NiC28H34S4(NO)2(CH2)4 is Indium-derived structured and crystallizes in the monoclinic C2 space group. The structure is zero-dimensional and consists of sixteen 02329_fluka molecules and four NiC28H34S4(NO)2 clusters. In two of the NiC28H34S4(NO)2 clusters, Ni(1) is bonded in a distorted octahedral geometry to one N(1), one N(2), two equivalent S(1), and two equivalent S(2) atoms. The Ni(1)-N(1) bond length is 2.07 Å. The Ni(1)-N(2) bond length is 2.05 Å. Both Ni(1)-S(1) bond lengths are 2.41 Å. Both Ni(1)-S(2) bond lengths are 2.42 Å. There are fifteen inequivalent C sites. In the first C site, C(1) is bonded in a distorted single-bond geometry to one S(1), one S(2), and one O(1) atom. The C(1)-S(1) bond length is 1.70 Å. The C(1)-S(2) bond length is 1.69 Å. The C(1)-O(1) bond length is 1.34 Å. In the second C site, C(2) is bonded in a distorted water-like geometry to one C(3), one H(1), and one O(1) atom. The C(2)-C(3) bond length is 1.55 Å. The C(2)-H(1) bond length is 1.10 Å. The C(2)-O(1) bond length is 1.46 Å. In the third C site, C(3) is bonded in a tetrahedral geometry to one C(2), one C(4), one C(8), and one C(9) atom. The C(3)-C(4) bond length is 1.55 Å. The C(3)-C(8) bond length is 1.52 Å. The C(3)-C(9) bond length is 1.57 Å. In the fourth C site, C(4) is bonded in a distorted water-like geometry to one C(3), one H(2), and one H(3) atom. The C(4)-H(2) bond length is 1.10 Å. The C(4)-H(3) bond length is 1.10 Å. In the fifth C site, C(6) is bonded in a distorted single-bond geometry to one C(9) and one H(6) atom. The C(6)-C(9) bond length is 1.56 Å. The C(6)-H(6) bond length is 1.10 Å. In the sixth C site, C(8) is bonded in a distorted trigonal non-coplanar geometry to one C(3), one H(10), one H(11), and one H(9) atom. The C(8)-H(10) bond length is 1.10 Å. The C(8)-H(11) bond length is 1.10 Å. The C(8)-H(9) bond length is 1.10 Å. In the seventh C site, C(9) is bonded in a tetrahedral geometry to one C(10), one C(11), one C(3), and one C(6) atom. The C(9)-C(10) bond length is 1.53 Å. The C(9)-C(11) bond length is 1.53 Å. In the eighth C site, C(10) is bonded in a distorted trigonal non-coplanar geometry to one C(9), one H(12), one H(13), and one H(14) atom. The C(10)-H(12) bond length is 1.10 Å. The C(10)-H(13) bond length is 1.10 Å. The C(10)-H(14) bond length is 1.10 Å. In the ninth C site, C(11) is bonded in a distorted trigonal non-coplanar geometry to one C(9), one H(15), one H(16), and one H(17) atom. The C(11)-H(15) bond length is 1.10 Å. The C(11)-H(16) bond length is 1.10 Å. The C(11)-H(17) bond length is 1.10 Å. In the tenth C site, C(12) is bonded in a distorted trigonal planar geometry to one C(13), one N(1), and one H(18) atom. The C(12)-C(13) bond length is 1.39 Å. The C(12)-N(1) bond length is 1.34 Å. The C(12)-H(18) bond length is 1.09 Å. In the eleventh C site, C(13) is bonded in a distorted trigonal planar geometry to one C(12), one C(14), and one H(19) atom. The C(13)-C(14) bond length is 1.40 Å. The C(13)-H(19) bond length is 1.09 Å. In the twelfth C site, C(14) is bonded in a trigonal planar geometry to one C(15) and two equivalent C(13) atoms. The C(14)-C(15) bond length is 1.47 Å. In the thirteenth C site, C(15) is bonded in a trigonal planar geometry to one C(14) and two equivalent C(16) atoms. Both C(15)-C(16) bond lengths are 1.40 Å. In the fourteenth C site, C(16) is bonded in a distorted single-bond geometry to one C(15) and one H(20) atom. The C(16)-H(20) bond length is 1.09 Å. In the fifteenth C site, C(17) is bonded in a 2-coordinate geometry to one N(2) and one H(21) atom. The C(17)-N(2) bond length is 1.35 Å. The C(17)-H(21) bond length is 1.09 Å. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Ni(1) and two equivalent C(12) atoms. In the second N site, N(2) is bonded in a trigonal planar geometry to one Ni(1) and two equivalent C(17) atoms. There are seventeen 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(4) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(4) atom. In the fourth H site, H(6) is bonded in a single-bond geometry to one C(6) atom. In the fifth H site, H(9) is bonded in a single-bond geometry to one C(8) atom. In the sixth H site, H(10) is bonded in a single-bond geometry to one C(8) atom. In the seventh H site, H(11) is bonded in a single-bond geometry to one C(8) atom. In the eighth H site, H(12) is bonded in a single-bond geometry to one C(10) atom. In the ninth H site, H(13) is bonded in a single-bond geometry to one C(10) atom. In the tenth H site, H(14) is bonded in a single-bond geometry to one C(10) atom. In the eleventh H site, H(15) is bonded in a single-bond geometry to one C(11) atom. In the twelfth H site, H(16) is bonded in a single-bond geometry to one C(11) atom. In the thirteenth H site, H(17) is bonded in a single-bond geometry to one C(11) atom. In the fourteenth H site, H(18) is bonded in a single-bond geometry to one C(12) atom. In the fifteenth H site, H(19) is bonded in a single-bond geometry to one C(13) atom. In the sixteenth H site, H(20) is bonded in a single-bond geometry to one C(16) atom. In the seventeenth H site, H(21) is bonded in a single-bond geometry to one C(17) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in an L-shaped geometry to one Ni(1) and one C(1) atom. In the second S site, S(2) is bonded in an L-shaped geometry to one Ni(1) and one C(1) atom. O(1) is bonded in a bent 120 degrees geometry to one C(1) and one C(2) atom. In two of the NiC28H34S4(NO)2 clusters, Ni(2) is bonded in a distorted octahedral geometry to one N(3), one N(4), two equivalent S(3), and two equivalent S(4) atoms. The Ni(2)-N(3) bond length is 2.06 Å. The Ni(2)-N(4) bond length is 2.06 Å. Both Ni(2)-S(3) bond lengths are 2.42 Å. Both Ni(2)-S(4) bond lengths are 2.45 Å. There are fifteen inequivalent C sites. In the first C site, C(18) is bonded in a distorted single-bond geometry to one S(3), one S(4), and one O(2) atom. The C(18)-S(3) bond length is 1.69 Å. The C(18)-S(4) bond length is 1.70 Å. The C(18)-O(2) bond length is 1.34 Å. In the second C site, C(19) is bonded in a distorted water-like geometry to one C(20), one H(22), and one O(2) atom. The C(19)-C(20) bond length is 1.54 Å. The C(19)-H(22) bond length is 1.10 Å. The C(19)-O(2) bond length is 1.46 Å. In the third C site, C(20) is bonded in a tetrahedral geometry to one C(19), one C(21), one C(25), and one C(26) atom. The C(20)-C(21) bond length is 1.55 Å. The C(20)-C(25) bond length is 1.51 Å. The C(20)-C(26) bond length is 1.57 Å. In the fourth C site, C(21) is bonded in a distorted water-like geometry to one C(20), one H(23), and one H(24) atom. The C(21)-H(23) bond length is 1.10 Å. The C(21)-H(24) bond length is 1.10 Å. In the fifth C site, C(23) is bonded in a distorted single-bond geometry to one C(26) and one H(27) atom. The C(23)-C(26) bond length is 1.56 Å. The C(23)-H(27) bond length is 1.10 Å. In the sixth C site, C(25) is bonded in a distorted trigonal non-coplanar geometry to one C(20), one H(30), one H(31), and one H(32) atom. The C(25)-H(30) bond length is 1.10 Å. The C(25)-H(31) bond length is 1.10 Å. The C(25)-H(32) bond length is 1.10 Å. In the seventh C site, C(26) is bonded in a tetrahedral geometry to one C(20), one C(23), one C(27), and one C(28) atom. The C(26)-C(27) bond length is 1.53 Å. The C(26)-C(28) bond length is 1.53 Å. In the eighth C site, C(27) is bonded in a distorted trigonal non-coplanar geometry to one C(26), one H(33), one H(34), and one H(35) atom. The C(27)-H(33) bond length is 1.10 Å. The C(27)-H(34) bond length is 1.10 Å. The C(27)-H(35) bond length is 1.10 Å. In the ninth C site, C(28) is bonded in a distorted trigonal non-coplanar geometry to one C(26), one H(36), one H(37), and one H(38) atom. The C(28)-H(36) bond length is 1.10 Å. The C(28)-H(37) bond length is 1.10 Å. The C(28)-H(38) bond length is 1.10 Å. In the tenth C site, C(29) is bonded in a distorted trigonal planar geometry to one C(30), one N(3), and one H(39) atom. The C(29)-C(30) bond length is 1.39 Å. The C(29)-N(3) bond length is 1.35 Å. The C(29)-H(39) bond length is 1.09 Å. In the eleventh C site, C(30) is bonded in a distorted single-bond geometry to one C(29), one C(31), and one H(40) atom. The C(30)-C(31) bond length is 1.41 Å. The C(30)-H(40) bond length is 1.09 Å. In the twelfth C site, C(31) is bonded in a trigonal planar geometry to one C(32) and two equivalent C(30) atoms. The C(31)-C(32) bond length is 1.47 Å. In the thirteenth C site, C(32) is bonded in a trigonal planar geometry to one C(31) and two equivalent C(33) atoms. Both C(32)-C(33) bond lengths are 1.41 Å. In the fourteenth C site, C(33) is bonded in a distorted single-bond geometry to one C(32) and one H(41) atom. The C(33)-H(41) bond length is 1.09 Å. In the fifteenth C site, C(34) is bonded in a distorted bent 120 degrees geometry to one N(4) and one H(42) atom. The C(34)-N(4) bond length is 1.35 Å. The C(34)-H(42) bond length is 1.09 Å. There are two inequivalent N sites. In the first N site, N(3) is bonded in a trigonal planar geometry to one Ni(2) and two equivalent C(29) atoms. In the second N site, N(4) is bonded in a trigonal planar geometry to one Ni(2) and two equivalent C(34) atoms. There are seventeen inequivalent H sites. In the first H site, H(22) is bonded in a single-bond geometry to one C(19) atom. In the second H site, H(23) is bonded in a single-bond geometry to one C(21) atom. In the third H site, H(24) is bonded in a single-bond geometry to one C(21) atom. In the fourth H site, H(27) is bonded in a single-bond geometry to one C(23) atom. In the fifth H site, H(30) is bonded in a single-bond geometry to one C(25) atom. In the sixth H site, H(31) is bonded in a single-bond geometry to one C(25) atom. In the seventh H site, H(32) is bonded in a single-bond geometry to one C(25) atom. In the eighth H site, H(33) is bonded in a single-bond geometry to one C(27) atom. In the ninth H site, H(34) is bonded in a single-bond geometry to one C(27) atom. In the tenth H site, H(35) is bonded in a single-bond geometry to one C(27) atom. In the eleventh H site, H(36) is bonded in a single-bond geometry to one C(28) atom. In the twelfth H site, H(37) is bonded in a single-bond geometry to one C(28) atom. In the thirteenth H site, H(38) is bonded in a single-bond geometry to one C(28) atom. In the fourteenth H site, H(39) is bonded in a single-bond geometry to one C(29) atom. In the fifteenth H site, H(40) is bonded in a single-bond geometry to one C(30) atom. In the sixteenth H site, H(41) is bonded in a single-bond geometry to one C(33) atom. In the seventeenth H site, H(42) is bonded in a single-bond geometry to one C(34) atom. There are two inequivalent S sites. In the first S site, S(3) is bonded in an L-shaped geometry to one Ni(2) and one C(18) atom. In the second S site, S(4) is bonded in an L-shaped geometry to one Ni(2) and one C(18) atom. O(2) is bonded in a bent 120 degrees geometry to one C(18) and one C(19) atom. Linkers: 3 CC1(C)[C@H]2CC[C@]1(C)[C@H](OC([S])=S)C2 ,2 c1cc(-c2ccncc2)ccn1. Metal clusters: 2 [Ni]. The MOF has largest included sphere 4.67 A, density 1.10 g/cm3, surface area 5107.18 m2/g, accessible volume 0.36 cm3/g