ZnC13NH9O5 crystallizes in the triclinic P-1 space group. There are three inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to one N(1), one O(12), one O(14), one O(4), one O(7), and one O(9) atom to form corner-sharing ZnNO5 octahedra. The corner-sharing octahedral tilt angles are 66°. The Zn(1)-N(1) bond length is 2.10 Å. The Zn(1)-O(12) bond length is 2.07 Å. The Zn(1)-O(14) bond length is 2.10 Å. The Zn(1)-O(4) bond length is 2.17 Å. The Zn(1)-O(7) bond length is 2.17 Å. The Zn(1)-O(9) bond length is 2.16 Å. In the second Zn site, Zn(2) is bonded to one N(2), one O(10), one O(15), one O(5), one O(7), and one O(8) atom to form corner-sharing ZnNO5 octahedra. The corner-sharing octahedral tilt angles range from 66-67°. The Zn(2)-N(2) bond length is 2.11 Å. The Zn(2)-O(10) bond length is 2.07 Å. The Zn(2)-O(15) bond length is 2.10 Å. The Zn(2)-O(5) bond length is 2.17 Å. The Zn(2)-O(7) bond length is 2.16 Å. The Zn(2)-O(8) bond length is 2.17 Å. In the third Zn site, Zn(3) is bonded to one N(3), one O(11), one O(13), one O(6), one O(8), and one O(9) atom to form corner-sharing ZnNO5 octahedra. The corner-sharing octahedral tilt angles range from 66-67°. The Zn(3)-N(3) bond length is 2.11 Å. The Zn(3)-O(11) bond length is 2.07 Å. The Zn(3)-O(13) bond length is 2.10 Å. The Zn(3)-O(6) bond length is 2.17 Å. The Zn(3)-O(8) bond length is 2.16 Å. The Zn(3)-O(9) bond length is 2.17 Å. There are thirty-one inequivalent C sites. In the first C site, C(36) is bonded in a distorted trigonal planar geometry to one C(19,20,21); one C(31,32,33); and one H(25,26,27) atom. The C(36)-C(19,20,21) bond length is 1.41 Å. The C(36)-C(31,32,33) bond length is 1.39 Å. The C(36)-H(25,26,27) bond length is 1.09 Å. In the second C site, C(37) is bonded in a distorted bent 120 degrees geometry to one C(25), one O(10), and one O(13) atom. The C(37)-C(25) bond length is 1.49 Å. The C(37)-O(10) bond length is 1.28 Å. The C(37)-O(13) bond length is 1.27 Å. In the third C site, C(38) is bonded in a distorted bent 120 degrees geometry to one C(26), one O(11), and one O(14) atom. The C(38)-C(26) bond length is 1.49 Å. The C(38)-O(11) bond length is 1.28 Å. The C(38)-O(14) bond length is 1.27 Å. In the fourth C site, C(39) is bonded in a distorted bent 120 degrees geometry to one C(27), one O(12), and one O(15) atom. The C(39)-C(27) bond length is 1.49 Å. The C(39)-O(12) bond length is 1.28 Å. The C(39)-O(15) bond length is 1.27 Å. In the fifth C site, C(1) is bonded in a distorted bent 120 degrees geometry to one C(4,6); one O(1); and one O(7) atom. The C(1)-C(4,6) bond length is 1.51 Å. The C(1)-O(1) bond length is 1.25 Å. The C(1)-O(7) bond length is 1.29 Å. In the sixth C site, C(2) is bonded in a distorted bent 120 degrees geometry to one C(5), one O(2), and one O(8) atom. The C(2)-C(5) bond length is 1.51 Å. The C(2)-O(2) bond length is 1.25 Å. The C(2)-O(8) bond length is 1.29 Å. In the seventh C site, C(3) is bonded in a distorted bent 120 degrees geometry to one C(4,6); one O(3); and one O(9) atom. The C(3)-C(4,6) bond length is 1.51 Å. The C(3)-O(3) bond length is 1.25 Å. The C(3)-O(9) bond length is 1.29 Å. In the eighth C site, C(4,6) is bonded in a distorted trigonal planar geometry to one C(1), one C(7), and one N(1) atom. The C(4,6)-C(7) bond length is 1.40 Å. The C(4,6)-N(1) bond length is 1.35 Å. In the ninth C site, C(5) is bonded in a distorted trigonal planar geometry to one C(2), one C(8), and one N(2) atom. The C(5)-C(8) bond length is 1.40 Å. The C(5)-N(2) bond length is 1.35 Å. In the tenth C site, C(7) is bonded in a distorted trigonal planar geometry to one C(10,11,12); one C(4,6); and one H(7,8,9) atom. The C(7)-C(10,11,12) bond length is 1.39 Å. The C(7)-H(7,8,9) bond length is 1.09 Å. In the eleventh C site, C(8) is bonded in a distorted trigonal planar geometry to one C(10,11,12); one C(5); and one H(7,8,9) atom. The C(8)-C(10,11,12) bond length is 1.39 Å. The C(8)-H(7,8,9) bond length is 1.09 Å. In the twelfth C site, C(9) is bonded in a distorted trigonal planar geometry to one C(10,11,12); one C(4,6); and one H(7,8,9) atom. The C(9)-C(10,11,12) bond length is 1.39 Å. The C(9)-C(4,6) bond length is 1.40 Å. The C(9)-H(7,8,9) bond length is 1.09 Å. In the thirteenth C site, C(10,11,12) is bonded in a distorted trigonal planar geometry to one C(13); one C(7); and one H(10,11,12) atom. The C(10,11,12)-C(13) bond length is 1.40 Å. The C(10,11,12)-H(10,11,12) bond length is 1.09 Å. In the fourteenth C site, C(13) is bonded in a trigonal planar geometry to one C(10,11,12); one C(16,18); and one C(19,20,21) atom. The C(13)-C(16,18) bond length is 1.41 Å. The C(13)-C(19,20,21) bond length is 1.47 Å. In the fifteenth C site, C(14) is bonded in a trigonal planar geometry to one C(10,11,12); one C(17); and one C(19,20,21) atom. The C(14)-C(10,11,12) bond length is 1.40 Å. The C(14)-C(17) bond length is 1.41 Å. The C(14)-C(19,20,21) bond length is 1.47 Å. In the sixteenth C site, C(15) is bonded in a trigonal planar geometry to one C(10,11,12); one C(16,18); and one C(19,20,21) atom. The C(15)-C(10,11,12) bond length is 1.40 Å. The C(15)-C(16,18) bond length is 1.41 Å. The C(15)-C(19,20,21) bond length is 1.47 Å. In the seventeenth C site, C(16,18) is bonded in a distorted bent 120 degrees geometry to one C(13), one N(1), and one H(13) atom. The C(16,18)-N(1) bond length is 1.34 Å. The C(16,18)-H(13) bond length is 1.09 Å. In the eighteenth C site, C(17) is bonded in a distorted bent 120 degrees geometry to one C(14), one N(2), and one H(14) atom. The C(17)-N(2) bond length is 1.34 Å. The C(17)-H(14) bond length is 1.09 Å. In the nineteenth C site, C(19,20,21) is bonded in a trigonal planar geometry to one C(13), one C(22), and one C(34) atom. The C(19,20,21)-C(22) bond length is 1.40 Å. The C(19,20,21)-C(34) bond length is 1.41 Å. In the twentieth C site, C(22) is bonded in a distorted single-bond geometry to one C(19,20,21); one C(25); and one H(16,17,18) atom. The C(22)-C(25) bond length is 1.40 Å. The C(22)-H(16,17,18) bond length is 1.09 Å. In the twenty-first C site, C(23) is bonded in a distorted single-bond geometry to one C(19,20,21); one C(26); and one H(16,17,18) atom. The C(23)-C(19,20,21) bond length is 1.40 Å. The C(23)-C(26) bond length is 1.40 Å. The C(23)-H(16,17,18) bond length is 1.09 Å. In the twenty-second C site, C(24) is bonded in a distorted single-bond geometry to one C(19,20,21); one C(27); and one H(16,17,18) atom. The C(24)-C(19,20,21) bond length is 1.40 Å. The C(24)-C(27) bond length is 1.40 Å. The C(24)-H(16,17,18) bond length is 1.09 Å. In the twenty-third C site, C(25) is bonded in a trigonal planar geometry to one C(22), one C(28), and one C(37) atom. The C(25)-C(28) bond length is 1.40 Å. In the twenty-fourth C site, C(26) is bonded in a trigonal planar geometry to one C(23), one C(29), and one C(38) atom. The C(26)-C(29) bond length is 1.40 Å. In the twenty-fifth C site, C(27) is bonded in a trigonal planar geometry to one C(24), one C(30), and one C(39) atom. The C(27)-C(30) bond length is 1.40 Å. In the twenty-sixth C site, C(28) is bonded in a distorted single-bond geometry to one C(25); one C(31,32,33); and one H(19,20,21) atom. The C(28)-C(31,32,33) bond length is 1.39 Å. The C(28)-H(19,20,21) bond length is 1.09 Å. In the twenty-seventh C site, C(29) is bonded in a distorted single-bond geometry to one C(26); one C(31,32,33); and one H(19,20,21) atom. The C(29)-C(31,32,33) bond length is 1.39 Å. The C(29)-H(19,20,21) bond length is 1.09 Å. In the twenty-eighth C site, C(30) is bonded in a distorted single-bond geometry to one C(27); one C(31,32,33); and one H(19,20,21) atom. The C(30)-C(31,32,33) bond length is 1.39 Å. The C(30)-H(19,20,21) bond length is 1.09 Å. In the twenty-ninth C site, C(31,32,33) is bonded in a distorted trigonal planar geometry to one C(28), one C(34), and one H(22) atom. The C(31,32,33)-C(34) bond length is 1.39 Å. The C(31,32,33)-H(22) bond length is 1.09 Å. In the thirtieth C site, C(34) is bonded in a distorted trigonal planar geometry to one C(19,20,21); one C(31,32,33); and one H(25,26,27) atom. The C(34)-H(25,26,27) bond length is 1.09 Å. In the thirty-first C site, C(35) is bonded in a distorted trigonal planar geometry to one C(19,20,21); one C(31,32,33); and one H(25,26,27) atom. The C(35)-C(19,20,21) bond length is 1.41 Å. The C(35)-C(31,32,33) bond length is 1.39 Å. The C(35)-H(25,26,27) 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(16,18); and one C(4,6) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one Zn(2), one C(17), and one C(5) atom. In the third N site, N(3) is bonded in a trigonal planar geometry to one Zn(3); one C(16,18); and one C(4,6) atom. The N(3)-C(16,18) bond length is 1.34 Å. The N(3)-C(4,6) bond length is 1.35 Å. There are seventeen inequivalent H sites. In the first H site, H(1) is bonded in a distorted single-bond geometry to one O(3) and one O(4) atom. The H(1)-O(3) bond length is 1.64 Å. The H(1)-O(4) bond length is 1.01 Å. In the second H site, H(2) is bonded in a distorted single-bond geometry to one O(1) and one O(5) atom. The H(2)-O(1) bond length is 1.64 Å. The H(2)-O(5) bond length is 1.01 Å. In the third H site, H(3) is bonded in a distorted single-bond geometry to one O(2) and one O(6) atom. The H(3)-O(2) bond length is 1.64 Å. The H(3)-O(6) bond length is 1.01 Å. In the fourth H site, H(4) is bonded in a single-bond geometry to one O(4) atom. The H(4)-O(4) bond length is 0.99 Å. In the fifth H site, H(5) is bonded in a single-bond geometry to one O(5) atom. The H(5)-O(5) bond length is 0.99 Å. In the sixth H site, H(6) is bonded in a single-bond geometry to one O(6) atom. The H(6)-O(6) bond length is 0.99 Å. In the seventh H site, H(7,8,9) is bonded in a single-bond geometry to one C(7) atom. In the eighth H site, H(10,11,12) is bonded in a single-bond geometry to one C(10,11,12) atom. In the ninth H site, H(13) is bonded in a single-bond geometry to one C(16,18) atom. In the tenth H site, H(14) is bonded in a single-bond geometry to one C(17) atom. In the eleventh H site, H(15) is bonded in a single-bond geometry to one C(16,18) atom. The H(15)-C(16,18) bond length is 1.09 Å. In the twelfth H site, H(16,17,18) is bonded in a single-bond geometry to one C(22) atom. In the thirteenth H site, H(19,20,21) is bonded in a single-bond geometry to one C(28) atom. In the fourteenth H site, H(22) is bonded in a single-bond geometry to one C(31,32,33) atom. In the fifteenth H site, H(23) is bonded in a single-bond geometry to one C(31,32,33) atom. The H(23)-C(31,32,33) bond length is 1.09 Å. In the sixteenth H site, H(24) is bonded in a single-bond geometry to one C(31,32,33) atom. The H(24)-C(31,32,33) bond length is 1.09 Å. In the seventeenth H site, H(25,26,27) is bonded in a single-bond geometry to one C(34) atom. There are fifteen inequivalent O sites. In the first O site, O(1) is bonded in a water-like geometry to one C(1) and one H(2) atom. In the second O site, O(2) is bonded in a water-like geometry to one C(2) and one H(3) atom. In the third O site, O(3) is bonded in a water-like geometry to one C(3) and one H(1) atom. In the fourth O site, O(4) is bonded in a distorted water-like geometry to one Zn(1), one H(1), and one H(4) atom. In the fifth O site, O(5) is bonded in a distorted water-like geometry to one Zn(2), one H(2), and one H(5) atom. In the sixth O site, O(6) is bonded in a distorted water-like geometry to one Zn(3), one H(3), and one H(6) atom. In the seventh O site, O(7) is bonded in a distorted trigonal planar geometry to one Zn(1), one Zn(2), and one C(1) atom. In the eighth O site, O(8) is bonded in a distorted trigonal planar geometry to one Zn(2), one Zn(3), and one C(2) atom. In the ninth O site, O(9) is bonded in a distorted trigonal planar geometry to one Zn(1), one Zn(3), and one C(3) atom. In the tenth O site, O(10) is bonded in a bent 120 degrees geometry to one Zn(2) and one C(37) atom. In the eleventh O site, O(11) is bonded in a bent 120 degrees geometry to one Zn(3) and one C(38) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one Zn(1) and one C(39) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one Zn(3) and one C(37) atom. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one Zn(1) and one C(38) atom. In the fifteenth O site, O(15) is bonded in a distorted bent 120 degrees geometry to one Zn(2) and one C(39) atom. Linkers: 6 [O]C(=O)c1cccc(-c2ccc(C([O])=O)nc2)c1. Metal clusters: 6 [Zn]. The MOF has largest included sphere 11.15 A, density 1.10 g/cm3, surface area 4131.00 m2/g, accessible volume 0.49 cm3/g