ZnC8N5H8O2CHCH2(CH3)2 crystallizes in the monoclinic P2_1 space group. The structure consists of six 02329_fluka molecules, six 02329_fluka molecules, and twelve 02329_fluka molecules inside a ZnC8N5H8O2 framework. In the ZnC8N5H8O2 framework, there are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a trigonal bipyramidal geometry to one N(1,3); one N(5,6); one N(7,9); one O(1,3); and one O(4,6) atom. The Zn(1)-N(1,3) bond length is 2.10 Å. The Zn(1)-N(5,6) bond length is 2.05 Å. The Zn(1)-N(7,9) bond length is 1.98 Å. The Zn(1)-O(1,3) bond length is 2.18 Å. The Zn(1)-O(4,6) bond length is 2.16 Å. In the second Zn site, Zn(2,3) is bonded in a trigonal bipyramidal geometry to one N(2), one N(4), one N(8), one O(2), and one O(5) atom. The Zn(2,3)-N(2) bond length is 2.10 Å. The Zn(2,3)-N(4) bond length is 2.05 Å. The Zn(2,3)-N(8) bond length is 1.99 Å. The Zn(2,3)-O(2) bond length is 2.18 Å. The Zn(2,3)-O(5) bond length is 2.16 Å. There are fourteen inequivalent C sites. In the first C site, C(19,21) is bonded in a distorted trigonal non-coplanar geometry to one C(28,29); one N(1,3); one H(31,32,33); and one H(34,35,36) atom. The C(19,21)-C(28,29) bond length is 1.50 Å. The C(19,21)-N(1,3) bond length is 1.49 Å. The C(19,21)-H(31,32,33) bond length is 1.10 Å. The C(19,21)-H(34,35,36) bond length is 1.10 Å. In the second C site, C(20) is bonded in a distorted trigonal non-coplanar geometry to one C(28,29); one N(2); one H(31,32,33); and one H(34,35,36) atom. The C(20)-C(28,29) bond length is 1.50 Å. The C(20)-N(2) bond length is 1.49 Å. The C(20)-H(31,32,33) bond length is 1.10 Å. The C(20)-H(34,35,36) bond length is 1.10 Å. In the third C site, C(22,23) is bonded in a distorted bent 120 degrees geometry to one N(4) and one H(37,38,39) atom. The C(22,23)-N(4) bond length is 1.35 Å. The C(22,23)-H(37,38,39) bond length is 1.09 Å. In the fourth C site, C(24) is bonded in a distorted bent 120 degrees geometry to one N(5,6) and one H(37,38,39) atom. The C(24)-N(5,6) bond length is 1.35 Å. The C(24)-H(37,38,39) bond length is 1.09 Å. In the fifth C site, C(25,27) is bonded in a distorted single-bond geometry to one C(28,29) and one H(40,41,42) atom. The C(25,27)-C(28,29) bond length is 1.40 Å. The C(25,27)-H(40,41,42) bond length is 1.09 Å. In the sixth C site, C(26) is bonded in a distorted single-bond geometry to one C(28,29) and one H(40,41,42) atom. The C(26)-C(28,29) bond length is 1.40 Å. The C(26)-H(40,41,42) bond length is 1.09 Å. In the seventh C site, C(28,29) is bonded in a trigonal planar geometry to one C(19,21); one C(25,27); and one C(31,33) atom. The C(28,29)-C(31,33) bond length is 1.40 Å. In the eighth C site, C(30) is bonded in a trigonal planar geometry to one C(19,21); one C(25,27); and one C(31,33) atom. The C(30)-C(19,21) bond length is 1.50 Å. The C(30)-C(25,27) bond length is 1.40 Å. The C(30)-C(31,33) bond length is 1.40 Å. In the ninth C site, C(31,33) is bonded in a distorted trigonal planar geometry to one C(28,29); one C(34,35); and one H(43,44) atom. The C(31,33)-C(34,35) bond length is 1.39 Å. The C(31,33)-H(43,44) bond length is 1.09 Å. In the tenth C site, C(32) is bonded in a distorted trigonal planar geometry to one C(28,29); one C(34,35); and one H(43,44) atom. The C(32)-C(28,29) bond length is 1.40 Å. The C(32)-C(34,35) bond length is 1.39 Å. The C(32)-H(43,44) bond length is 1.09 Å. In the eleventh C site, C(34,35) is bonded in a distorted bent 120 degrees geometry to one C(31,33); one N(4); and one H(46,47,48) atom. The C(34,35)-N(4) bond length is 1.35 Å. The C(34,35)-H(46,47,48) bond length is 1.09 Å. In the twelfth C site, C(36) is bonded in a distorted bent 120 degrees geometry to one C(31,33); one N(5,6); and one H(46,47,48) atom. The C(36)-C(31,33) bond length is 1.39 Å. The C(36)-N(5,6) bond length is 1.35 Å. The C(36)-H(46,47,48) bond length is 1.09 Å. In the thirteenth C site, C(1,2,3) is bonded in a distorted bent 120 degrees geometry to one O(1,3) and one O(4,6) atom. The C(1,2,3)-O(1,3) bond length is 1.28 Å. The C(1,2,3)-O(4,6) bond length is 1.26 Å. In the fourteenth C site, C(4,5,6) is bonded in a 2-coordinate geometry to one N(1,3) and one H(1,2,3) atom. The C(4,5,6)-N(1,3) bond length is 1.48 Å. The C(4,5,6)-H(1,2,3) bond length is 1.10 Å. There are eight inequivalent N sites. In the first N site, N(1,3) is bonded in a distorted tetrahedral geometry to one Zn(1); one C(19,21); one C(4,5,6); and one H(49,50,51) atom. The N(1,3)-H(49,50,51) bond length is 1.03 Å. In the second N site, N(2) is bonded in a distorted tetrahedral geometry to one Zn(2,3); one C(20); one C(4,5,6); and one H(49,50,51) atom. The N(2)-C(4,5,6) bond length is 1.48 Å. The N(2)-H(49,50,51) bond length is 1.03 Å. In the third N site, N(4) is bonded in a trigonal planar geometry to one Zn(2,3); one C(22,23); and one C(34,35) atom. In the fourth N site, N(5,6) is bonded in a trigonal planar geometry to one Zn(2,3); one C(22,23); and one C(34,35) atom. The N(5,6)-Zn(2,3) bond length is 2.05 Å. The N(5,6)-C(22,23) bond length is 1.35 Å. The N(5,6)-C(34,35) bond length is 1.35 Å. In the fifth N site, N(7,9) is bonded in a bent 120 degrees geometry to one Zn(1) and one N(10,11,12) atom. The N(7,9)-N(10,11,12) bond length is 1.21 Å. In the sixth N site, N(8) is bonded in a bent 120 degrees geometry to one Zn(2,3) and one N(10,11,12) atom. The N(8)-N(10,11,12) bond length is 1.21 Å. In the seventh N site, N(10,11,12) is bonded in a linear geometry to one N(13,14,15) and one N(7,9) atom. The N(10,11,12)-N(13,14,15) bond length is 1.17 Å. In the eighth N site, N(13,14,15) is bonded in a single-bond geometry to one N(10,11,12) atom. There are nine inequivalent H sites. In the first H site, H(1,2,3) is bonded in a single-bond geometry to one C(4,5,6) atom. In the second H site, H(31,32,33) is bonded in a single-bond geometry to one C(19,21) atom. In the third H site, H(34,35,36) is bonded in a single-bond geometry to one C(19,21) atom. In the fourth H site, H(37,38,39) is bonded in a single-bond geometry to one C(22,23) atom. In the fifth H site, H(40,41,42) is bonded in a single-bond geometry to one C(25,27) atom. In the sixth H site, H(43,44) is bonded in a single-bond geometry to one C(31,33) atom. In the seventh H site, H(45) is bonded in a single-bond geometry to one C(31,33) atom. The H(45)-C(31,33) bond length is 1.09 Å. In the eighth H site, H(46,47,48) is bonded in a single-bond geometry to one C(34,35) atom. In the ninth H site, H(49,50,51) is bonded in a single-bond geometry to one N(1,3) atom. There are four inequivalent O sites. In the first O site, O(1,3) is bonded in a distorted bent 120 degrees geometry to one Zn(1) and one C(1,2,3) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one Zn(2,3) and one C(1,2,3) atom. The O(2)-C(1,2,3) bond length is 1.28 Å. In the third O site, O(4,6) is bonded in a 2-coordinate geometry to one Zn(1) and one C(1,2,3) atom. In the fourth O site, O(5) is bonded in a 2-coordinate geometry to one Zn(2,3) and one C(1,2,3) atom. The O(5)-C(1,2,3) bond length is 1.26 Å. Linkers: 6 CC[C@H](C)[C@H](NCc1ccncc1)C([O])=O. Metal clusters: 6 [Zn]. The MOF has largest included sphere 8.54 A, density 1.18 g/cm3, surface area 4780.23 m2/g, accessible volume 0.38 cm3/g