Nd2C39H29(NO8)2CH3(H2)2 crystallizes in the triclinic P-1 space group. The structure consists of two 02329_fluka molecules and four 1333-74-0 molecules inside a Nd2C39H29(NO8)2 framework. In the Nd2C39H29(NO8)2 framework, there are two inequivalent Nd sites. In the first Nd site, Nd(1) is bonded in a 9-coordinate geometry to one O(1), one O(10), one O(12), one O(13), one O(15), one O(3), one O(5), and two equivalent O(7) atoms. The Nd(1)-O(1) bond length is 2.54 Å. The Nd(1)-O(10) bond length is 2.47 Å. The Nd(1)-O(12) bond length is 2.43 Å. The Nd(1)-O(13) bond length is 2.55 Å. The Nd(1)-O(15) bond length is 2.57 Å. The Nd(1)-O(3) bond length is 2.45 Å. The Nd(1)-O(5) bond length is 2.48 Å. There is one shorter (2.42 Å) and one longer (2.72 Å) Nd(1)-O(7) bond length. In the second Nd site, Nd(2) is bonded in a 9-coordinate geometry to one O(11), one O(14), one O(16), one O(2), one O(4), one O(6), one O(9), and two equivalent O(8) atoms. The Nd(2)-O(11) bond length is 2.43 Å. The Nd(2)-O(14) bond length is 2.55 Å. The Nd(2)-O(16) bond length is 2.57 Å. The Nd(2)-O(2) bond length is 2.54 Å. The Nd(2)-O(4) bond length is 2.45 Å. The Nd(2)-O(6) bond length is 2.49 Å. The Nd(2)-O(9) bond length is 2.47 Å. There is one shorter (2.42 Å) and one longer (2.72 Å) Nd(2)-O(8) bond length. There are thirty-four inequivalent C sites. In the first C site, C(27) is bonded in a trigonal planar geometry to one C(25), one C(29), and one C(31) atom. The C(27)-C(25) bond length is 1.40 Å. The C(27)-C(29) bond length is 1.40 Å. The C(27)-C(31) bond length is 1.50 Å. In the second C site, C(28) is bonded in a trigonal planar geometry to one C(26), one C(30), and one C(32) atom. The C(28)-C(26) bond length is 1.40 Å. The C(28)-C(30) bond length is 1.40 Å. The C(28)-C(32) bond length is 1.50 Å. In the third C site, C(29) is bonded in a distorted single-bond geometry to one C(19); one C(27); and one H(13,14) atom. The C(29)-C(19) bond length is 1.40 Å. The C(29)-H(13,14) bond length is 1.09 Å. In the fourth C site, C(30) is bonded in a distorted single-bond geometry to one C(20); one C(28); and one H(13,14) atom. The C(30)-C(20) bond length is 1.40 Å. The C(30)-H(13,14) bond length is 1.09 Å. In the fifth C site, C(31) is bonded in a bent 120 degrees geometry to one C(27), one O(11), and one O(9) atom. The C(31)-O(11) bond length is 1.27 Å. The C(31)-O(9) bond length is 1.27 Å. In the sixth C site, C(32) is bonded in a bent 120 degrees geometry to one C(28), one O(10), and one O(12) atom. The C(32)-O(10) bond length is 1.27 Å. The C(32)-O(12) bond length is 1.27 Å. In the seventh C site, C(33) is bonded in a distorted bent 120 degrees geometry to one C(35,36); one H(17,18); and one O(13) atom. The C(33)-C(35,36) bond length is 1.48 Å. The C(33)-H(17,18) bond length is 1.11 Å. The C(33)-O(13) bond length is 1.23 Å. In the eighth C site, C(34) is bonded in a distorted bent 120 degrees geometry to one C(35,36); one H(17,18); and one O(14) atom. The C(34)-C(35,36) bond length is 1.48 Å. The C(34)-H(17,18) bond length is 1.11 Å. The C(34)-O(14) bond length is 1.23 Å. In the ninth C site, C(35,36) is bonded in a distorted trigonal non-coplanar geometry to one C(33); one H(19,20); one H(21,22); and one H(23,24) atom. The C(35,36)-H(19,20) bond length is 1.10 Å. The C(35,36)-H(21,22) bond length is 1.10 Å. The C(35,36)-H(23,24) bond length is 1.09 Å. In the tenth C site, C(37) is bonded in a distorted bent 120 degrees geometry to one C(39), one H(27), and one O(15) atom. The C(37)-C(39) bond length is 1.48 Å. The C(37)-H(27) bond length is 1.11 Å. The C(37)-O(15) bond length is 1.23 Å. In the eleventh C site, C(38) is bonded in a distorted bent 120 degrees geometry to one H(28) and one O(16) atom. The C(38)-H(28) bond length is 1.11 Å. The C(38)-O(16) bond length is 1.23 Å. In the twelfth C site, C(39) is bonded in a distorted trigonal non-coplanar geometry to one C(37); one H(29); and two equivalent H(31,33) atoms. The C(39)-H(29) bond length is 1.10 Å. Both C(39)-H(31,33) bond lengths are 1.10 Å. In the thirteenth C site, C(1) is bonded in a bent 120 degrees geometry to one C(3), one O(1), and one O(3) atom. The C(1)-C(3) bond length is 1.50 Å. The C(1)-O(1) bond length is 1.28 Å. The C(1)-O(3) bond length is 1.28 Å. In the fourteenth C site, C(2) is bonded in a bent 120 degrees geometry to one C(4), one O(2), and one O(4) atom. The C(2)-C(4) bond length is 1.50 Å. The C(2)-O(2) bond length is 1.28 Å. The C(2)-O(4) bond length is 1.28 Å. In the fifteenth C site, C(3) is bonded in a trigonal planar geometry to one C(1); one C(13,14); and one C(5,6) atom. The C(3)-C(13,14) bond length is 1.41 Å. The C(3)-C(5,6) bond length is 1.40 Å. In the sixteenth C site, C(4) is bonded in a trigonal planar geometry to one C(13,14); one C(2); and one C(5,6) atom. The C(4)-C(13,14) bond length is 1.41 Å. The C(4)-C(5,6) bond length is 1.40 Å. In the seventeenth C site, C(5,6) is bonded in a distorted trigonal planar geometry to one C(3), one C(7), and one H(1) atom. The C(5,6)-C(7) bond length is 1.39 Å. The C(5,6)-H(1) bond length is 1.09 Å. In the eighteenth C site, C(7) is bonded in a distorted trigonal planar geometry to one C(5,6); one C(9,10); and one H(3,4) atom. The C(7)-C(9,10) bond length is 1.41 Å. The C(7)-H(3,4) bond length is 1.09 Å. In the nineteenth C site, C(8) is bonded in a distorted trigonal planar geometry to one C(5,6); one C(9,10); and one H(3,4) atom. The C(8)-C(5,6) bond length is 1.39 Å. The C(8)-C(9,10) bond length is 1.41 Å. The C(8)-H(3,4) bond length is 1.09 Å. In the twentieth C site, C(9,10) is bonded in a trigonal planar geometry to one C(11), one C(15), and one C(7) atom. The C(9,10)-C(11) bond length is 1.41 Å. The C(9,10)-C(15) bond length is 1.46 Å. In the twenty-first C site, C(11) is bonded in a distorted single-bond geometry to one C(9,10) and one H(5,6) atom. The C(11)-H(5,6) bond length is 1.09 Å. In the twenty-second C site, C(12) is bonded in a distorted single-bond geometry to one C(9,10) and one H(5,6) atom. The C(12)-C(9,10) bond length is 1.41 Å. The C(12)-H(5,6) bond length is 1.09 Å. In the twenty-third C site, C(13,14) is bonded in a distorted single-bond geometry to one C(3) and one H(7) atom. The C(13,14)-H(7) bond length is 1.09 Å. In the twenty-fourth C site, C(15) is bonded in a distorted bent 120 degrees geometry to one C(9,10); one N(1); and one H(35,36) atom. The C(15)-N(1) bond length is 1.29 Å. The C(15)-H(35,36) bond length is 1.11 Å. In the twenty-fifth C site, C(16) is bonded in a distorted bent 120 degrees geometry to one C(9,10); one N(2); and one H(35,36) atom. The C(16)-C(9,10) bond length is 1.46 Å. The C(16)-N(2) bond length is 1.29 Å. The C(16)-H(35,36) bond length is 1.11 Å. In the twenty-sixth C site, C(17,18) is bonded in a distorted bent 120 degrees geometry to one C(19), one O(5), and one O(7) atom. The C(17,18)-C(19) bond length is 1.49 Å. The C(17,18)-O(5) bond length is 1.27 Å. The C(17,18)-O(7) bond length is 1.29 Å. In the twenty-seventh C site, C(19) is bonded in a trigonal planar geometry to one C(17,18); one C(21); and one C(29) atom. The C(19)-C(21) bond length is 1.40 Å. In the twenty-eighth C site, C(20) is bonded in a trigonal planar geometry to one C(17,18); one C(22); and one C(30) atom. The C(20)-C(17,18) bond length is 1.49 Å. The C(20)-C(22) bond length is 1.40 Å. In the twenty-ninth C site, C(21) is bonded in a distorted single-bond geometry to one C(19), one C(23), and one H(9) atom. The C(21)-C(23) bond length is 1.40 Å. The C(21)-H(9) bond length is 1.09 Å. In the thirtieth C site, C(22) is bonded in a distorted single-bond geometry to one C(20), one C(24), and one H(10) atom. The C(22)-C(24) bond length is 1.40 Å. The C(22)-H(10) bond length is 1.09 Å. In the thirty-first C site, C(23) is bonded in a distorted trigonal planar geometry to one C(21), one C(25), and one N(1) atom. The C(23)-C(25) bond length is 1.41 Å. The C(23)-N(1) bond length is 1.40 Å. In the thirty-second C site, C(24) is bonded in a distorted trigonal planar geometry to one C(22), one C(26), and one N(2) atom. The C(24)-C(26) bond length is 1.41 Å. The C(24)-N(2) bond length is 1.40 Å. In the thirty-third C site, C(25) is bonded in a distorted single-bond geometry to one C(23), one C(27), and one H(11) atom. The C(25)-H(11) bond length is 1.09 Å. In the thirty-fourth C site, C(26) is bonded in a distorted single-bond geometry to one C(24), one C(28), and one H(12) atom. The C(26)-H(12) bond length is 1.09 Å. There are two inequivalent N sites. In the first N site, N(1) is bonded in a bent 120 degrees geometry to one C(15) and one C(23) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one C(16) and one C(24) atom. There are twenty inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(5,6) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(5,6) atom. The H(2)-C(5,6) bond length is 1.09 Å. In the third H site, H(3,4) is bonded in a single-bond geometry to one C(7) atom. In the fourth H site, H(5,6) is bonded in a single-bond geometry to one C(11) atom. In the fifth H site, H(7) is bonded in a single-bond geometry to one C(13,14) atom. In the sixth H site, H(8) is bonded in a single-bond geometry to one C(13,14) atom. The H(8)-C(13,14) bond length is 1.09 Å. In the seventh H site, H(9) is bonded in a single-bond geometry to one C(21) atom. In the eighth H site, H(10) is bonded in a single-bond geometry to one C(22) atom. In the ninth H site, H(11) is bonded in a single-bond geometry to one C(25) atom. In the tenth H site, H(12) is bonded in a single-bond geometry to one C(26) atom. In the eleventh H site, H(13,14) is bonded in a single-bond geometry to one C(29) atom. In the twelfth H site, H(17,18) is bonded in a single-bond geometry to one C(33) atom. In the thirteenth H site, H(19,20) is bonded in a single-bond geometry to one C(35,36) atom. In the fourteenth H site, H(21,22) is bonded in a single-bond geometry to one C(35,36) atom. In the fifteenth H site, H(23,24) is bonded in a single-bond geometry to one C(35,36) atom. In the sixteenth H site, H(27) is bonded in a single-bond geometry to one C(37) atom. In the seventeenth H site, H(28) is bonded in a single-bond geometry to one C(38) atom. In the eighteenth H site, H(29) is bonded in a single-bond geometry to one C(39) atom. In the nineteenth H site, H(31,33) is bonded in a single-bond geometry to one C(39) atom. In the twentieth H site, H(35,36) is bonded in a single-bond geometry to one C(15) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Nd(1) and one C(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Nd(2) and one C(2) atom. In the third O site, O(3) is bonded in a distorted L-shaped geometry to one Nd(1) and one C(1) atom. In the fourth O site, O(4) is bonded in a distorted L-shaped geometry to one Nd(2) and one C(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Nd(1) and one C(17,18) atom. In the sixth O site, O(6) is bonded in a distorted single-bond geometry to one Nd(2) and one C(17,18) atom. The O(6)-C(17,18) bond length is 1.27 Å. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one C(17,18) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to two equivalent Nd(2) and one C(17,18) atom. The O(8)-C(17,18) bond length is 1.29 Å. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Nd(2) and one C(31) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one Nd(1) and one C(32) atom. In the eleventh O site, O(11) is bonded in a distorted bent 120 degrees geometry to one Nd(2) and one C(31) atom. In the twelfth O site, O(12) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one C(32) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one C(33) atom. In the fourteenth O site, O(14) is bonded in a distorted bent 150 degrees geometry to one Nd(2) and one C(34) atom. In the fifteenth O site, O(15) is bonded in a distorted single-bond geometry to one Nd(1) and one C(37) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to one Nd(2) and one C(38) atom. Linkers: 4 [O]C(=O)c1ccc(/C=N/c2cc(C([O])=O)cc(C([O])=O)c2)cc1. Metal clusters: 4 [Nd]. The MOF has largest included sphere 4.37 A, density 1.45 g/cm3, surface area 4309.38 m2/g, accessible volume 0.22 cm3/g