CdC27N5H22O9CH crystallizes in the triclinic P-1 space group. The structure consists of two 02329_fluka molecules inside a CdC27N5H22O9 framework. In the CdC27N5H22O9 framework, Cd(1) is bonded in an octahedral geometry to one N(1), one N(4), one O(1), one O(2), one O(3), and one O(7) atom. The Cd(1)-N(1) bond length is 2.34 Å. The Cd(1)-N(4) bond length is 2.30 Å. The Cd(1)-O(1) bond length is 2.32 Å. The Cd(1)-O(2) bond length is 2.43 Å. The Cd(1)-O(3) bond length is 2.36 Å. The Cd(1)-O(7) bond length is 2.30 Å. There are twenty-seven inequivalent C sites. In the first C site, C(1) is bonded in a distorted trigonal planar geometry to one C(2), one N(1), and one H(3) atom. The C(1)-C(2) bond length is 1.40 Å. The C(1)-N(1) bond length is 1.35 Å. The C(1)-H(3) bond length is 1.09 Å. In the second C site, C(2) is bonded in a distorted single-bond geometry to one C(1), one C(3), and one H(5) atom. The C(2)-C(3) bond length is 1.40 Å. The C(2)-H(5) bond length is 1.09 Å. In the third C site, C(3) is bonded in a trigonal planar geometry to one C(2), one C(5), and one C(6) atom. The C(3)-C(5) bond length is 1.40 Å. The C(3)-C(6) bond length is 1.52 Å. In the fourth C site, C(4) is bonded in a distorted trigonal planar geometry to one C(5), one N(1), and one H(7) atom. The C(4)-C(5) bond length is 1.39 Å. The C(4)-N(1) bond length is 1.35 Å. The C(4)-H(7) bond length is 1.09 Å. In the fifth C site, C(5) is bonded in a distorted trigonal planar geometry to one C(3), one C(4), and one H(8) atom. The C(5)-H(8) bond length is 1.09 Å. In the sixth C site, C(6) is bonded in a distorted trigonal non-coplanar geometry to one C(3), one N(2), one H(10), and one H(9) atom. The C(6)-N(2) bond length is 1.46 Å. The C(6)-H(10) bond length is 1.10 Å. The C(6)-H(9) bond length is 1.10 Å. In the seventh C site, C(7) is bonded in a distorted bent 120 degrees geometry to one C(8), one N(2), and one O(8) atom. The C(7)-C(8) bond length is 1.49 Å. The C(7)-N(2) bond length is 1.35 Å. The C(7)-O(8) bond length is 1.25 Å. In the eighth C site, C(8) is bonded in a trigonal planar geometry to one C(12), one C(7), and one C(9) atom. The C(8)-C(12) bond length is 1.40 Å. The C(8)-C(9) bond length is 1.40 Å. In the ninth C site, C(9) is bonded in a distorted single-bond geometry to one C(8) and one H(11) atom. The C(9)-H(11) bond length is 1.09 Å. In the tenth C site, C(10) is bonded in a distorted single-bond geometry to one C(11) and one H(12) atom. The C(10)-C(11) bond length is 1.40 Å. The C(10)-H(12) bond length is 1.09 Å. In the eleventh C site, C(11) is bonded in a trigonal planar geometry to one C(10), one C(13), and one C(14) atom. The C(11)-C(13) bond length is 1.40 Å. The C(11)-C(14) bond length is 1.50 Å. In the twelfth C site, C(12) is bonded in a distorted trigonal planar geometry to one C(13), one C(8), and one H(13) atom. The C(12)-C(13) bond length is 1.39 Å. The C(12)-H(13) bond length is 1.09 Å. In the thirteenth C site, C(13) is bonded in a distorted single-bond geometry to one C(11), one C(12), and one H(14) atom. The C(13)-H(14) bond length is 1.09 Å. In the fourteenth C site, C(14) is bonded in a distorted bent 120 degrees geometry to one C(11), one N(3), and one O(9) atom. The C(14)-N(3) bond length is 1.36 Å. The C(14)-O(9) bond length is 1.25 Å. In the fifteenth C site, C(15) is bonded in a distorted trigonal non-coplanar geometry to one C(18), one N(3), one H(15), and one H(16) atom. The C(15)-C(18) bond length is 1.51 Å. The C(15)-N(3) bond length is 1.44 Å. The C(15)-H(15) bond length is 1.10 Å. The C(15)-H(16) bond length is 1.10 Å. In the sixteenth C site, C(16) is bonded in a distorted trigonal planar geometry to one C(17), one N(4), and one H(17) atom. The C(16)-C(17) bond length is 1.39 Å. The C(16)-N(4) bond length is 1.35 Å. The C(16)-H(17) bond length is 1.09 Å. In the seventeenth C site, C(17) is bonded in a distorted single-bond geometry to one C(16), one C(18), and one H(18) atom. The C(17)-C(18) bond length is 1.40 Å. The C(17)-H(18) bond length is 1.09 Å. In the eighteenth C site, C(18) is bonded in a trigonal planar geometry to one C(15), one C(17), and one C(19) atom. The C(18)-C(19) bond length is 1.40 Å. In the nineteenth C site, C(19) is bonded in a distorted single-bond geometry to one C(18) and one H(19) atom. The C(19)-H(19) bond length is 1.09 Å. In the twentieth C site, C(20) is bonded in a distorted bent 120 degrees geometry to one N(4) and one H(20) atom. The C(20)-N(4) bond length is 1.34 Å. The C(20)-H(20) bond length is 1.09 Å. In the twenty-first C site, C(21) is bonded in a distorted bent 120 degrees geometry to one C(22), one O(3), and one O(7) atom. The C(21)-C(22) bond length is 1.51 Å. The C(21)-O(3) bond length is 1.27 Å. The C(21)-O(7) bond length is 1.27 Å. In the twenty-second C site, C(22) is bonded in a trigonal planar geometry to one C(21), one C(23), and one C(25) atom. The C(22)-C(23) bond length is 1.41 Å. The C(22)-C(25) bond length is 1.40 Å. In the twenty-third C site, C(23) is bonded in a trigonal planar geometry to one C(22), one C(24), and one C(28) atom. The C(23)-C(24) bond length is 1.52 Å. The C(23)-C(28) bond length is 1.41 Å. In the twenty-fourth C site, C(24) is bonded in a distorted bent 120 degrees geometry to one C(23), one O(2), and one O(4) atom. The C(24)-O(2) bond length is 1.28 Å. The C(24)-O(4) bond length is 1.25 Å. In the twenty-fifth C site, C(25) is bonded in a distorted single-bond geometry to one C(22) and one H(21) atom. The C(25)-H(21) bond length is 1.09 Å. In the twenty-sixth C site, C(27) is bonded in a distorted single-bond geometry to one C(28) and one H(23) atom. The C(27)-C(28) bond length is 1.40 Å. The C(27)-H(23) bond length is 1.09 Å. In the twenty-seventh C site, C(28) is bonded in a distorted trigonal planar geometry to one C(23), one C(27), and one N(5) atom. The C(28)-N(5) bond length is 1.46 Å. There are five inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Cd(1), one C(1), and one C(4) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one C(6), one C(7), and one H(4) atom. The N(2)-H(4) bond length is 1.01 Å. In the third N site, N(3) is bonded in a trigonal planar geometry to one C(14), one C(15), and one H(6) atom. The N(3)-H(6) bond length is 1.03 Å. In the fourth N site, N(4) is bonded in a trigonal planar geometry to one Cd(1), one C(16), and one C(20) atom. In the fifth N site, N(5) is bonded in a trigonal planar geometry to one C(28), one O(5), and one O(6) atom. The N(5)-O(5) bond length is 1.25 Å. The N(5)-O(6) bond length is 1.25 Å. There are twenty-two inequivalent H sites. In the first H site, H(1) is bonded in a distorted linear geometry to one O(1) and one O(2) atom. The H(1)-O(1) bond length is 1.01 Å. The H(1)-O(2) bond length is 1.64 Å. In the second H site, H(2) is bonded in a single-bond geometry to one O(1) and one O(8) atom. The H(2)-O(1) bond length is 0.99 Å. The H(2)-O(8) bond length is 1.69 Å. In the third H site, H(3) is bonded in a single-bond geometry to one C(1) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one N(2) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one C(2) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one N(3) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one C(4) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one C(5) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one C(6) atom. In the tenth H site, H(10) is bonded in a single-bond geometry to one C(6) atom. In the eleventh H site, H(11) is bonded in a single-bond geometry to one C(9) atom. In the twelfth H site, H(12) is bonded in a single-bond geometry to one C(10) atom. In the thirteenth H site, H(13) is bonded in a single-bond geometry to one C(12) atom. In the fourteenth H site, H(14) is bonded in a single-bond geometry to one C(13) atom. In the fifteenth H site, H(15) is bonded in a single-bond geometry to one C(15) atom. In the sixteenth H site, H(16) is bonded in a single-bond geometry to one C(15) atom. In the seventeenth H site, H(17) is bonded in a single-bond geometry to one C(16) atom. In the eighteenth H site, H(18) is bonded in a single-bond geometry to one C(17) atom. In the nineteenth H site, H(19) is bonded in a single-bond geometry to one C(19) atom. In the twentieth H site, H(20) is bonded in a single-bond geometry to one C(20) atom. In the twenty-first H site, H(21) is bonded in a single-bond geometry to one C(25) atom. In the twenty-second H site, H(23) is bonded in a single-bond geometry to one C(27) atom. There are nine inequivalent O sites. In the first O site, O(8) is bonded in a distorted single-bond geometry to one C(7) and one H(2) atom. In the second O site, O(9) is bonded in a single-bond geometry to one C(14) atom. In the third O site, O(1) is bonded in a distorted water-like geometry to one Cd(1), one H(1), and one H(2) atom. In the fourth O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to one Cd(1), one C(24), and one H(1) atom. In the fifth O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Cd(1) and one C(21) atom. In the sixth O site, O(4) is bonded in a single-bond geometry to one C(24) atom. In the seventh O site, O(5) is bonded in a single-bond geometry to one N(5) atom. In the eighth O site, O(6) is bonded in a single-bond geometry to one N(5) atom. In the ninth O site, O(7) is bonded in a distorted bent 120 degrees geometry to one Cd(1) and one C(21) atom. Linkers: 2 O=C(NCc1ccncc1)c1ccc(C(=O)NCc2ccncc2)cc1 ,2 [O]C(=O)c1cccc([N+](=O)[O-])c1C([O])=O. Metal clusters: 1 O.O.O=[C]O[Cd]1O[C]O[Cd](O[C]=O)O[C]O1. The MOF has largest included sphere 2.70 A, density 1.67 g/cm3, surface area 4339.26 m2/g, accessible volume 0.14 cm3/g