Li6Mn2OF11 crystallizes in the triclinic P1 space group. There are six inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one F(10), one F(3), one F(7), and one F(8) atom. In the second Li site, Li(2) is bonded in a 8-coordinate geometry to one Mn(1), one F(11), one F(2), one F(4), one F(5), one F(6), one F(8), and one F(9) atom. In the third Li site, Li(3) is bonded in a 1-coordinate geometry to one O(1), one F(10), one F(3), one F(4), and one F(6) atom. In the fourth Li site, Li(4) is bonded in a 5-coordinate geometry to one O(1), one F(1), one F(10), one F(4), and one F(9) atom. In the fifth Li site, Li(5) is bonded in a distorted rectangular see-saw-like geometry to one F(2), one F(3), one F(5), and one F(8) atom. In the sixth Li site, Li(6) is bonded in a 5-coordinate geometry to one F(11), one F(5), one F(7), one F(8), and one F(9) atom. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a distorted rectangular see-saw-like geometry to one Li(2), one O(1), one F(11), one F(2), one F(4), one F(6), and one F(9) atom. In the second Mn site, Mn(2) is bonded in a 2-coordinate geometry to one O(1), one F(1), one F(3), one F(4), one F(5), and one F(7) atom. O(1) is bonded in a 4-coordinate geometry to one Li(3), one Li(4), one Mn(1), and one Mn(2) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a bent 120 degrees geometry to one Li(4) and one Mn(2) atom. In the second F site, F(2) is bonded in a distorted L-shaped geometry to one Li(2), one Li(5), and one Mn(1) atom. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Li(5), and one Mn(2) atom. In the fourth F site, F(4) is bonded in a 5-coordinate geometry to one Li(2), one Li(3), one Li(4), one Mn(1), and one Mn(2) atom. In the fifth F site, F(5) is bonded in a 3-coordinate geometry to one Li(2), one Li(5), one Li(6), and one Mn(2) atom. In the sixth F site, F(6) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Mn(1) atom. In the seventh F site, F(7) is bonded in a 3-coordinate geometry to one Li(1), one Li(6), and one Mn(2) atom. In the eighth F site, F(8) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), one Li(5), and one Li(6) atom. In the ninth F site, F(9) is bonded in a 4-coordinate geometry to one Li(2), one Li(4), one Li(6), and one Mn(1) atom. In the tenth F site, F(10) is bonded in a distorted water-like geometry to one Li(1), one Li(3), and one Li(4) atom. In the eleventh F site, F(11) is bonded in a distorted water-like geometry to one Li(2), one Li(6), and one Mn(1) atom.
Li6Mn2OF11 crystallizes in the triclinic P1 space group. There are six inequivalent Li sites. In the first Li site, Li(1) is bonded in a 4-coordinate geometry to one F(10), one F(3), one F(7), and one F(8) atom. The Li(1)-F(10) bond length is 1.81 Å. The Li(1)-F(3) bond length is 2.19 Å. The Li(1)-F(7) bond length is 1.95 Å. The Li(1)-F(8) bond length is 1.82 Å. In the second Li site, Li(2) is bonded in a 8-coordinate geometry to one Mn(1), one F(11), one F(2), one F(4), one F(5), one F(6), one F(8), and one F(9) atom. The Li(2)-Mn(1) bond length is 2.37 Å. The Li(2)-F(11) bond length is 2.49 Å. The Li(2)-F(2) bond length is 1.99 Å. The Li(2)-F(4) bond length is 2.26 Å. The Li(2)-F(5) bond length is 2.60 Å. The Li(2)-F(6) bond length is 2.50 Å. The Li(2)-F(8) bond length is 2.20 Å. The Li(2)-F(9) bond length is 1.90 Å. In the third Li site, Li(3) is bonded in a 1-coordinate geometry to one O(1), one F(10), one F(3), one F(4), and one F(6) atom. The Li(3)-O(1) bond length is 2.02 Å. The Li(3)-F(10) bond length is 1.70 Å. The Li(3)-F(3) bond length is 2.30 Å. The Li(3)-F(4) bond length is 2.52 Å. The Li(3)-F(6) bond length is 2.24 Å. In the fourth Li site, Li(4) is bonded in a 5-coordinate geometry to one O(1), one F(1), one F(10), one F(4), and one F(9) atom. The Li(4)-O(1) bond length is 2.17 Å. The Li(4)-F(1) bond length is 1.54 Å. The Li(4)-F(10) bond length is 2.46 Å. The Li(4)-F(4) bond length is 2.11 Å. The Li(4)-F(9) bond length is 1.99 Å. In the fifth Li site, Li(5) is bonded in a distorted rectangular see-saw-like geometry to one F(2), one F(3), one F(5), and one F(8) atom. The Li(5)-F(2) bond length is 2.12 Å. The Li(5)-F(3) bond length is 1.75 Å. The Li(5)-F(5) bond length is 2.19 Å. The Li(5)-F(8) bond length is 1.92 Å. In the sixth Li site, Li(6) is bonded in a 5-coordinate geometry to one F(11), one F(5), one F(7), one F(8), and one F(9) atom. The Li(6)-F(11) bond length is 1.90 Å. The Li(6)-F(5) bond length is 2.48 Å. The Li(6)-F(7) bond length is 2.16 Å. The Li(6)-F(8) bond length is 1.73 Å. The Li(6)-F(9) bond length is 2.39 Å. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a distorted rectangular see-saw-like geometry to one Li(2), one O(1), one F(11), one F(2), one F(4), one F(6), and one F(9) atom. The Mn(1)-O(1) bond length is 1.65 Å. The Mn(1)-F(11) bond length is 1.67 Å. The Mn(1)-F(2) bond length is 2.47 Å. The Mn(1)-F(4) bond length is 2.37 Å. The Mn(1)-F(6) bond length is 1.87 Å. The Mn(1)-F(9) bond length is 1.86 Å. In the second Mn site, Mn(2) is bonded in a 2-coordinate geometry to one O(1), one F(1), one F(3), one F(4), one F(5), and one F(7) atom. The Mn(2)-O(1) bond length is 2.18 Å. The Mn(2)-F(1) bond length is 1.77 Å. The Mn(2)-F(3) bond length is 1.76 Å. The Mn(2)-F(4) bond length is 2.64 Å. The Mn(2)-F(5) bond length is 2.05 Å. The Mn(2)-F(7) bond length is 2.57 Å. O(1) is bonded in a 4-coordinate geometry to one Li(3), one Li(4), one Mn(1), and one Mn(2) atom. There are eleven inequivalent F sites. In the first F site, F(1) is bonded in a bent 120 degrees geometry to one Li(4) and one Mn(2) atom. In the second F site, F(2) is bonded in a distorted L-shaped geometry to one Li(2), one Li(5), and one Mn(1) atom. In the third F site, F(3) is bonded in a 4-coordinate geometry to one Li(1), one Li(3), one Li(5), and one Mn(2) atom. In the fourth F site, F(4) is bonded in a 5-coordinate geometry to one Li(2), one Li(3), one Li(4), one Mn(1), and one Mn(2) atom. In the fifth F site, F(5) is bonded in a 3-coordinate geometry to one Li(2), one Li(5), one Li(6), and one Mn(2) atom. In the sixth F site, F(6) is bonded in a 3-coordinate geometry to one Li(2), one Li(3), and one Mn(1) atom. In the seventh F site, F(7) is bonded in a 3-coordinate geometry to one Li(1), one Li(6), and one Mn(2) atom. In the eighth F site, F(8) is bonded in a 4-coordinate geometry to one Li(1), one Li(2), one Li(5), and one Li(6) atom. In the ninth F site, F(9) is bonded in a 4-coordinate geometry to one Li(2), one Li(4), one Li(6), and one Mn(1) atom. In the tenth F site, F(10) is bonded in a distorted water-like geometry to one Li(1), one Li(3), and one Li(4) atom. In the eleventh F site, F(11) is bonded in a distorted water-like geometry to one Li(2), one Li(6), and one Mn(1) atom.