Zn6C83H39(N2O15)2(CH)4 crystallizes in the monoclinic C2/c space group. The structure consists of sixteen 02329_fluka molecules inside a Zn6C83H39(N2O15)2 framework. In the Zn6C83H39(N2O15)2 framework, there are three inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a square pyramidal geometry to one O(1), one O(10), one O(15), one O(2), and one O(9) atom. The Zn(1)-O(1) bond length is 2.02 Å. The Zn(1)-O(10) bond length is 2.09 Å. The Zn(1)-O(15) bond length is 1.99 Å. The Zn(1)-O(2) bond length is 2.04 Å. The Zn(1)-O(9) bond length is 2.03 Å. In the second Zn site, Zn(2) is bonded to one O(13), one O(14), one O(3), one O(4), one O(5), and one O(7) atom to form distorted corner-sharing ZnO6 octahedra. The Zn(2)-O(13) bond length is 2.05 Å. The Zn(2)-O(14) bond length is 2.04 Å. The Zn(2)-O(3) bond length is 2.34 Å. The Zn(2)-O(4) bond length is 2.06 Å. The Zn(2)-O(5) bond length is 2.16 Å. The Zn(2)-O(7) bond length is 1.97 Å. In the third Zn site, Zn(3) is bonded to one O(11), one O(3), one O(6), and one O(8) atom to form distorted corner-sharing ZnO4 tetrahedra. The corner-sharing octahedral tilt angles are 83°. The Zn(3)-O(11) bond length is 1.97 Å. The Zn(3)-O(3) bond length is 1.99 Å. The Zn(3)-O(6) bond length is 1.98 Å. The Zn(3)-O(8) bond length is 1.97 Å. There are forty-two inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to one C(2), one C(6), and one N(1) atom. The C(1)-C(2) bond length is 1.40 Å. The C(1)-C(6) bond length is 1.40 Å. The C(1)-N(1) bond length is 1.38 Å. In the second C site, C(2) is bonded in a distorted single-bond geometry to one C(1) and one H(1) atom. The C(2)-H(1) bond length is 0.93 Å. In the third C site, C(3) is bonded in a distorted single-bond geometry to one C(4) and one H(2) atom. The C(3)-C(4) bond length is 1.42 Å. The C(3)-H(2) bond length is 0.93 Å. In the fourth C site, C(4) is bonded in a trigonal planar geometry to one C(19), one C(3), and one C(5) atom. The C(4)-C(19) bond length is 1.51 Å. The C(4)-C(5) bond length is 1.35 Å. In the fifth C site, C(5) is bonded in a distorted single-bond geometry to one C(4), one C(6), and one H(3) atom. The C(5)-C(6) bond length is 1.41 Å. The C(5)-H(3) bond length is 0.93 Å. In the sixth C site, C(6) is bonded in a trigonal planar geometry to one C(1), one C(5), and one C(7) atom. The C(6)-C(7) bond length is 1.42 Å. In the seventh C site, C(7) is bonded in a trigonal planar geometry to one C(12), one C(6), and one C(8) atom. The C(7)-C(12) bond length is 1.42 Å. The C(7)-C(8) bond length is 1.40 Å. In the eighth C site, C(8) is bonded in a single-bond geometry to one C(7), one C(9), and one H(4) atom. The C(8)-C(9) bond length is 1.38 Å. The C(8)-H(4) bond length is 0.93 Å. In the ninth C site, C(9) is bonded in a trigonal planar geometry to one C(10), one C(20), and one C(8) atom. The C(9)-C(10) bond length is 1.40 Å. The C(9)-C(20) bond length is 1.49 Å. In the tenth C site, C(10) is bonded in a distorted single-bond geometry to one C(9) and one H(5) atom. The C(10)-H(5) bond length is 0.93 Å. In the eleventh C site, C(12) is bonded in a distorted single-bond geometry to one C(7) and one N(1) atom. The C(12)-N(1) bond length is 1.38 Å. In the twelfth C site, C(13) is bonded in a distorted trigonal planar geometry to one C(14), one C(18), and one N(1) atom. The C(13)-C(14) bond length is 1.38 Å. The C(13)-C(18) bond length is 1.36 Å. The C(13)-N(1) bond length is 1.43 Å. In the thirteenth C site, C(14) is bonded in a distorted single-bond geometry to one C(13) and one H(7) atom. The C(14)-H(7) bond length is 0.93 Å. In the fourteenth C site, C(15) is bonded in a distorted single-bond geometry to one C(16) and one H(8) atom. The C(15)-C(16) bond length is 1.39 Å. The C(15)-H(8) bond length is 0.93 Å. In the fifteenth C site, C(16) is bonded in a trigonal planar geometry to one C(15), one C(17), and one C(21) atom. The C(16)-C(17) bond length is 1.37 Å. The C(16)-C(21) bond length is 1.50 Å. In the sixteenth C site, C(17) is bonded in a distorted single-bond geometry to one C(16) and one H(9) atom. The C(17)-H(9) bond length is 0.93 Å. In the seventeenth C site, C(18) is bonded in a distorted single-bond geometry to one C(13) and one H(10) atom. The C(18)-H(10) bond length is 0.93 Å. In the eighteenth C site, C(19) is bonded in a distorted bent 120 degrees geometry to one C(4), one O(1), and one O(2) atom. The C(19)-O(1) bond length is 1.26 Å. The C(19)-O(2) bond length is 1.25 Å. In the nineteenth C site, C(20) is bonded in a bent 120 degrees geometry to one C(9), one O(3), and one O(4) atom. The C(20)-O(3) bond length is 1.29 Å. The C(20)-O(4) bond length is 1.25 Å. In the twentieth C site, C(21) is bonded in a distorted bent 120 degrees geometry to one C(16), one O(5), and one O(6) atom. The C(21)-O(5) bond length is 1.22 Å. The C(21)-O(6) bond length is 1.24 Å. In the twenty-first C site, C(22) is bonded in a distorted single-bond geometry to one C(27) and one N(2) atom. The C(22)-C(27) bond length is 1.41 Å. The C(22)-N(2) bond length is 1.38 Å. In the twenty-second C site, C(24) is bonded in a distorted single-bond geometry to one C(25) and one H(12) atom. The C(24)-C(25) bond length is 1.42 Å. The C(24)-H(12) bond length is 0.93 Å. In the twenty-third C site, C(25) is bonded in a trigonal planar geometry to one C(24), one C(26), and one C(40) atom. The C(25)-C(26) bond length is 1.37 Å. The C(25)-C(40) bond length is 1.49 Å. In the twenty-fourth C site, C(26) is bonded in a single-bond geometry to one C(25), one C(27), and one H(13) atom. The C(26)-C(27) bond length is 1.39 Å. The C(26)-H(13) bond length is 0.93 Å. In the twenty-fifth C site, C(27) is bonded in a trigonal planar geometry to one C(22), one C(26), and one C(28) atom. The C(27)-C(28) bond length is 1.46 Å. In the twenty-sixth C site, C(28) is bonded in a trigonal planar geometry to one C(27), one C(29), and one C(33) atom. The C(28)-C(29) bond length is 1.40 Å. The C(28)-C(33) bond length is 1.39 Å. In the twenty-seventh C site, C(29) is bonded in a distorted trigonal planar geometry to one C(28), one C(30), and one N(2) atom. The C(29)-C(30) bond length is 1.39 Å. The C(29)-N(2) bond length is 1.40 Å. In the twenty-eighth C site, C(30) is bonded in a distorted single-bond geometry to one C(29) and one H(14) atom. The C(30)-H(14) bond length is 0.93 Å. In the twenty-ninth C site, C(31) is bonded in a distorted single-bond geometry to one C(32) and one H(15) atom. The C(31)-C(32) bond length is 1.41 Å. The C(31)-H(15) bond length is 0.93 Å. In the thirtieth C site, C(32) is bonded in a trigonal planar geometry to one C(31), one C(33), and one C(41) atom. The C(32)-C(33) bond length is 1.41 Å. The C(32)-C(41) bond length is 1.48 Å. In the thirty-first C site, C(33) is bonded in a distorted single-bond geometry to one C(28), one C(32), and one H(16) atom. The C(33)-H(16) bond length is 0.93 Å. In the thirty-second C site, C(34) is bonded in a distorted trigonal planar geometry to one C(35), one C(39), and one N(2) atom. The C(34)-C(35) bond length is 1.37 Å. The C(34)-C(39) bond length is 1.40 Å. The C(34)-N(2) bond length is 1.43 Å. In the thirty-third C site, C(35) is bonded in a distorted single-bond geometry to one C(34) and one H(17) atom. The C(35)-H(17) bond length is 0.93 Å. In the thirty-fourth C site, C(36) is bonded in a distorted single-bond geometry to one C(37) and one H(18) atom. The C(36)-C(37) bond length is 1.32 Å. The C(36)-H(18) bond length is 0.93 Å. In the thirty-fifth C site, C(37) is bonded in a trigonal planar geometry to one C(36), one C(38), and one C(42) atom. The C(37)-C(38) bond length is 1.43 Å. The C(37)-C(42) bond length is 1.50 Å. In the thirty-sixth C site, C(38) is bonded in a distorted single-bond geometry to one C(37) and one H(19) atom. The C(38)-H(19) bond length is 0.93 Å. In the thirty-seventh C site, C(39) is bonded in a distorted single-bond geometry to one C(34) and one H(20) atom. The C(39)-H(20) bond length is 0.93 Å. In the thirty-eighth C site, C(40) is bonded in a distorted bent 120 degrees geometry to one C(25), one O(7), and one O(8) atom. The C(40)-O(7) bond length is 1.24 Å. The C(40)-O(8) bond length is 1.28 Å. In the thirty-ninth C site, C(41) is bonded in a distorted bent 120 degrees geometry to one C(32), one O(10), and one O(9) atom. The C(41)-O(10) bond length is 1.26 Å. The C(41)-O(9) bond length is 1.26 Å. In the fortieth C site, C(42) is bonded in a distorted bent 120 degrees geometry to one C(37), one O(11), and one O(12) atom. The C(42)-O(11) bond length is 1.22 Å. The C(42)-O(12) bond length is 1.22 Å. In the forty-first C site, C(43) is bonded in a trigonal planar geometry to one H(21), one O(14), and one O(15) atom. The C(43)-H(21) bond length is 0.93 Å. The C(43)-O(14) bond length is 1.28 Å. The C(43)-O(15) bond length is 1.22 Å. In the forty-second C site, C(44) is bonded in a trigonal planar geometry to one H(22) and two equivalent O(13) atoms. The C(44)-H(22) bond length is 0.93 Å. Both C(44)-O(13) bond lengths are 1.22 Å. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one C(1), one C(12), and one C(13) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one C(22), one C(29), and one C(34) atom. There are twenty inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(2) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(3) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(5) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(8) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one C(10) atom. In the sixth H site, H(7) is bonded in a single-bond geometry to one C(14) atom. In the seventh H site, H(8) is bonded in a single-bond geometry to one C(15) atom. In the eighth H site, H(9) is bonded in a single-bond geometry to one C(17) atom. In the ninth H site, H(10) is bonded in a single-bond geometry to one C(18) atom. In the tenth H site, H(12) is bonded in a single-bond geometry to one C(24) atom. In the eleventh H site, H(13) is bonded in a single-bond geometry to one C(26) atom. In the twelfth H site, H(14) is bonded in a single-bond geometry to one C(30) atom. In the thirteenth H site, H(15) is bonded in a single-bond geometry to one C(31) atom. In the fourteenth H site, H(16) is bonded in a single-bond geometry to one C(33) atom. In the fifteenth H site, H(17) is bonded in a single-bond geometry to one C(35) atom. In the sixteenth H site, H(18) is bonded in a single-bond geometry to one C(36) atom. In the seventeenth H site, H(19) is bonded in a single-bond geometry to one C(38) atom. In the eighteenth H site, H(20) is bonded in a single-bond geometry to one C(39) atom. In the nineteenth H site, H(21) is bonded in a single-bond geometry to one C(43) atom. In the twentieth H site, H(22) is bonded in a single-bond geometry to one C(44) atom. There are fifteen 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(19) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Zn(1) and one C(19) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Zn(2), one Zn(3), and one C(20) atom. In the fourth O site, O(4) is bonded in a water-like geometry to one Zn(2) and one C(20) atom. In the fifth O site, O(5) is bonded in a distorted bent 150 degrees geometry to one Zn(2) and one C(21) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Zn(3) and one C(21) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one Zn(2) and one C(40) atom. In the eighth O site, O(8) is bonded in a bent 120 degrees geometry to one Zn(3) and one C(40) atom. In the ninth O site, O(9) is bonded in a bent 120 degrees geometry to one Zn(1) and one C(41) atom. In the tenth O site, O(10) is bonded in a distorted bent 120 degrees geometry to one Zn(1) and one C(41) atom. In the eleventh O site, O(11) is bonded in a water-like geometry to one Zn(3) and one C(42) atom. In the twelfth O site, O(12) is bonded in a single-bond geometry to one C(42) atom. In the thirteenth O site, O(13) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(44) atom. In the fourteenth O site, O(14) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(43) atom. In the fifteenth O site, O(15) is bonded in a bent 120 degrees geometry to one Zn(1) and one C(43) atom. Linkers: 16 [O]C(=O)c1ccc(-n2c3ccc(C([O])=O)cc3c3cc(C([O])=O)ccc32)cc1. Metal clusters: 24 [Zn]. The MOF has largest included sphere 5.61 A, density 1.31 g/cm3, surface area 4027.93 m2/g, accessible volume 0.34 cm3/g