Zn3B2C40N16H34O9 crystallizes in the monoclinic C2/c space group. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a trigonal bipyramidal geometry to two equivalent N(5), two equivalent N(8), and one O(5) atom. Both Zn(1)-N(5) bond lengths are 2.16 Å. Both Zn(1)-N(8) bond lengths are 2.03 Å. The Zn(1)-O(5) bond length is 2.29 Å. In the second Zn site, Zn(2) is bonded in a tetrahedral geometry to one N(1), one N(3), one O(2), and one O(4) atom. The Zn(2)-N(1) bond length is 1.99 Å. The Zn(2)-N(3) bond length is 2.03 Å. The Zn(2)-O(2) bond length is 1.95 Å. The Zn(2)-O(4) bond length is 1.95 Å. B(1) is bonded in a tetrahedral geometry to one N(2), one N(4), one N(6), and one N(7) atom. The B(1)-N(2) bond length is 1.54 Å. The B(1)-N(4) bond length is 1.55 Å. The B(1)-N(6) bond length is 1.55 Å. The B(1)-N(7) bond length is 1.55 Å. There are twenty inequivalent C sites. In the first C site, C(1) is bonded in a distorted bent 120 degrees geometry to one C(2), one N(2), and one H(1) atom. The C(1)-C(2) bond length is 1.37 Å. The C(1)-N(2) bond length is 1.39 Å. The C(1)-H(1) bond length is 1.09 Å. In the second C site, C(2) is bonded in a distorted bent 120 degrees geometry to one C(1), one N(1), and one H(2) atom. The C(2)-N(1) bond length is 1.38 Å. The C(2)-H(2) bond length is 1.08 Å. In the third C site, C(3) is bonded in a trigonal planar geometry to one N(1), one N(2), and one H(3) atom. The C(3)-N(1) bond length is 1.33 Å. The C(3)-N(2) bond length is 1.36 Å. The C(3)-H(3) bond length is 1.09 Å. In the fourth C site, C(4) is bonded in a distorted bent 120 degrees geometry to one C(5), one N(3), and one H(4) atom. The C(4)-C(5) bond length is 1.37 Å. The C(4)-N(3) bond length is 1.38 Å. The C(4)-H(4) bond length is 1.08 Å. In the fifth C site, C(5) is bonded in a distorted bent 120 degrees geometry to one C(4), one N(4), and one H(5) atom. The C(5)-N(4) bond length is 1.39 Å. The C(5)-H(5) bond length is 1.08 Å. In the sixth C site, C(6) is bonded in a trigonal planar geometry to one N(3), one N(4), and one H(6) atom. The C(6)-N(3) bond length is 1.33 Å. The C(6)-N(4) bond length is 1.36 Å. The C(6)-H(6) bond length is 1.08 Å. In the seventh C site, C(7) is bonded in a trigonal planar geometry to one N(5), one N(6), and one H(7) atom. The C(7)-N(5) bond length is 1.33 Å. The C(7)-N(6) bond length is 1.36 Å. The C(7)-H(7) bond length is 1.08 Å. In the eighth C site, C(8) is bonded in a distorted bent 120 degrees geometry to one C(9), one N(5), and one H(8) atom. The C(8)-C(9) bond length is 1.38 Å. The C(8)-N(5) bond length is 1.39 Å. The C(8)-H(8) bond length is 1.09 Å. In the ninth C site, C(9) is bonded in a distorted bent 120 degrees geometry to one C(8), one N(6), and one H(9) atom. The C(9)-N(6) bond length is 1.39 Å. The C(9)-H(9) bond length is 1.08 Å. In the tenth C site, C(10) is bonded in a distorted bent 120 degrees geometry to one C(11), one N(7), and one H(10) atom. The C(10)-C(11) bond length is 1.37 Å. The C(10)-N(7) bond length is 1.39 Å. The C(10)-H(10) bond length is 1.08 Å. In the eleventh C site, C(11) is bonded in a distorted bent 120 degrees geometry to one C(10), one N(8), and one H(11) atom. The C(11)-N(8) bond length is 1.38 Å. The C(11)-H(11) bond length is 1.09 Å. In the twelfth C site, C(12) is bonded in a trigonal planar geometry to one N(7), one N(8), and one H(12) atom. The C(12)-N(7) bond length is 1.36 Å. The C(12)-N(8) bond length is 1.33 Å. The C(12)-H(12) bond length is 1.08 Å. In the thirteenth C site, C(13) is bonded in a distorted bent 120 degrees geometry to one C(15), one O(1), and one O(2) atom. The C(13)-C(15) bond length is 1.50 Å. The C(13)-O(1) bond length is 1.25 Å. The C(13)-O(2) bond length is 1.30 Å. In the fourteenth C site, C(14) is bonded in a distorted single-bond geometry to one C(15) and one H(13) atom. The C(14)-C(15) bond length is 1.40 Å. The C(14)-H(13) bond length is 1.09 Å. In the fifteenth C site, C(15) is bonded in a trigonal planar geometry to one C(13), one C(14), and one C(16) atom. The C(15)-C(16) bond length is 1.40 Å. In the sixteenth C site, C(16) is bonded in a distorted single-bond geometry to one C(15) and one H(14) atom. The C(16)-H(14) bond length is 1.09 Å. In the seventeenth C site, C(17) is bonded in a distorted bent 120 degrees geometry to one C(18), one O(3), and one O(4) atom. The C(17)-C(18) bond length is 1.50 Å. The C(17)-O(3) bond length is 1.25 Å. The C(17)-O(4) bond length is 1.30 Å. In the eighteenth C site, C(18) is bonded in a trigonal planar geometry to one C(17), one C(19), and one C(20) atom. The C(18)-C(19) bond length is 1.40 Å. The C(18)-C(20) 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(15) atom. The C(19)-H(15) bond length is 1.09 Å. In the twentieth C site, C(20) is bonded in a distorted single-bond geometry to one C(18) and one H(16) atom. The C(20)-H(16) bond length is 1.09 Å. There are eight inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Zn(2), one C(2), and one C(3) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one B(1), one C(1), and one C(3) atom. In the third N site, N(3) is bonded in a trigonal planar geometry to one Zn(2), one C(4), and one C(6) atom. In the fourth N site, N(4) is bonded in a trigonal planar geometry to one B(1), one C(5), and one C(6) atom. In the fifth N site, N(5) is bonded in a distorted trigonal planar geometry to one Zn(1), one C(7), and one C(8) atom. In the sixth N site, N(6) is bonded in a trigonal planar geometry to one B(1), one C(7), and one C(9) atom. In the seventh N site, N(7) is bonded in a trigonal planar geometry to one B(1), one C(10), and one C(12) atom. In the eighth N site, N(8) is bonded in a trigonal planar geometry to one Zn(1), one C(11), and one C(12) atom. There are seventeen inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(2) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(3) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(4) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one C(5) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one C(6) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one C(7) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one C(8) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one C(9) atom. In the tenth H site, H(10) is bonded in a single-bond geometry to one C(10) atom. In the eleventh H site, H(11) is bonded in a single-bond geometry to one C(11) atom. In the twelfth H site, H(12) is bonded in a single-bond geometry to one C(12) atom. In the thirteenth H site, H(13) is bonded in a single-bond geometry to one C(14) atom. In the fourteenth H site, H(14) is bonded in a single-bond geometry to one C(16) atom. In the fifteenth H site, H(15) is bonded in a single-bond geometry to one C(19) atom. In the sixteenth H site, H(16) is bonded in a single-bond geometry to one C(20) atom. In the seventeenth H site, H(17) is bonded in a single-bond geometry to one O(5) atom. The H(17)-O(5) bond length is 0.97 Å. There are five inequivalent O sites. In the first O site, O(2) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(13) atom. In the second O site, O(3) is bonded in a single-bond geometry to one C(17) atom. In the third O site, O(4) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(17) atom. In the fourth O site, O(5) is bonded in a distorted water-like geometry to one Zn(1) and two equivalent H(17) atoms. In the fifth O site, O(1) is bonded in a single-bond geometry to one C(13) atom. Linkers: 4 c1ncn(c1)[B](n1cncc1)(n1cncc1)n1cncc1 ,4 [O]C(=O)c1ccc(C([O])=O)cc1. Metal clusters: 2 O.[Zn] ,4 O=[C]O[Zn]O[C]=O. The MOF has largest included sphere 3.27 A, density 1.52 g/cm3, surface area 4341.13 m2/g, accessible volume 0.21 cm3/g