(4), and one Mn(2) atom to form OLi2MnV3 octahedra that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid,  an edgeedge with one O(6)Li3MnV2 octahedra,  an edgeedge with one O(7)Li3MnV2 octahedra,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra,  an edgeedge with one O(11)LiMnV3 square pyramid, edges with two equivalent O(2)LiMnV3 square pyramids, and edges with two equivalent O(3)LiMnV3 square pyramids. The corner-sharing octahedral tilt angles range from 2-8°. In the tenth O site, O(10) is bonded to one Li(2), one Li(4), one V(1), one V(3), one V(4), and one Mn(2) atom to form OLi2MnV3 octahedra that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid,  an edgeedge with one O(7)Li3MnV2 octahedra,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid,  an edgeedge with one O(3)LiMnV3 square pyramid, edges with two equivalent O(11)LiMnV3 square pyramids, and edges with two equivalent O(2)LiMnV3 square pyramids. The corner-sharing octahedral tilt angles range from 5-8°. In the eleventh O site, O(11) is bonded to one Li(2), one V(1), one V(4), one V(5), and one Mn(2) atom to form OLiMnV3 square pyramids that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid, corners with two equivalent O(2)LiMnV3 square pyramids, corners with two equivalent O(3)LiMnV3 square pyramids,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra,  an edgeedge with one O(12)Li2MnV2 square pyramid,  an edgeedge with one O(2)LiMnV3 square pyramid, and  an edgeedge with one O(3)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 1-16°. In the twelfth O site, O(12) is bonded to one Li(2), one Li(3), one V(2), one V(5), and one Mn(1) atom to form OLi2MnV2 square pyramids that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid, corners with two equivalent O(1)Li2MnV2 square pyramids, corners with two equivalent O(4)Li2MnV2 square pyramids,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid,  an edgeedge with one O(4)Li2MnV2 square pyramid, and  an edgeedge with one O(11)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 2-7°. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li4Mn2V5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.029
_cell_length_b   5.321
_cell_length_c   9.908
_cell_angle_alpha   80.512
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   469.449
_cell_formula_units_Z   2
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
  Li  Li0  1  0.918  0.013  0.739  1.0
  Li  Li1  1  0.918  0.481  0.259  1.0
  Li  Li2  1  0.582  0.758  0.503  1.0
  Li  Li3  1  0.418  0.987  0.261  1.0
  Li  Li4  1  0.586  0.500  0.258  1.0
  Li  Li5  1  0.418  0.519  0.741  1.0
  Li  Li6  1  0.082  0.242  0.497  1.0
  Li  Li7  1  0.086  0.500  0.742  1.0
  Mn  Mn8  1  0.751  0.241  0.505  1.0
  Mn  Mn9  1  0.743  0.765  0.986  1.0
  Mn  Mn10  1  0.243  0.235  0.014  1.0
  Mn  Mn11  1  0.251  0.759  0.495  1.0
  V  V12  1  0.917  0.253  0.002  1.0
  V  V13  1  0.922  0.746  0.494  1.0
  V  V14  1  0.752  0.998  0.255  1.0
  V  V15  1  0.576  0.248  0.000  1.0
  V  V16  1  0.744  0.503  0.740  1.0
  V  V17  1  0.422  0.254  0.506  1.0
  V  V18  1  0.417  0.747  0.998  1.0
  V  V19  1  0.252  0.002  0.745  1.0
  V  V20  1  0.244  0.497  0.260  1.0
  V  V21  1  0.076  0.752  1.000  1.0
  O  O22  1  0.896  0.122  0.383  1.0
  O  O23  1  0.911  0.900  0.108  1.0
  O  O24  1  0.754  0.164  0.879  1.0
  O  O25  1  0.775  0.841  0.624  1.0
  O  O26  1  0.912  0.602  0.877  1.0
  O  O27  1  0.906  0.377  0.614  1.0
  O  O28  1  0.767  0.652  0.367  1.0
  O  O29  1  0.594  0.136  0.389  1.0
  O  O30  1  0.583  0.895  0.124  1.0
  O  O31  1  0.742  0.346  0.124  1.0
  O  O32  1  0.411  0.100  0.892  1.0
  O  O33  1  0.396  0.878  0.617  1.0
  O  O34  1  0.573  0.589  0.883  1.0
  O  O35  1  0.598  0.387  0.614  1.0
  O  O36  1  0.275  0.159  0.376  1.0
  O  O37  1  0.406  0.623  0.386  1.0
  O  O38  1  0.412  0.398  0.123  1.0
  O  O39  1  0.254  0.836  0.121  1.0
  O  O40  1  0.242  0.654  0.876  1.0
  O  O41  1  0.083  0.105  0.876  1.0
  O  O42  1  0.094  0.864  0.611  1.0
  O  O43  1  0.267  0.348  0.633  1.0
  O  O44  1  0.098  0.613  0.386  1.0
  O  O45  1  0.073  0.411  0.117  1.0
[/CIF]
.
The compound described by Li4V5Mn2O12 crystallizes in the monoclinic P2_1 space group. There are four inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(3), one O(4), one O(5), one O(6), one O(8), and one O(9) atom to form LiO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, edges with two equivalent Li(4)O6 octahedra, and edges with two equivalent V(5)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-17°. In the second Li site, Li(2) is bonded to one O(1), one O(10), one O(11), one O(12), one O(2), and one O(7) atom to form LiO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one V(5)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-17°. In the third Li site, Li(3) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(8) atom to form LiO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(2)O6 octahedra, and edges with three equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-17°. In the fourth Li site, Li(4) is bonded to one O(10), one O(5), one O(6), one O(7), one O(8), and one O(9) atom to form LiO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one V(5)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, edges with two equivalent Li(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 2-10°. There are five inequivalent V sites. In the first V site, V(1) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(4)O6 octahedra, and edges with three equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 3-12°. In the second V site, V(2) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(8) atom to form VO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent Li(3)O6 octahedra, and edges with three equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 6-13°. In the third V site, V(3) is bonded to one O(1), one O(10), one O(2), one O(7), one O(8), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, edges with two equivalent Li(2)O6 octahedra, and edges with two equivalent Li(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-12°. In the fourth V site, V(4) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(9) atom to form VO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(1)O6 octahedra, and edges with three equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 2-12°. In the fifth V site, V(5) is bonded to one O(11), one O(12), one O(3), one O(4), one O(5), and one O(6) atom to form VO6 octahedra that share  a cornercorner with one Li(3)O6 octahedra,  a cornercorner with one V(1)O6 octahedra,  a cornercorner with one V(2)O6 octahedra,  a cornercorner with one V(4)O6 octahedra,  a cornercorner with one Mn(1)O6 octahedra,  a cornercorner with one Mn(2)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(3)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(1)O6 octahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra,  an edgeedge with one Mn(1)O6 octahedra,  an edgeedge with one Mn(2)O6 octahedra, and edges with two equivalent Li(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-14°. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(8) atom to form MnO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent Li(3)O6 octahedra, and edges with three equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 4-14°. In the second Mn site, Mn(2) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Li(1)O6 octahedra,  a cornercorner with one Li(2)O6 octahedra,  a cornercorner with one Li(4)O6 octahedra,  a cornercorner with one V(3)O6 octahedra,  a cornercorner with one V(5)O6 octahedra,  an edgeedge with one Li(1)O6 octahedra,  an edgeedge with one Li(2)O6 octahedra,  an edgeedge with one Li(4)O6 octahedra,  an edgeedge with one V(3)O6 octahedra,  an edgeedge with one V(5)O6 octahedra, edges with three equivalent V(1)O6 octahedra, and edges with three equivalent V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 5-17°. There are twelve inequivalent O sites. In the first O site, O(1) is bonded to one Li(2), one Li(3), one V(2), one V(3), and one Mn(1) atom to form OLi2MnV2 square pyramids that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid, corners with two equivalent O(12)Li2MnV2 square pyramids, corners with two equivalent O(2)LiMnV3 square pyramids,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(6)Li3MnV2 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(12)Li2MnV2 square pyramid, and  an edgeedge with one O(4)Li2MnV2 square pyramid. The corner-sharing octahedral tilt angles range from 5-11°. In the second O site, O(2) is bonded to one Li(2), one V(1), one V(3), one V(4), and one Mn(2) atom to form OLiMnV3 square pyramids that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid, corners with two equivalent O(1)Li2MnV2 square pyramids, corners with two equivalent O(11)LiMnV3 square pyramids,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(7)Li3MnV2 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(11)LiMnV3 square pyramid, and  an edgeedge with one O(3)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 6-8°. In the third O site, O(3) is bonded to one Li(1), one V(1), one V(4), one V(5), and one Mn(2) atom to form OLiMnV3 square pyramids that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid, corners with two equivalent O(4)Li2MnV2 square pyramids, corners with two equivalent O(11)LiMnV3 square pyramids,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(6)Li3MnV2 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(11)LiMnV3 square pyramid, and  an edgeedge with one O(2)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 4-10°. In the fourth O site, O(4) is bonded to one Li(1), one Li(3), one V(2), one V(5), and one Mn(1) atom to form OLi2MnV2 square pyramids that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid, corners with two equivalent O(12)Li2MnV2 square pyramids, corners with two equivalent O(3)LiMnV3 square pyramids,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(7)Li3MnV2 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid, and  an edgeedge with one O(12)Li2MnV2 square pyramid. The corner-sharing octahedral tilt angles range from 8-13°. In the fifth O site, O(5) is bonded to one Li(1), one Li(4), one V(1), one V(4), one V(5), and one Mn(2) atom to form OLi2MnV3 octahedra that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid,  an edgeedge with one O(6)Li3MnV2 octahedra,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(4)Li2MnV2 square pyramid,  an edgeedge with one O(2)LiMnV3 square pyramid, edges with two equivalent O(11)LiMnV3 square pyramids, and edges with two equivalent O(3)LiMnV3 square pyramids. The corner-sharing octahedral tilt angles range from 4-9°. In the sixth O site, O(6) is bonded to one Li(1), one Li(3), one Li(4), one V(2), one V(5), and one Mn(1) atom to form OLi3MnV2 octahedra that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid,  an edgeedge with one O(3)LiMnV3 square pyramid, edges with two equivalent O(12)Li2MnV2 square pyramids, and edges with two equivalent O(4)Li2MnV2 square pyramids. The corner-sharing octahedral tilt angles range from 4-8°. In the seventh O site, O(7) is bonded to one Li(2), one Li(3), one Li(4), one V(2), one V(3), and one Mn(1) atom to form OLi3MnV2 octahedra that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(8)Li3MnV2 octahedra,  an edgeedge with one O(4)Li2MnV2 square pyramid,  an edgeedge with one O(2)LiMnV3 square pyramid, edges with two equivalent O(1)Li2MnV2 square pyramids, and edges with two equivalent O(12)Li2MnV2 square pyramids. The corner-sharing octahedral tilt angles range from 5-9°. In the eighth O site, O(8) is bonded to one Li(1), one Li(3), one Li(4), one V(2), one V(3), and one Mn(1) atom to form OLi3MnV2 octahedra that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid,  an edgeedge with one O(10)Li2MnV3 octahedra,  an edgeedge with one O(5)Li2MnV3 octahedra,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra,  an edgeedge with one O(12)Li2MnV2 square pyramid, edges with two equivalent O(1)Li2MnV2 square pyramids, and edges with two equivalent O(4)Li2MnV2 square pyramids. The corner-sharing octahedral tilt angles range from 2-5°. In the ninth O site, O(9) is bonded to one Li(1), one Li(4), one V(1), one V(3), one V(4), and one Mn(2) atom to form OLi2MnV3 octahedra that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid,  a cornercorner with one O(11)LiMnV3 square pyramid,  an edgeedge with one O(6)Li3MnV2 octahedra,  an edgeedge with one O(7)Li3MnV2 octahedra,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra,  an edgeedge with one O(11)LiMnV3 square pyramid, edges with two equivalent O(2)LiMnV3 square pyramids, and edges with two equivalent O(3)LiMnV3 square pyramids. The corner-sharing octahedral tilt angles range from 2-8°. In the tenth O site, O(10) is bonded to one Li(2), one Li(4), one V(1), one V(3), one V(4), and one Mn(2) atom to form OLi2MnV3 octahedra that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(12)Li2MnV2 square pyramid,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid,  an edgeedge with one O(7)Li3MnV2 octahedra,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra, edges with two equivalent O(9)Li2MnV3 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid,  an edgeedge with one O(3)LiMnV3 square pyramid, edges with two equivalent O(11)LiMnV3 square pyramids, and edges with two equivalent O(2)LiMnV3 square pyramids. The corner-sharing octahedral tilt angles range from 5-8°. In the eleventh O site, O(11) is bonded to one Li(2), one V(1), one V(4), one V(5), and one Mn(2) atom to form OLiMnV3 square pyramids that share  a cornercorner with one O(9)Li2MnV3 octahedra,  a cornercorner with one O(6)Li3MnV2 octahedra,  a cornercorner with one O(7)Li3MnV2 octahedra,  a cornercorner with one O(1)Li2MnV2 square pyramid,  a cornercorner with one O(4)Li2MnV2 square pyramid, corners with two equivalent O(2)LiMnV3 square pyramids, corners with two equivalent O(3)LiMnV3 square pyramids,  an edgeedge with one O(9)Li2MnV3 octahedra, edges with two equivalent O(10)Li2MnV3 octahedra, edges with two equivalent O(5)Li2MnV3 octahedra,  an edgeedge with one O(12)Li2MnV2 square pyramid,  an edgeedge with one O(2)LiMnV3 square pyramid, and  an edgeedge with one O(3)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 1-16°. In the twelfth O site, O(12) is bonded to one Li(2), one Li(3), one V(2), one V(5), and one Mn(1) atom to form OLi2MnV2 square pyramids that share  a cornercorner with one O(10)Li2MnV3 octahedra,  a cornercorner with one O(5)Li2MnV3 octahedra,  a cornercorner with one O(8)Li3MnV2 octahedra,  a cornercorner with one O(2)LiMnV3 square pyramid,  a cornercorner with one O(3)LiMnV3 square pyramid, corners with two equivalent O(1)Li2MnV2 square pyramids, corners with two equivalent O(4)Li2MnV2 square pyramids,  an edgeedge with one O(8)Li3MnV2 octahedra, edges with two equivalent O(6)Li3MnV2 octahedra, edges with two equivalent O(7)Li3MnV2 octahedra,  an edgeedge with one O(1)Li2MnV2 square pyramid,  an edgeedge with one O(4)Li2MnV2 square pyramid, and  an edgeedge with one O(11)LiMnV3 square pyramid. The corner-sharing octahedral tilt angles range from 2-7°. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li4Mn2V5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.029
_cell_length_b   5.321
_cell_length_c   9.908
_cell_angle_alpha   80.512
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   469.449
_cell_formula_units_Z   2
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
  Li  Li0  1  0.918  0.013  0.739  1.0
  Li  Li1  1  0.918  0.481  0.259  1.0
  Li  Li2  1  0.582  0.758  0.503  1.0
  Li  Li3  1  0.418  0.987  0.261  1.0
  Li  Li4  1  0.586  0.500  0.258  1.0
  Li  Li5  1  0.418  0.519  0.741  1.0
  Li  Li6  1  0.082  0.242  0.497  1.0
  Li  Li7  1  0.086  0.500  0.742  1.0
  Mn  Mn8  1  0.751  0.241  0.505  1.0
  Mn  Mn9  1  0.743  0.765  0.986  1.0
  Mn  Mn10  1  0.243  0.235  0.014  1.0
  Mn  Mn11  1  0.251  0.759  0.495  1.0
  V  V12  1  0.917  0.253  0.002  1.0
  V  V13  1  0.922  0.746  0.494  1.0
  V  V14  1  0.752  0.998  0.255  1.0
  V  V15  1  0.576  0.248  0.000  1.0
  V  V16  1  0.744  0.503  0.740  1.0
  V  V17  1  0.422  0.254  0.506  1.0
  V  V18  1  0.417  0.747  0.998  1.0
  V  V19  1  0.252  0.002  0.745  1.0
  V  V20  1  0.244  0.497  0.260  1.0
  V  V21  1  0.076  0.752  1.000  1.0
  O  O22  1  0.896  0.122  0.383  1.0
  O  O23  1  0.911  0.900  0.108  1.0
  O  O24  1  0.754  0.164  0.879  1.0
  O  O25  1  0.775  0.841  0.624  1.0
  O  O26  1  0.912  0.602  0.877  1.0
  O  O27  1  0.906  0.377  0.614  1.0
  O  O28  1  0.767  0.652  0.367  1.0
  O  O29  1  0.594  0.136  0.389  1.0
  O  O30  1  0.583  0.895  0.124  1.0
  O  O31  1  0.742  0.346  0.124  1.0
  O  O32  1  0.411  0.100  0.892  1.0
  O  O33  1  0.396  0.878  0.617  1.0
  O  O34  1  0.573  0.589  0.883  1.0
  O  O35  1  0.598  0.387  0.614  1.0
  O  O36  1  0.275  0.159  0.376  1.0
  O  O37  1  0.406  0.623  0.386  1.0
  O  O38  1  0.412  0.398  0.123  1.0
  O  O39  1  0.254  0.836  0.121  1.0
  O  O40  1  0.242  0.654  0.876  1.0
  O  O41  1  0.083  0.105  0.876  1.0
  O  O42  1  0.094  0.864  0.611  1.0
  O  O43  1  0.267  0.348  0.633  1.0
  O  O44  1  0.098  0.613  0.386  1.0
  O  O45  1  0.073  0.411  0.117  1.0
[/CIF]
.