CoC42H28(N5S)2 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of three CoC42H28(N5S)2 clusters. Co(1) is bonded in an octahedral geometry to two equivalent N(1), two equivalent N(14), and two equivalent N(4) atoms. Both Co(1)-N(1) bond lengths are 2.01 Å. Both Co(1)-N(14) bond lengths are 2.16 Å. Both Co(1)-N(4) bond lengths are 2.21 Å. There are twenty-one inequivalent C sites. In the first C site, C(22) is bonded in a distorted single-bond geometry to one C(19); one C(25,26); and one H(13,14,15) atom. The C(22)-C(19) bond length is 1.40 Å. The C(22)-C(25,26) bond length is 1.40 Å. The C(22)-H(13,14,15) bond length is 1.09 Å. In the second C site, C(25,26) is bonded in a trigonal planar geometry to one C(22), one C(28), and one C(49) atom. The C(25,26)-C(28) bond length is 1.40 Å. The C(25,26)-C(49) bond length is 1.48 Å. In the third C site, C(28) is bonded in a distorted single-bond geometry to one C(25,26); one C(31); and one H(16,17) atom. The C(28)-C(31) bond length is 1.40 Å. The C(28)-H(16,17) bond length is 1.09 Å. In the fourth C site, C(31) is bonded in a distorted single-bond geometry to one C(28), one C(34), and one N(7) atom. The C(31)-C(34) bond length is 1.48 Å. The C(31)-N(7) bond length is 1.35 Å. In the fifth C site, C(34) is bonded in a trigonal planar geometry to one C(31), one C(37), and one C(46) atom. The C(34)-C(37) bond length is 1.40 Å. The C(34)-C(46) bond length is 1.40 Å. In the sixth C site, C(37) is bonded in a distorted single-bond geometry to one C(34) and one H(19,21) atom. The C(37)-H(19,21) bond length is 1.09 Å. In the seventh C site, C(41) is bonded in a distorted bent 120 degrees geometry to one N(14) and one H(23,26) atom. The C(41)-N(14) bond length is 1.35 Å. The C(41)-H(23,26) bond length is 1.09 Å. In the eighth C site, C(44) is bonded in a distorted bent 120 degrees geometry to one N(14) and one H(23,26) atom. The C(44)-N(14) bond length is 1.35 Å. The C(44)-H(23,26) bond length is 1.09 Å. In the ninth C site, C(46) is bonded in a distorted single-bond geometry to one C(34) and one H(28,30) atom. The C(46)-H(28,30) bond length is 1.09 Å. In the tenth C site, C(49) is bonded in a distorted trigonal planar geometry to one C(25,26); one C(52,53,54); and one N(10,11,12) atom. The C(49)-C(52,53,54) bond length is 1.40 Å. The C(49)-N(10,11,12) bond length is 1.35 Å. In the eleventh C site, C(52,53,54) is bonded in a distorted single-bond geometry to one C(49), one C(55), and one H(31) atom. The C(52,53,54)-C(55) bond length is 1.39 Å. The C(52,53,54)-H(31) bond length is 1.09 Å. In the twelfth C site, C(55) is bonded in a distorted trigonal planar geometry to one C(52,53,54); one C(58,59,60); and one H(34,35,36) atom. The C(55)-C(58,59,60) bond length is 1.39 Å. The C(55)-H(34,35,36) bond length is 1.09 Å. In the thirteenth C site, C(58,59,60) is bonded in a distorted trigonal planar geometry to one C(55), one C(61), and one H(37) atom. The C(58,59,60)-C(61) bond length is 1.40 Å. The C(58,59,60)-H(37) bond length is 1.09 Å. In the fourteenth C site, C(61) is bonded in a distorted bent 120 degrees geometry to one C(58,59,60); one N(10,11,12); and one H(40,41,42) atom. The C(61)-N(10,11,12) bond length is 1.34 Å. The C(61)-H(40,41,42) bond length is 1.09 Å. In the fifteenth C site, C(1) is bonded in a distorted single-bond geometry to one N(1) and one S(1) atom. The C(1)-N(1) bond length is 1.19 Å. The C(1)-S(1) bond length is 1.61 Å. In the sixteenth C site, C(4) is bonded in a distorted bent 120 degrees geometry to one N(4) and one H(1,3) atom. The C(4)-N(4) bond length is 1.35 Å. The C(4)-H(1,3) bond length is 1.09 Å. In the seventeenth C site, C(7) is bonded in a distorted single-bond geometry to one C(10,11,12) and one H(4,5,6) atom. The C(7)-C(10,11,12) bond length is 1.40 Å. The C(7)-H(4,5,6) bond length is 1.09 Å. In the eighteenth C site, C(10,11,12) is bonded in a trigonal planar geometry to one C(13), one C(19), and one C(7) atom. The C(10,11,12)-C(13) bond length is 1.40 Å. The C(10,11,12)-C(19) bond length is 1.48 Å. In the nineteenth C site, C(13) is bonded in a distorted single-bond geometry to one C(10,11,12); one C(16); and one H(7,8,9) atom. The C(13)-C(16) bond length is 1.39 Å. The C(13)-H(7,8,9) bond length is 1.09 Å. In the twentieth C site, C(16) is bonded in a distorted trigonal planar geometry to one C(13), one N(4), and one H(10) atom. The C(16)-N(4) bond length is 1.35 Å. The C(16)-H(10) bond length is 1.09 Å. In the twenty-first C site, C(19) is bonded in a distorted trigonal planar geometry to one C(10,11,12); one C(22); and one N(7) atom. The C(19)-N(7) bond length is 1.34 Å. There are five inequivalent N sites. In the first N site, N(1) is bonded in a bent 150 degrees geometry to one Co(1) and one C(1) atom. In the second N site, N(4) is bonded in a trigonal planar geometry to one Co(1), one C(16), and one C(4) atom. In the third N site, N(7) is bonded in a bent 120 degrees geometry to one C(19) and one C(31) atom. In the fourth N site, N(10,11,12) is bonded in a bent 120 degrees geometry to one C(49) and one C(61) atom. In the fifth N site, N(14) is bonded in a trigonal planar geometry to one Co(1), one C(41), and one C(44) atom. There are thirteen inequivalent H sites. In the first H site, H(1,3) is bonded in a single-bond geometry to one C(4) atom. In the second H site, H(4,5,6) is bonded in a single-bond geometry to one C(7) atom. In the third H site, H(7,8,9) is bonded in a single-bond geometry to one C(13) atom. In the fourth H site, H(10) is bonded in a single-bond geometry to one C(16) atom. In the fifth H site, H(13,14,15) is bonded in a single-bond geometry to one C(22) atom. In the sixth H site, H(16,17) is bonded in a single-bond geometry to one C(28) atom. In the seventh H site, H(19,21) is bonded in a single-bond geometry to one C(37) atom. In the eighth H site, H(23,26) is bonded in a single-bond geometry to one C(41) atom. In the ninth H site, H(28,30) is bonded in a single-bond geometry to one C(46) atom. In the tenth H site, H(31) is bonded in a single-bond geometry to one C(52,53,54) atom. In the eleventh H site, H(34,35,36) is bonded in a single-bond geometry to one C(55) atom. In the twelfth H site, H(37) is bonded in a single-bond geometry to one C(58,59,60) atom. In the thirteenth H site, H(40,41,42) is bonded in a single-bond geometry to one C(61) atom. S(1) is bonded in a single-bond geometry to one C(1) atom. Linkers: 6 c1ccc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)nc1. Metal clusters: 3 [Co]. The MOF has largest included sphere 6.77 A, density 1.12 g/cm3, surface area 4890.14 m2/g, accessible volume 0.38 cm3/g