ZnH30(C22N3)2 crystallizes in the trigonal R-3 space group. Zn(1) is bonded in an octahedral geometry to two equivalent N(1), two equivalent N(2), and two equivalent N(3) atoms. Both Zn(1)-N(1) bond lengths are 2.08 Å. Both Zn(1)-N(2) bond lengths are 2.09 Å. Both Zn(1)-N(3) bond lengths are 2.33 Å. There are twenty-two inequivalent C sites. In the first C site, C(19) is bonded in a distorted single-bond geometry to one C(18) and one H(12) atom. The C(19)-C(18) bond length is 1.40 Å. The C(19)-H(12) bond length is 1.09 Å. In the second C site, C(20) is bonded in a distorted bent 120 degrees geometry to one N(3) and one H(13) atom. The C(20)-N(3) bond length is 1.34 Å. The C(20)-H(13) bond length is 1.09 Å. In the third C site, C(21) is bonded in a distorted trigonal planar geometry to one C(22), one N(3), and one H(14) atom. The C(21)-C(22) bond length is 1.39 Å. The C(21)-N(3) bond length is 1.34 Å. The C(21)-H(14) bond length is 1.09 Å. In the fourth C site, C(22) is bonded in a distorted single-bond geometry to one C(18), one C(21), and one H(15) atom. The C(22)-C(18) bond length is 1.40 Å. The C(22)-H(15) bond length is 1.09 Å. In the fifth C site, C(1) is bonded in a distorted single-bond geometry to one C(10), one C(2), and one N(1) atom. The C(1)-C(10) bond length is 1.41 Å. The C(1)-C(2) bond length is 1.45 Å. The C(1)-N(1) bond length is 1.37 Å. In the sixth C site, C(2) is bonded in a distorted single-bond geometry to one C(1), one C(3), and one H(1) atom. The C(2)-C(3) bond length is 1.37 Å. The C(2)-H(1) bond length is 1.09 Å. In the seventh C site, C(3) is bonded in a distorted single-bond geometry to one C(2), one C(4), and one H(2) atom. The C(3)-C(4) bond length is 1.45 Å. The C(3)-H(2) bond length is 1.08 Å. In the eighth C site, C(4) is bonded in a distorted single-bond geometry to one C(3), one C(5), and one N(1) atom. The C(4)-C(5) bond length is 1.41 Å. The C(4)-N(1) bond length is 1.37 Å. In the ninth C site, C(5) is bonded in a trigonal planar geometry to one C(11), one C(4), and one C(6) atom. The C(5)-C(11) bond length is 1.49 Å. The C(5)-C(6) bond length is 1.42 Å. In the tenth C site, C(6) is bonded in a distorted single-bond geometry to one C(5), one C(7), and one N(2) atom. The C(6)-C(7) bond length is 1.45 Å. The C(6)-N(2) bond length is 1.37 Å. In the eleventh C site, C(7) is bonded in a distorted single-bond geometry to one C(6), one C(8), and one H(3) atom. The C(7)-C(8) bond length is 1.37 Å. The C(7)-H(3) bond length is 1.08 Å. In the twelfth C site, C(8) is bonded in a distorted single-bond geometry to one C(7), one C(9), and one H(4) atom. The C(8)-C(9) bond length is 1.45 Å. The C(8)-H(4) bond length is 1.09 Å. In the thirteenth C site, C(9) is bonded in a distorted single-bond geometry to one C(10), one C(8), and one N(2) atom. The C(9)-C(10) bond length is 1.41 Å. The C(9)-N(2) bond length is 1.37 Å. In the fourteenth C site, C(10) is bonded in a trigonal planar geometry to one C(1), one C(18), and one C(9) atom. The C(10)-C(18) bond length is 1.49 Å. In the fifteenth C site, C(11) is bonded in a trigonal planar geometry to one C(12), one C(16), and one C(5) atom. The C(11)-C(12) bond length is 1.40 Å. The C(11)-C(16) bond length is 1.40 Å. In the sixteenth C site, C(12) is bonded in a distorted single-bond geometry to one C(11) and one H(5) atom. The C(12)-H(5) bond length is 1.09 Å. In the seventeenth C site, C(13) is bonded in a distorted single-bond geometry to one C(14) and one H(6) atom. The C(13)-C(14) bond length is 1.40 Å. The C(13)-H(6) bond length is 1.09 Å. In the eighteenth C site, C(14) is bonded in a trigonal planar geometry to one C(13), one C(15), and one C(17) atom. The C(14)-C(15) bond length is 1.40 Å. The C(14)-C(17) bond length is 1.51 Å. In the nineteenth C site, C(15) is bonded in a distorted trigonal planar geometry to one C(14), one C(16), and one H(7) atom. The C(15)-C(16) bond length is 1.40 Å. The C(15)-H(7) bond length is 1.09 Å. In the twentieth C site, C(16) is bonded in a distorted single-bond geometry to one C(11), one C(15), and one H(8) atom. The C(16)-H(8) bond length is 1.09 Å. In the twenty-first C site, C(17) is bonded in a distorted trigonal non-coplanar geometry to one C(14), one H(10), one H(11), and one H(9) atom. The C(17)-H(10) bond length is 1.10 Å. The C(17)-H(11) bond length is 1.10 Å. The C(17)-H(9) bond length is 1.10 Å. In the twenty-second C site, C(18) is bonded in a trigonal planar geometry to one C(10), one C(19), and one C(22) atom. 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(1), and one C(4) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one Zn(1), one C(6), and one C(9) atom. In the third N site, N(3) is bonded in a trigonal planar geometry to one Zn(1), one C(20), and one C(21) atom. There are fifteen 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(7) 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(12) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one C(13) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one C(15) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one C(16) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one C(17) atom. In the tenth H site, H(10) is bonded in a single-bond geometry to one C(17) atom. In the eleventh H site, H(11) is bonded in a single-bond geometry to one C(17) atom. In the twelfth H site, H(12) is bonded in a single-bond geometry to one C(19) atom. In the thirteenth H site, H(13) is bonded in a single-bond geometry to one C(20) atom. In the fourteenth H site, H(14) is bonded in a single-bond geometry to one C(21) atom. In the fifteenth H site, H(15) is bonded in a single-bond geometry to one C(22) atom. Linkers: 1 [CH]=[C]/C1=C2\C=C/C(=C(\c3ccncc3)C3=N/C(=C(/c4ccc(C)cc4)C4=CC=C([N]4)/C(c4ccncc4)=C4/C=CC1=N4)C=C3)[N]2 ,3 Cc1ccc(/C2=C3\C=C/C(=C(\c4ccncc4)C4=N/C(=C(/c5ccc(C)cc5)C5=CC=C([N]5)/C(c5ccncc5)=C5/C=CC2=N5)C=C4)[N]3)cc1 ,1 [C]/C1=C2\[C]=CC(=N2)/C(c2ccncc2)=C2/C=C/C(=C(\c3ccc(C)cc3)C3=N/C(=C(/c4ccncc4)C4=CC=C1[N]4)C=C3)[N]2 ,1 [CH]=[C]/C1=C2\C=CC(=N2)/C(c2ccncc2)=C2/C=C/C(=C(\c3ccc(C)cc3)C3=N/C(=C(/c4ccncc4)C4=CC=C1[N]4)C=C3)[N]2 ,1 [C]/C1=C2\C=C/C(=C(\c3ccncc3)C3=N/C(=C(/c4ccc(C)cc4)C4=CC=C([N]4)/C(c4ccncc4)=C4/C=[C]C1=N4)C=C3)[N]2. Metal clusters: 3 [Zn]. The MOF has largest included sphere 5.50 A, density 1.21 g/cm3, surface area 4858.45 m2/g, accessible volume 0.29 cm3/g