LiMg2H8(C3O2)6 crystallizes in the monoclinic C2/c space group. Li(1) is bonded to two equivalent O(2) and two equivalent O(5) atoms to form LiO4 tetrahedra that share corners with two equivalent Mg(1)O4 trigonal pyramids. Both Li(1)-O(2) bond lengths are 2.05 Å. Both Li(1)-O(5) bond lengths are 1.85 Å. Mg(1) is bonded to one O(1), one O(2), one O(3), and one O(6) atom to form MgO4 trigonal pyramids that share  a cornercorner with one Li(1)O4 tetrahedra. The Mg(1)-O(1) bond length is 1.98 Å. The Mg(1)-O(2) bond length is 2.05 Å. The Mg(1)-O(3) bond length is 2.09 Å. The Mg(1)-O(6) bond length is 1.98 Å. There are nine inequivalent C sites. In the first C site, C(1) is bonded in a distorted bent 120 degrees geometry to one C(2), one O(1), and one O(2) atom. The C(1)-C(2) bond length is 1.49 Å. The C(1)-O(1) bond length is 1.25 Å. The C(1)-O(2) bond length is 1.27 Å. In the second C site, C(2) is bonded in a trigonal planar geometry to one C(1), one C(3), and one C(9) atom. The C(2)-C(3) bond length is 1.39 Å. The C(2)-C(9) bond length is 1.40 Å. In the third C site, C(3) is bonded in a distorted single-bond geometry to one C(2), one C(4), and one H(2) atom. The C(3)-C(4) bond length is 1.39 Å. The C(3)-H(2) bond length is 0.93 Å. In the fourth C site, C(4) is bonded in a trigonal planar geometry to one C(3), one C(5), and one C(6) atom. The C(4)-C(5) bond length is 1.50 Å. The C(4)-C(6) bond length is 1.39 Å. In the fifth C site, C(5) is bonded in a distorted bent 120 degrees geometry to one C(4), one O(3), and one O(4) atom. The C(5)-O(3) bond length is 1.24 Å. The C(5)-O(4) bond length is 1.28 Å. In the sixth C site, C(6) is bonded in a distorted single-bond geometry to one C(4), one C(7), and one H(3) atom. The C(6)-C(7) bond length is 1.38 Å. The C(6)-H(3) bond length is 0.93 Å. In the seventh C site, C(7) is bonded in a trigonal planar geometry to one C(6), one C(8), and one C(9) atom. The C(7)-C(8) bond length is 1.50 Å. The C(7)-C(9) bond length is 1.39 Å. In the eighth C site, C(8) is bonded in a distorted bent 120 degrees geometry to one C(7), one O(5), and one O(6) atom. The C(8)-O(5) bond length is 1.25 Å. The C(8)-O(6) bond length is 1.25 Å. In the ninth C site, C(9) is bonded in a distorted single-bond geometry to one C(2), one C(7), and one H(4) atom. The C(9)-H(4) bond length is 0.93 Å. There are four inequivalent H sites. In the first H site, H(1) is bonded in a distorted single-bond geometry to one O(4) atom. The H(1)-O(4) bond length is 0.82 Å. In the second H site, H(2) is bonded in a single-bond geometry to one C(3) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(6) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(9) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to one Mg(1) and one C(1) atom. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to one Li(1), one Mg(1), and one C(1) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Mg(1) and one C(5) atom. In the fourth O site, O(4) is bonded in a distorted water-like geometry to one C(5) and one H(1) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one Li(1) and one C(8) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Mg(1) and one C(8) atom. Linkers: 4 [O]C(=O)c1cc(C([O])=O)cc(C(=O)O)c1. Metal clusters: 2 [Li] ,4 [Mg]. The MOF has largest included sphere 5.14 A, density 1.21 g/cm3, surface area 4045.07 m2/g, accessible volume 0.35 cm3/g