CdC16N3H11O4CH3 crystallizes in the orthorhombic P2_12_12_1 space group. The structure consists of eight 02329_fluka molecules inside a CdC16N3H11O4 framework. In the CdC16N3H11O4 framework, there are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a trigonal bipyramidal geometry to one N(6), one O(2), one O(4), one O(5), and one O(8) atom. The Cd(1)-N(6) bond length is 2.19 Å. The Cd(1)-O(2) bond length is 2.22 Å. The Cd(1)-O(4) bond length is 2.24 Å. The Cd(1)-O(5) bond length is 2.23 Å. The Cd(1)-O(8) bond length is 2.28 Å. In the second Cd site, Cd(2) is bonded in a distorted trigonal bipyramidal geometry to one N(3), one O(1), one O(3), one O(6), and one O(7) atom. The Cd(2)-N(3) bond length is 2.21 Å. The Cd(2)-O(1) bond length is 2.23 Å. The Cd(2)-O(3) bond length is 2.24 Å. The Cd(2)-O(6) bond length is 2.25 Å. The Cd(2)-O(7) bond length is 2.26 Å. There are thirty-two inequivalent C sites. In the first C site, C(9) is bonded in a distorted trigonal planar geometry to one C(10), one C(8), and one N(2) atom. The C(9)-C(10) bond length is 1.40 Å. The C(9)-C(8) bond length is 1.41 Å. The C(9)-N(2) bond length is 1.42 Å. In the second C site, C(10) is bonded in a distorted single-bond geometry to one C(2), one C(9), and one H(2) atom. The C(10)-C(2) bond length is 1.39 Å. The C(10)-H(2) bond length is 0.93 Å. In the third C site, C(11) is bonded in a 3-coordinate geometry to one C(14), one N(1), one H(3), and one H(4) atom. The C(11)-C(14) bond length is 1.53 Å. The C(11)-N(1) bond length is 1.47 Å. The C(11)-H(3) bond length is 0.97 Å. The C(11)-H(4) bond length is 0.97 Å. In the fourth C site, C(12) is bonded in a distorted single-bond geometry to one C(2), one C(3), and one H(5) atom. The C(12)-C(2) bond length is 1.36 Å. The C(12)-C(3) bond length is 1.40 Å. The C(12)-H(5) bond length is 0.93 Å. In the fifth C site, C(13) is bonded in a distorted single-bond geometry to one C(5), one C(7), and one H(6) atom. The C(13)-C(5) bond length is 1.40 Å. The C(13)-C(7) bond length is 1.38 Å. The C(13)-H(6) bond length is 0.93 Å. In the sixth C site, C(14) is bonded in a trigonal planar geometry to one C(11), one C(15), and one C(16) atom. The C(14)-C(15) bond length is 1.36 Å. The C(14)-C(16) bond length is 1.40 Å. In the seventh C site, C(26) is bonded in a distorted single-bond geometry to one C(19) and one H(18) atom. The C(26)-C(19) bond length is 1.42 Å. The C(26)-H(18) bond length is 0.93 Å. In the eighth C site, C(28) is bonded in a distorted bent 120 degrees geometry to one C(2), one O(5), and one O(6) atom. The C(28)-C(2) bond length is 1.53 Å. The C(28)-O(5) bond length is 1.25 Å. The C(28)-O(6) bond length is 1.25 Å. In the ninth C site, C(29) is bonded in a distorted bent 120 degrees geometry to one C(3), one O(7), and one O(8) atom. The C(29)-C(3) bond length is 1.51 Å. The C(29)-O(7) bond length is 1.27 Å. The C(29)-O(8) bond length is 1.27 Å. In the tenth C site, C(30) is bonded in a distorted trigonal planar geometry to one C(32), one N(5), and one N(6) atom. The C(30)-C(32) bond length is 1.50 Å. The C(30)-N(5) bond length is 1.34 Å. The C(30)-N(6) bond length is 1.34 Å. In the eleventh C site, C(32) is bonded in a water-like geometry to one C(30), one H(25), and one H(26) atom. The C(32)-H(25) bond length is 0.97 Å. The C(32)-H(26) bond length is 0.97 Å. In the twelfth C site, C(33) is bonded in a distorted bent 120 degrees geometry to one C(34), one N(5), and one H(27) atom. The C(33)-C(34) bond length is 1.36 Å. The C(33)-N(5) bond length is 1.38 Å. The C(33)-H(27) bond length is 0.93 Å. In the thirteenth C site, C(15) is bonded in a single-bond geometry to one C(14) and one H(7) atom. The C(15)-H(7) bond length is 0.93 Å. In the fourteenth C site, C(16) is bonded in a distorted single-bond geometry to one C(14) and one H(8) atom. The C(16)-H(8) bond length is 0.93 Å. In the fifteenth C site, C(17) is bonded in a distorted single-bond geometry to one C(6), one C(7), and one H(9) atom. The C(17)-C(6) bond length is 1.41 Å. The C(17)-C(7) bond length is 1.38 Å. The C(17)-H(9) bond length is 0.93 Å. In the sixteenth C site, C(18) is bonded in a distorted trigonal planar geometry to one C(25), one N(1), and one N(3) atom. The C(18)-C(25) bond length is 1.51 Å. The C(18)-N(1) bond length is 1.35 Å. The C(18)-N(3) bond length is 1.33 Å. In the seventeenth C site, C(19) is bonded in a trigonal planar geometry to one C(23), one C(24), and one C(26) atom. The C(19)-C(23) bond length is 1.37 Å. The C(19)-C(24) bond length is 1.49 Å. In the eighteenth C site, C(34) is bonded in a distorted trigonal planar geometry to one C(33), one N(6), and one H(28) atom. The C(34)-N(6) bond length is 1.37 Å. The C(34)-H(28) bond length is 0.93 Å. In the nineteenth C site, C(20) is bonded in a distorted single-bond geometry to one C(5), one C(6), and one H(10) atom. The C(20)-C(5) bond length is 1.38 Å. The C(20)-C(6) bond length is 1.40 Å. The C(20)-H(10) bond length is 0.93 Å. In the twentieth C site, C(21) is bonded in a distorted bent 120 degrees geometry to one C(22), one N(1), and one H(11) atom. The C(21)-C(22) bond length is 1.34 Å. The C(21)-N(1) bond length is 1.40 Å. The C(21)-H(11) bond length is 0.94 Å. In the twenty-first C site, C(22) is bonded in a distorted trigonal planar geometry to one C(21), one N(3), and one H(12) atom. The C(22)-N(3) bond length is 1.37 Å. The C(22)-H(12) bond length is 0.93 Å. In the twenty-second C site, C(23) is bonded in a distorted single-bond geometry to one C(19) and one H(13) atom. The C(23)-H(13) bond length is 0.93 Å. In the twenty-third C site, C(24) is bonded in a 3-coordinate geometry to one C(19), one N(5), one H(14), and one H(15) atom. The C(24)-N(5) bond length is 1.47 Å. The C(24)-H(14) bond length is 0.97 Å. The C(24)-H(15) bond length is 0.97 Å. In the twenty-fourth C site, C(25) is bonded in a water-like geometry to one C(18), one H(16), and one H(17) atom. The C(25)-H(16) bond length is 0.97 Å. The C(25)-H(17) bond length is 0.97 Å. In the twenty-fifth C site, C(1) is bonded in a distorted bent 120 degrees geometry to one C(6), one O(1), and one O(2) atom. The C(1)-C(6) bond length is 1.49 Å. The C(1)-O(1) bond length is 1.26 Å. The C(1)-O(2) bond length is 1.26 Å. In the twenty-sixth C site, C(2) is bonded in a trigonal planar geometry to one C(10), one C(12), and one C(28) atom. In the twenty-seventh C site, C(3) is bonded in a trigonal planar geometry to one C(12), one C(29), and one C(8) atom. The C(3)-C(8) bond length is 1.36 Å. In the twenty-eighth C site, C(4) is bonded in a distorted bent 120 degrees geometry to one C(5), one O(3), and one O(4) atom. The C(4)-C(5) bond length is 1.49 Å. The C(4)-O(3) bond length is 1.24 Å. The C(4)-O(4) bond length is 1.27 Å. In the twenty-ninth C site, C(5) is bonded in a trigonal planar geometry to one C(13), one C(20), and one C(4) atom. In the thirtieth C site, C(6) is bonded in a trigonal planar geometry to one C(1), one C(17), and one C(20) atom. In the thirty-first C site, C(7) is bonded in a distorted trigonal planar geometry to one C(13), one C(17), and one N(4) atom. The C(7)-N(4) bond length is 1.45 Å. In the thirty-second C site, C(8) is bonded in a distorted single-bond geometry to one C(3), one C(9), and one H(1) atom. The C(8)-H(1) bond length is 0.93 Å. There are six inequivalent N sites. In the first N site, N(5) is bonded in a trigonal planar geometry to one C(24), one C(30), and one C(33) atom. In the second N site, N(6) is bonded in a trigonal planar geometry to one Cd(1), one C(30), and one C(34) atom. In the third N site, N(1) is bonded in a trigonal planar geometry to one C(11), one C(18), and one C(21) atom. In the fourth N site, N(2) is bonded in a distorted bent 120 degrees geometry to one C(9) and one N(4) atom. The N(2)-N(4) bond length is 1.24 Å. In the fifth N site, N(4) is bonded in a distorted bent 120 degrees geometry to one C(7) and one N(2) atom. In the sixth N site, N(3) is bonded in a trigonal planar geometry to one Cd(2), one C(18), and one C(22) atom. There are twenty-two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(8) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(10) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(11) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(11) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one C(12) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one C(13) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one C(15) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one C(16) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one C(17) atom. In the tenth H site, H(10) is bonded in a single-bond geometry to one C(20) atom. In the eleventh H site, H(11) is bonded in a single-bond geometry to one C(21) atom. In the twelfth H site, H(12) is bonded in a single-bond geometry to one C(22) atom. In the thirteenth H site, H(13) is bonded in a single-bond geometry to one C(23) atom. In the fourteenth H site, H(14) is bonded in a single-bond geometry to one C(24) atom. In the fifteenth H site, H(15) is bonded in a single-bond geometry to one C(24) atom. In the sixteenth H site, H(16) is bonded in a single-bond geometry to one C(25) atom. In the seventeenth H site, H(17) is bonded in a single-bond geometry to one C(25) atom. In the eighteenth H site, H(18) is bonded in a single-bond geometry to one C(26) atom. In the nineteenth H site, H(25) is bonded in a single-bond geometry to one C(32) atom. In the twentieth H site, H(26) is bonded in a single-bond geometry to one C(32) atom. In the twenty-first H site, H(27) is bonded in a single-bond geometry to one C(33) atom. In the twenty-second H site, H(28) is bonded in a single-bond geometry to one C(34) atom. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 150 degrees geometry to one Cd(2) and one C(1) atom. In the second O site, O(8) is bonded in a water-like geometry to one Cd(1) and one C(29) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Cd(2) and one C(4) atom. In the fourth O site, O(2) is bonded in a bent 120 degrees geometry to one Cd(1) and one C(1) atom. In the fifth O site, O(7) is bonded in a distorted bent 150 degrees geometry to one Cd(2) and one C(29) atom. In the sixth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Cd(1) and one C(4) atom. In the seventh O site, O(6) is bonded in a bent 120 degrees geometry to one Cd(2) and one C(28) atom. In the eighth O site, O(5) is bonded in a distorted bent 150 degrees geometry to one Cd(1) and one C(28) atom. Linkers: 4 CCc1nccn1Cc1ccc(Cn2ccnc2CC)cc1 ,4 [O]C(=O)c1cc([N][N]c2cc(C([O])=O)cc(C([O])=O)c2)cc(C([O])=O)c1. Metal clusters: 4 [C]1O[Cd]234O[C]O[Cd]2(O1)(O[C]O3)O[C]O4. RCSR code: lvt. The MOF has largest included sphere 5.15 A, density 1.48 g/cm3, surface area 4176.25 m2/g, accessible volume 0.26 cm3/g