ZnC36N3H37O5(CH2)2(CF3)2 crystallizes in the monoclinic C2 space group. The structure consists of eight 02329_fluka molecules and eight trifluoromethane molecules inside a ZnC36N3H37O5 framework. In the ZnC36N3H37O5 framework, there are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in an octahedral geometry to two equivalent N(1), two equivalent O(1), and two equivalent O(2) atoms. Both Zn(1)-N(1) bond lengths are 2.14 Å. Both Zn(1)-O(1) bond lengths are 2.12 Å. Both Zn(1)-O(2) bond lengths are 2.08 Å. In the second Zn site, Zn(2) is bonded in an octahedral geometry to two equivalent N(2), two equivalent O(3), and two equivalent O(4) atoms. Both Zn(2)-N(2) bond lengths are 2.17 Å. Both Zn(2)-O(3) bond lengths are 2.08 Å. Both Zn(2)-O(4) bond lengths are 2.12 Å. There are thirty-six inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to one C(2) and one O(1) atom. The C(1)-C(2) bond length is 1.39 Å. The C(1)-O(1) bond length is 1.28 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(8) atom. The C(2)-C(3) bond length is 1.43 Å. The C(2)-C(8) bond length is 1.52 Å. In the third C site, C(3) is bonded in a distorted single-bond geometry to one C(2), one C(5), and one O(2) atom. The C(3)-C(5) bond length is 1.52 Å. The C(3)-O(2) bond length is 1.27 Å. In the fourth C site, C(5) is bonded in a tetrahedral geometry to one C(12), one C(3), one C(6), and one C(9) atom. The C(5)-C(12) bond length is 1.51 Å. The C(5)-C(6) bond length is 1.57 Å. The C(5)-C(9) bond length is 1.57 Å. In the fifth C site, C(6) is bonded in a distorted water-like geometry to one C(5), one H(2), and one H(3) atom. The C(6)-H(2) bond length is 1.10 Å. The C(6)-H(3) bond length is 1.10 Å. In the sixth C site, C(8) is bonded in a distorted single-bond geometry to one C(2), one C(9), and one H(6) atom. The C(8)-C(9) bond length is 1.57 Å. The C(8)-H(6) bond length is 1.10 Å. In the seventh C site, C(9) is bonded in a tetrahedral geometry to one C(10), one C(11), one C(5), and one C(8) atom. The C(9)-C(10) bond length is 1.53 Å. The C(9)-C(11) bond length is 1.53 Å. In the eighth C site, C(10) is bonded in a distorted trigonal non-coplanar geometry to one C(9), one H(7), one H(8), and one H(9) atom. The C(10)-H(7) bond length is 1.10 Å. The C(10)-H(8) bond length is 1.10 Å. The C(10)-H(9) bond length is 1.10 Å. In the ninth C site, C(11) is bonded in a distorted trigonal non-coplanar geometry to one C(9), one H(10), one H(11), and one H(12) atom. The C(11)-H(10) bond length is 1.10 Å. The C(11)-H(11) bond length is 1.10 Å. The C(11)-H(12) bond length is 1.09 Å. In the tenth C site, C(12) is bonded in a distorted trigonal non-coplanar geometry to one C(5), one H(13), one H(14), and one H(15) atom. The C(12)-H(13) bond length is 1.10 Å. The C(12)-H(14) bond length is 1.10 Å. The C(12)-H(15) bond length is 1.10 Å. In the eleventh C site, C(13) is bonded in a distorted single-bond geometry to one C(14) and one O(3) atom. The C(13)-C(14) bond length is 1.39 Å. The C(13)-O(3) bond length is 1.28 Å. In the twelfth C site, C(14) is bonded in a trigonal planar geometry to one C(13), one C(15), and one C(20) atom. The C(14)-C(15) bond length is 1.45 Å. The C(14)-C(20) bond length is 1.52 Å. In the thirteenth C site, C(15) is bonded in a distorted single-bond geometry to one C(14), one C(17), and one O(4) atom. The C(15)-C(17) bond length is 1.53 Å. The C(15)-O(4) bond length is 1.26 Å. In the fourteenth C site, C(17) is bonded in a tetrahedral geometry to one C(15), one C(18), one C(21), and one C(24) atom. The C(17)-C(18) bond length is 1.56 Å. The C(17)-C(21) bond length is 1.57 Å. The C(17)-C(24) bond length is 1.51 Å. In the fifteenth C site, C(18) is bonded in a distorted water-like geometry to one C(17), one H(16), and one H(17) atom. The C(18)-H(16) bond length is 1.10 Å. The C(18)-H(17) bond length is 1.10 Å. In the sixteenth C site, C(20) is bonded in a distorted single-bond geometry to one C(14), one C(21), and one H(20) atom. The C(20)-C(21) bond length is 1.56 Å. The C(20)-H(20) bond length is 1.09 Å. In the seventeenth C site, C(21) is bonded in a tetrahedral geometry to one C(17), one C(20), one C(22), and one C(23) atom. The C(21)-C(22) bond length is 1.53 Å. The C(21)-C(23) bond length is 1.53 Å. In the eighteenth C site, C(22) is bonded in a distorted trigonal non-coplanar geometry to one C(21), one H(21), one H(22), and one H(23) atom. The C(22)-H(21) bond length is 1.10 Å. The C(22)-H(22) bond length is 1.10 Å. The C(22)-H(23) bond length is 1.10 Å. In the nineteenth C site, C(23) is bonded in a distorted trigonal non-coplanar geometry to one C(21), one H(24), one H(25), and one H(26) atom. The C(23)-H(24) bond length is 1.10 Å. The C(23)-H(25) bond length is 1.10 Å. The C(23)-H(26) bond length is 1.10 Å. In the twentieth C site, C(24) is bonded in a distorted trigonal non-coplanar geometry to one C(17), one H(27), one H(28), and one H(29) atom. The C(24)-H(27) bond length is 1.10 Å. The C(24)-H(28) bond length is 1.10 Å. The C(24)-H(29) bond length is 1.10 Å. In the twenty-first C site, C(25) is bonded in a distorted trigonal planar geometry to one C(26), one N(1), and one H(30) atom. The C(25)-C(26) bond length is 1.39 Å. The C(25)-N(1) bond length is 1.35 Å. The C(25)-H(30) bond length is 1.09 Å. In the twenty-second C site, C(26) is bonded in a distorted single-bond geometry to one C(25), one C(27), and one H(31) atom. The C(26)-C(27) bond length is 1.40 Å. The C(26)-H(31) bond length is 1.09 Å. In the twenty-third C site, C(27) is bonded in a trigonal planar geometry to one C(26), one C(28), and one C(30) atom. The C(27)-C(28) bond length is 1.40 Å. The C(27)-C(30) bond length is 1.53 Å. In the twenty-fourth C site, C(28) is bonded in a distorted single-bond geometry to one C(27), one C(29), and one H(32) atom. The C(28)-C(29) bond length is 1.39 Å. The C(28)-H(32) bond length is 1.09 Å. In the twenty-fifth C site, C(29) is bonded in a distorted trigonal planar geometry to one C(28), one N(1), and one H(33) atom. The C(29)-N(1) bond length is 1.34 Å. The C(29)-H(33) bond length is 1.09 Å. In the twenty-sixth C site, C(30) is bonded in a distorted single-bond geometry to one C(27), one C(31), one C(36), and one O(5) atom. The C(30)-C(31) bond length is 1.53 Å. The C(30)-C(36) bond length is 1.54 Å. The C(30)-O(5) bond length is 1.42 Å. In the twenty-seventh C site, C(31) is bonded in a trigonal planar geometry to one C(30), one C(32), and one C(35) atom. The C(31)-C(32) bond length is 1.40 Å. The C(31)-C(35) bond length is 1.40 Å. In the twenty-eighth C site, C(32) is bonded in a distorted single-bond geometry to one C(31), one C(33), and one H(34) atom. The C(32)-C(33) bond length is 1.39 Å. The C(32)-H(34) bond length is 1.09 Å. In the twenty-ninth C site, C(33) is bonded in a distorted trigonal planar geometry to one C(32), one N(2), and one H(35) atom. The C(33)-N(2) bond length is 1.34 Å. The C(33)-H(35) bond length is 1.09 Å. In the thirtieth C site, C(34) is bonded in a distorted trigonal planar geometry to one C(35), one N(2), and one H(36) atom. The C(34)-C(35) bond length is 1.39 Å. The C(34)-N(2) bond length is 1.34 Å. The C(34)-H(36) bond length is 1.09 Å. In the thirty-first C site, C(35) is bonded in a distorted single-bond geometry to one C(31), one C(34), and one H(37) atom. The C(35)-H(37) bond length is 1.09 Å. In the thirty-second C site, C(36) is bonded in a trigonal planar geometry to one C(30), one C(37), and one C(40) atom. The C(36)-C(37) bond length is 1.40 Å. The C(36)-C(40) bond length is 1.40 Å. In the thirty-third C site, C(37) is bonded in a distorted single-bond geometry to one C(36), one C(38), and one H(38) atom. The C(37)-C(38) bond length is 1.39 Å. The C(37)-H(38) bond length is 1.09 Å. In the thirty-fourth C site, C(38) is bonded in a distorted trigonal planar geometry to one C(37), one N(3), and one H(39) atom. The C(38)-N(3) bond length is 1.34 Å. The C(38)-H(39) bond length is 1.09 Å. In the thirty-fifth C site, C(39) is bonded in a distorted trigonal planar geometry to one C(40), one N(3), and one H(40) atom. The C(39)-C(40) bond length is 1.40 Å. The C(39)-N(3) bond length is 1.34 Å. The C(39)-H(40) bond length is 1.09 Å. In the thirty-sixth C site, C(40) is bonded in a distorted single-bond geometry to one C(36), one C(39), and one H(41) atom. The C(40)-H(41) bond length is 1.09 Å. There are three inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Zn(1), one C(25), and one C(29) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one Zn(2), one C(33), and one C(34) atom. In the third N site, N(3) is bonded in a trigonal planar geometry to one C(38), one C(39), and one H(1) atom. The N(3)-H(1) bond length is 1.65 Å. There are thirty-seven inequivalent H sites. In the first H site, H(1) is bonded in a distorted single-bond geometry to one N(3) and one O(5) atom. The H(1)-O(5) bond length is 1.02 Å. In the second H site, H(2) is bonded in a single-bond geometry to one C(6) 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(6) is bonded in a single-bond geometry to one C(8) atom. In the fifth H site, H(7) is bonded in a single-bond geometry to one C(10) atom. In the sixth H site, H(8) is bonded in a single-bond geometry to one C(10) atom. In the seventh H site, H(9) is bonded in a single-bond geometry to one C(10) atom. In the eighth H site, H(10) is bonded in a single-bond geometry to one C(11) atom. In the ninth H site, H(11) is bonded in a single-bond geometry to one C(11) atom. In the tenth H site, H(12) is bonded in a single-bond geometry to one C(11) atom. In the eleventh H site, H(13) is bonded in a single-bond geometry to one C(12) atom. In the twelfth H site, H(14) is bonded in a single-bond geometry to one C(12) atom. In the thirteenth H site, H(15) is bonded in a single-bond geometry to one C(12) atom. In the fourteenth H site, H(16) is bonded in a single-bond geometry to one C(18) atom. In the fifteenth H site, H(17) is bonded in a single-bond geometry to one C(18) atom. In the sixteenth H site, H(20) is bonded in a single-bond geometry to one C(20) atom. In the seventeenth H site, H(21) is bonded in a single-bond geometry to one C(22) atom. In the eighteenth H site, H(22) is bonded in a single-bond geometry to one C(22) atom. In the nineteenth H site, H(23) is bonded in a single-bond geometry to one C(22) atom. In the twentieth H site, H(24) is bonded in a single-bond geometry to one C(23) atom. In the twenty-first H site, H(25) is bonded in a single-bond geometry to one C(23) atom. In the twenty-second H site, H(26) is bonded in a single-bond geometry to one C(23) atom. In the twenty-third H site, H(27) is bonded in a single-bond geometry to one C(24) atom. In the twenty-fourth H site, H(28) is bonded in a single-bond geometry to one C(24) atom. In the twenty-fifth H site, H(29) is bonded in a single-bond geometry to one C(24) atom. In the twenty-sixth H site, H(30) is bonded in a single-bond geometry to one C(25) atom. In the twenty-seventh H site, H(31) is bonded in a single-bond geometry to one C(26) atom. In the twenty-eighth H site, H(32) is bonded in a single-bond geometry to one C(28) atom. In the twenty-ninth H site, H(33) is bonded in a single-bond geometry to one C(29) atom. In the thirtieth H site, H(34) is bonded in a single-bond geometry to one C(32) atom. In the thirty-first H site, H(35) is bonded in a single-bond geometry to one C(33) atom. In the thirty-second H site, H(36) is bonded in a single-bond geometry to one C(34) atom. In the thirty-third H site, H(37) is bonded in a single-bond geometry to one C(35) atom. In the thirty-fourth H site, H(38) is bonded in a single-bond geometry to one C(37) atom. In the thirty-fifth H site, H(39) is bonded in a single-bond geometry to one C(38) atom. In the thirty-sixth H site, H(40) is bonded in a single-bond geometry to one C(39) atom. In the thirty-seventh H site, H(41) is bonded in a single-bond geometry to one C(40) atom. There are five inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Zn(1) and one C(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Zn(1) and one C(3) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(13) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(15) atom. In the fifth O site, O(5) is bonded in a water-like geometry to one C(30) and one H(1) atom. Linkers: 3 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C]2C(=O)C(F)(F)F ,1 OC(c1ccncc1)(c1ccncc1)c1ccncc1. Metal clusters: 2 [Zn]. The MOF has largest included sphere 4.61 A, density 1.23 g/cm3, surface area 5019.58 m2/g, accessible volume 0.29 cm3/g