Cu5C36H35(N3O5)3(H2O)2 crystallizes in the triclinic P1 space group. The structure consists of four water molecules inside a Cu5C36H35(N3O5)3 framework. In the Cu5C36H35(N3O5)3 framework, there are ten inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted rectangular see-saw-like geometry to one N(1), one N(4), one O(1), and one O(27) atom. The Cu(1)-N(1) bond length is 1.91 Å. The Cu(1)-N(4) bond length is 1.91 Å. The Cu(1)-O(1) bond length is 2.09 Å. The Cu(1)-O(27) bond length is 2.17 Å. In the second Cu site, Cu(2) is bonded in a distorted rectangular see-saw-like geometry to one N(2), one N(3), one O(2), and one O(28) atom. The Cu(2)-N(2) bond length is 1.91 Å. The Cu(2)-N(3) bond length is 1.91 Å. The Cu(2)-O(2) bond length is 2.09 Å. The Cu(2)-O(28) bond length is 2.17 Å. In the third Cu site, Cu(3) is bonded in a rectangular see-saw-like geometry to one N(13); one N(5,6); one O(1); and one O(3) atom. The Cu(3)-N(13) bond length is 1.94 Å. The Cu(3)-N(5,6) bond length is 1.95 Å. The Cu(3)-O(1) bond length is 1.97 Å. The Cu(3)-O(3) bond length is 1.94 Å. In the fourth Cu site, Cu(4) is bonded in a rectangular see-saw-like geometry to one N(14); one N(5,6); one O(2); and one O(4) atom. The Cu(4)-N(14) bond length is 1.94 Å. The Cu(4)-N(5,6) bond length is 1.95 Å. The Cu(4)-O(2) bond length is 1.97 Å. The Cu(4)-O(4) bond length is 1.93 Å. In the fifth Cu site, Cu(5) is bonded in a rectangular see-saw-like geometry to one N(15), one N(7), one O(2), and one O(5) atom. The Cu(5)-N(15) bond length is 1.96 Å. The Cu(5)-N(7) bond length is 1.96 Å. The Cu(5)-O(2) bond length is 2.01 Å. The Cu(5)-O(5) bond length is 1.95 Å. In the sixth Cu site, Cu(6) is bonded in a rectangular see-saw-like geometry to one N(16), one N(8), one O(1), and one O(6) atom. The Cu(6)-N(16) bond length is 1.95 Å. The Cu(6)-N(8) bond length is 1.96 Å. The Cu(6)-O(1) bond length is 2.02 Å. The Cu(6)-O(6) bond length is 1.95 Å. In the seventh Cu site, Cu(7) is bonded in a square pyramidal geometry to one N(17), one O(11), one O(14), one O(16), and one O(17) atom. The Cu(7)-N(17) bond length is 2.15 Å. The Cu(7)-O(11) bond length is 2.00 Å. The Cu(7)-O(14) bond length is 1.99 Å. The Cu(7)-O(16) bond length is 2.00 Å. The Cu(7)-O(17) bond length is 2.01 Å. In the eighth Cu site, Cu(8) is bonded in a square pyramidal geometry to one N(18), one O(12), one O(13), one O(15), and one O(18) atom. The Cu(8)-N(18) bond length is 2.15 Å. The Cu(8)-O(12) bond length is 2.00 Å. The Cu(8)-O(13) bond length is 1.99 Å. The Cu(8)-O(15) bond length is 2.01 Å. The Cu(8)-O(18) bond length is 2.01 Å. In the ninth Cu site, Cu(9) is bonded in a rectangular see-saw-like geometry to one N(11,12); one N(9,10); one O(19,20); and one O(21,22) atom. The Cu(9)-N(11,12) bond length is 1.93 Å. The Cu(9)-N(9,10) bond length is 1.93 Å. The Cu(9)-O(19,20) bond length is 1.97 Å. The Cu(9)-O(21,22) bond length is 1.97 Å. In the tenth Cu site, Cu(10) is bonded in a rectangular see-saw-like geometry to one N(11,12); one N(9,10); one O(19,20); and one O(21,22) atom. The Cu(10)-N(11,12) bond length is 1.93 Å. The Cu(10)-N(9,10) bond length is 1.93 Å. The Cu(10)-O(19,20) bond length is 1.97 Å. The Cu(10)-O(21,22) bond length is 1.97 Å. There are fifty-one inequivalent C sites. In the first C site, C(1,2) is bonded in a distorted trigonal non-coplanar geometry to one C(5,6); one H(15,16); one H(19,20); and one H(23,24) atom. The C(1,2)-C(5,6) bond length is 1.48 Å. The C(1,2)-H(15,16) bond length is 1.10 Å. The C(1,2)-H(19,20) bond length is 1.10 Å. The C(1,2)-H(23,24) bond length is 1.10 Å. In the second C site, C(3,4) is bonded in a distorted trigonal non-coplanar geometry to one C(7), one H(17), one H(21), and one H(25) atom. The C(3,4)-C(7) bond length is 1.48 Å. The C(3,4)-H(17) bond length is 1.10 Å. The C(3,4)-H(21) bond length is 1.10 Å. The C(3,4)-H(25) bond length is 1.10 Å. In the third C site, C(5,6) is bonded in a distorted trigonal planar geometry to one C(1,2); one N(1); and one N(9,10) atom. The C(5,6)-N(1) bond length is 1.33 Å. The C(5,6)-N(9,10) bond length is 1.35 Å. In the fourth C site, C(7) is bonded in a distorted trigonal planar geometry to one C(3,4); one N(11,12); and one N(3) atom. The C(7)-N(11,12) bond length is 1.35 Å. The C(7)-N(3) bond length is 1.33 Å. In the fifth C site, C(8) is bonded in a distorted trigonal planar geometry to one C(3,4); one N(11,12); and one N(4) atom. The C(8)-C(3,4) bond length is 1.48 Å. The C(8)-N(11,12) bond length is 1.35 Å. The C(8)-N(4) bond length is 1.33 Å. In the sixth C site, C(9) is bonded in a distorted trigonal planar geometry to one C(13,14); one N(5,6); and one N(9,10) atom. The C(9)-C(13,14) bond length is 1.48 Å. The C(9)-N(5,6) bond length is 1.34 Å. The C(9)-N(9,10) bond length is 1.36 Å. In the seventh C site, C(10) is bonded in a distorted trigonal planar geometry to one C(13,14); one N(5,6); and one N(9,10) atom. The C(10)-C(13,14) bond length is 1.48 Å. The C(10)-N(5,6) bond length is 1.34 Å. The C(10)-N(9,10) bond length is 1.36 Å. In the eighth C site, C(11) is bonded in a distorted trigonal planar geometry to one C(15,16); one N(11,12); and one N(7) atom. The C(11)-C(15,16) bond length is 1.48 Å. The C(11)-N(11,12) bond length is 1.36 Å. The C(11)-N(7) bond length is 1.33 Å. In the ninth C site, C(12) is bonded in a distorted trigonal planar geometry to one C(15,16); one N(11,12); and one N(8) atom. The C(12)-C(15,16) bond length is 1.48 Å. The C(12)-N(11,12) bond length is 1.36 Å. The C(12)-N(8) bond length is 1.33 Å. In the tenth C site, C(13,14) is bonded in a distorted trigonal non-coplanar geometry to one C(9); one H(27,28); one H(31,32); and one H(35,36) atom. The C(13,14)-H(27,28) bond length is 1.09 Å. The C(13,14)-H(31,32) bond length is 1.10 Å. The C(13,14)-H(35,36) bond length is 1.10 Å. In the eleventh C site, C(15,16) is bonded in a distorted trigonal non-coplanar geometry to one C(11); one H(29,30); one H(33,34); and one H(37,38) atom. The C(15,16)-H(29,30) bond length is 1.09 Å. The C(15,16)-H(33,34) bond length is 1.10 Å. The C(15,16)-H(37,38) bond length is 1.10 Å. In the twelfth C site, C(17) is bonded in a trigonal planar geometry to one C(21), one N(13), and one N(17) atom. The C(17)-C(21) bond length is 1.49 Å. The C(17)-N(13) bond length is 1.34 Å. The C(17)-N(17) bond length is 1.35 Å. In the thirteenth C site, C(18) is bonded in a trigonal planar geometry to one C(22), one N(14), and one N(18) atom. The C(18)-C(22) bond length is 1.49 Å. The C(18)-N(14) bond length is 1.34 Å. The C(18)-N(18) bond length is 1.35 Å. In the fourteenth C site, C(19) is bonded in a trigonal planar geometry to one C(23), one N(15), and one N(18) atom. The C(19)-C(23) bond length is 1.49 Å. The C(19)-N(15) bond length is 1.34 Å. The C(19)-N(18) bond length is 1.36 Å. In the fifteenth C site, C(20) is bonded in a trigonal planar geometry to one C(24), one N(16), and one N(17) atom. The C(20)-C(24) bond length is 1.49 Å. The C(20)-N(16) bond length is 1.34 Å. The C(20)-N(17) bond length is 1.36 Å. In the sixteenth C site, C(21) is bonded in a distorted trigonal non-coplanar geometry to one C(17); one H(39,40); one H(43,44); and one H(47,48) atom. The C(21)-H(39,40) bond length is 1.10 Å. The C(21)-H(43,44) bond length is 1.09 Å. The C(21)-H(47,48) bond length is 1.09 Å. In the seventeenth C site, C(22) is bonded in a distorted trigonal non-coplanar geometry to one C(18); one H(39,40); one H(43,44); and one H(47,48) atom. The C(22)-H(39,40) bond length is 1.10 Å. The C(22)-H(43,44) bond length is 1.09 Å. The C(22)-H(47,48) bond length is 1.09 Å. In the eighteenth C site, C(23) is bonded in a distorted trigonal non-coplanar geometry to one C(19); one H(41,42); one H(45,46); and one H(49,50) atom. The C(23)-H(41,42) bond length is 1.10 Å. The C(23)-H(45,46) bond length is 1.09 Å. The C(23)-H(49,50) bond length is 1.10 Å. In the nineteenth C site, C(24) is bonded in a distorted trigonal non-coplanar geometry to one C(20); one H(41,42); one H(45,46); and one H(49,50) atom. The C(24)-H(41,42) bond length is 1.10 Å. The C(24)-H(45,46) bond length is 1.09 Å. The C(24)-H(49,50) bond length is 1.10 Å. In the twentieth C site, C(25) is bonded in a distorted bent 120 degrees geometry to one C(29), one O(3), and one O(7) atom. The C(25)-C(29) bond length is 1.51 Å. The C(25)-O(3) bond length is 1.30 Å. The C(25)-O(7) bond length is 1.25 Å. In the twenty-first C site, C(26) is bonded in a distorted bent 120 degrees geometry to one C(30), one O(4), and one O(8) atom. The C(26)-C(30) bond length is 1.51 Å. The C(26)-O(4) bond length is 1.30 Å. The C(26)-O(8) bond length is 1.25 Å. In the twenty-second C site, C(27) is bonded in a distorted bent 120 degrees geometry to one C(31), one O(5), and one O(9) atom. The C(27)-C(31) bond length is 1.51 Å. The C(27)-O(5) bond length is 1.30 Å. The C(27)-O(9) bond length is 1.25 Å. In the twenty-third C site, C(28) is bonded in a distorted bent 120 degrees geometry to one C(32), one O(10), and one O(6) atom. The C(28)-C(32) bond length is 1.51 Å. The C(28)-O(10) bond length is 1.25 Å. The C(28)-O(6) bond length is 1.30 Å. In the twenty-fourth C site, C(29) is bonded in a trigonal planar geometry to one C(25); one C(33,34); and one C(37,38) atom. The C(29)-C(33,34) bond length is 1.40 Å. The C(29)-C(37,38) bond length is 1.40 Å. In the twenty-fifth C site, C(30) is bonded in a trigonal planar geometry to one C(26); one C(33,34); and one C(37,38) atom. The C(30)-C(33,34) bond length is 1.40 Å. The C(30)-C(37,38) bond length is 1.40 Å. In the twenty-sixth C site, C(31) is bonded in a trigonal planar geometry to one C(27); one C(35,36); and one C(39,40) atom. The C(31)-C(35,36) bond length is 1.40 Å. The C(31)-C(39,40) bond length is 1.40 Å. In the twenty-seventh C site, C(32) is bonded in a trigonal planar geometry to one C(28); one C(35,36); and one C(39,40) atom. The C(32)-C(35,36) bond length is 1.40 Å. The C(32)-C(39,40) bond length is 1.40 Å. In the twenty-eighth C site, C(33,34) is bonded in a distorted trigonal planar geometry to one C(29); one C(39,40); and one H(51,52) atom. The C(33,34)-C(39,40) bond length is 1.39 Å. The C(33,34)-H(51,52) bond length is 1.09 Å. In the twenty-ninth C site, C(35,36) is bonded in a distorted trigonal planar geometry to one C(31); one C(37,38); and one H(53,54) atom. The C(35,36)-C(37,38) bond length is 1.39 Å. The C(35,36)-H(53,54) bond length is 1.09 Å. In the thirtieth C site, C(37,38) is bonded in a distorted single-bond geometry to one C(29); one C(35,36); and one H(55,56,57,58) atom. The C(37,38)-H(55,56,57,58) bond length is 1.09 Å. In the thirty-first C site, C(39,40) is bonded in a distorted single-bond geometry to one C(31); one C(33,34); and one H(55,56,57,58) atom. The C(39,40)-H(55,56,57,58) bond length is 1.09 Å. In the thirty-second C site, C(41,42) is bonded in a bent 120 degrees geometry to one C(45,46); one O(19,20); and one O(23,24) atom. The C(41,42)-C(45,46) bond length is 1.50 Å. The C(41,42)-O(19,20) bond length is 1.30 Å. The C(41,42)-O(23,24) bond length is 1.25 Å. In the thirty-third C site, C(43,44) is bonded in a bent 120 degrees geometry to one C(47,48); one O(21,22); and one O(25,26) atom. The C(43,44)-C(47,48) bond length is 1.50 Å. The C(43,44)-O(21,22) bond length is 1.30 Å. The C(43,44)-O(25,26) bond length is 1.25 Å. In the thirty-fourth C site, C(45,46) is bonded in a trigonal planar geometry to one C(41,42); one C(49,50); and one C(53,54) atom. The C(45,46)-C(49,50) bond length is 1.40 Å. The C(45,46)-C(53,54) bond length is 1.40 Å. In the thirty-fifth C site, C(47,48) is bonded in a trigonal planar geometry to one C(43,44); one C(51,52); and one C(55,56) atom. The C(47,48)-C(51,52) bond length is 1.40 Å. The C(47,48)-C(55,56) bond length is 1.40 Å. In the thirty-sixth C site, C(49,50) is bonded in a distorted single-bond geometry to one C(45,46) and one H(59,60) atom. The C(49,50)-H(59,60) bond length is 1.09 Å. In the thirty-seventh C site, C(51,52) is bonded in a distorted single-bond geometry to one C(47,48) and one H(61,62) atom. The C(51,52)-H(61,62) bond length is 1.09 Å. In the thirty-eighth C site, C(53,54) is bonded in a distorted single-bond geometry to one C(45,46) and one H(63,64) atom. The C(53,54)-H(63,64) bond length is 1.09 Å. In the thirty-ninth C site, C(55,56) is bonded in a distorted single-bond geometry to one C(47,48) and one H(65,66) atom. The C(55,56)-H(65,66) bond length is 1.09 Å. In the fortieth C site, C(57) is bonded in a distorted bent 120 degrees geometry to one C(61,62); one O(11); and one O(15) atom. The C(57)-C(61,62) bond length is 1.50 Å. The C(57)-O(11) bond length is 1.27 Å. The C(57)-O(15) bond length is 1.28 Å. In the forty-first C site, C(58) is bonded in a distorted bent 120 degrees geometry to one C(61,62); one O(12); and one O(16) atom. The C(58)-C(61,62) bond length is 1.50 Å. The C(58)-O(12) bond length is 1.27 Å. The C(58)-O(16) bond length is 1.28 Å. In the forty-second C site, C(59) is bonded in a bent 120 degrees geometry to one C(63,64); one O(13); and one O(17) atom. The C(59)-C(63,64) bond length is 1.50 Å. The C(59)-O(13) bond length is 1.27 Å. The C(59)-O(17) bond length is 1.28 Å. In the forty-third C site, C(60) is bonded in a bent 120 degrees geometry to one C(63,64); one O(14); and one O(18) atom. The C(60)-C(63,64) bond length is 1.50 Å. The C(60)-O(14) bond length is 1.27 Å. The C(60)-O(18) bond length is 1.28 Å. In the forty-fourth C site, C(61,62) is bonded in a trigonal planar geometry to one C(57), one C(65), and one C(69) atom. The C(61,62)-C(65) bond length is 1.40 Å. The C(61,62)-C(69) bond length is 1.40 Å. In the forty-fifth C site, C(63,64) is bonded in a trigonal planar geometry to one C(59); one C(67,68); and one C(71,72) atom. The C(63,64)-C(67,68) bond length is 1.40 Å. The C(63,64)-C(71,72) bond length is 1.40 Å. In the forty-sixth C site, C(65) is bonded in a distorted single-bond geometry to one C(61,62) and one H(67,68) atom. The C(65)-H(67,68) bond length is 1.09 Å. In the forty-seventh C site, C(66) is bonded in a distorted single-bond geometry to one C(61,62) and one H(67,68) atom. The C(66)-C(61,62) bond length is 1.40 Å. The C(66)-H(67,68) bond length is 1.09 Å. In the forty-eighth C site, C(67,68) is bonded in a distorted single-bond geometry to one C(63,64) and one H(69,70,73,74) atom. The C(67,68)-H(69,70,73,74) bond length is 1.09 Å. In the forty-ninth C site, C(69) is bonded in a distorted single-bond geometry to one C(61,62) and one H(71,72) atom. The C(69)-H(71,72) bond length is 1.09 Å. In the fiftieth C site, C(70) is bonded in a distorted single-bond geometry to one C(61,62) and one H(71,72) atom. The C(70)-C(61,62) bond length is 1.40 Å. The C(70)-H(71,72) bond length is 1.09 Å. In the fifty-first C site, C(71,72) is bonded in a distorted single-bond geometry to one C(63,64) and one H(69,70,73,74) atom. The C(71,72)-H(69,70,73,74) bond length is 1.09 Å. There are fifteen inequivalent N sites. In the first N site, N(1) is bonded in a distorted trigonal planar geometry to one Cu(1); one C(5,6); and one N(5,6) atom. The N(1)-N(5,6) bond length is 1.37 Å. In the second N site, N(2) is bonded in a distorted trigonal planar geometry to one Cu(2); one C(5,6); and one N(5,6) atom. The N(2)-C(5,6) bond length is 1.33 Å. The N(2)-N(5,6) bond length is 1.37 Å. In the third N site, N(3) is bonded in a distorted trigonal planar geometry to one Cu(2), one C(7), and one N(7) atom. The N(3)-N(7) bond length is 1.38 Å. In the fourth N site, N(4) is bonded in a distorted trigonal planar geometry to one Cu(1), one C(8), and one N(8) atom. The N(4)-N(8) bond length is 1.38 Å. In the fifth N site, N(5,6) is bonded in a distorted trigonal planar geometry to one Cu(3), one C(9), and one N(1) atom. In the sixth N site, N(7) is bonded in a 3-coordinate geometry to one Cu(5), one C(11), and one N(3) atom. In the seventh N site, N(8) is bonded in a 3-coordinate geometry to one Cu(6), one C(12), and one N(4) atom. In the eighth N site, N(9,10) is bonded in a trigonal planar geometry to one Cu(9); one C(5,6); and one C(9) atom. In the ninth N site, N(11,12) is bonded in a trigonal planar geometry to one Cu(9), one C(11), and one C(7) atom. In the tenth N site, N(13) is bonded in a distorted trigonal planar geometry to one Cu(3), one C(17), and one N(16) atom. The N(13)-N(16) bond length is 1.37 Å. In the eleventh N site, N(14) is bonded in a distorted trigonal planar geometry to one Cu(4), one C(18), and one N(15) atom. The N(14)-N(15) bond length is 1.37 Å. In the twelfth N site, N(15) is bonded in a distorted trigonal planar geometry to one Cu(5), one C(19), and one N(14) atom. In the thirteenth N site, N(16) is bonded in a distorted trigonal planar geometry to one Cu(6), one C(20), and one N(13) atom. In the fourteenth N site, N(17) is bonded in a trigonal planar geometry to one Cu(7), one C(17), and one C(20) atom. In the fifteenth N site, N(18) is bonded in a trigonal planar geometry to one Cu(8), one C(18), and one C(19) atom. There are forty inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(1) atom. The H(1)-O(1) bond length is 0.98 Å. In the second H site, H(2) is bonded in a single-bond geometry to one O(2) atom. The H(2)-O(2) bond length is 0.98 Å. In the third H site, H(3) is bonded in a 2-coordinate geometry to one O(27) and one O(33) atom. The H(3)-O(27) bond length is 1.02 Å. The H(3)-O(33) bond length is 1.61 Å. In the fourth H site, H(4) is bonded in a 2-coordinate geometry to one O(28) and one O(34) atom. The H(4)-O(28) bond length is 1.02 Å. The H(4)-O(34) bond length is 1.62 Å. In the fifth H site, H(5,6) is bonded in a single-bond geometry to one O(27) atom. The H(5,6)-O(27) bond length is 0.97 Å. In the sixth H site, H(15,16) is bonded in a single-bond geometry to one C(1,2) atom. In the seventh H site, H(17) is bonded in a single-bond geometry to one C(3,4) atom. In the eighth H site, H(18) is bonded in a single-bond geometry to one C(3,4) atom. The H(18)-C(3,4) bond length is 1.10 Å. In the ninth H site, H(19,20) is bonded in a single-bond geometry to one C(1,2) atom. In the tenth H site, H(21) is bonded in a single-bond geometry to one C(3,4) atom. In the eleventh H site, H(22) is bonded in a single-bond geometry to one C(3,4) atom. The H(22)-C(3,4) bond length is 1.10 Å. In the twelfth H site, H(23,24) is bonded in a single-bond geometry to one C(1,2) atom. In the thirteenth H site, H(25) is bonded in a single-bond geometry to one C(3,4) atom. In the fourteenth H site, H(26) is bonded in a single-bond geometry to one C(3,4) atom. The H(26)-C(3,4) bond length is 1.10 Å. In the fifteenth H site, H(27,28) is bonded in a single-bond geometry to one C(13,14) atom. In the sixteenth H site, H(29,30) is bonded in a single-bond geometry to one C(15,16) atom. In the seventeenth H site, H(31,32) is bonded in a single-bond geometry to one C(13,14) atom. In the eighteenth H site, H(33,34) is bonded in a single-bond geometry to one C(15,16) atom. In the nineteenth H site, H(35,36) is bonded in a single-bond geometry to one C(13,14) atom. In the twentieth H site, H(37,38) is bonded in a single-bond geometry to one C(15,16) atom. In the twenty-first H site, H(39,40) is bonded in a single-bond geometry to one C(21) atom. In the twenty-second H site, H(41,42) is bonded in a single-bond geometry to one C(23) atom. In the twenty-third H site, H(43,44) is bonded in a single-bond geometry to one C(21) atom. In the twenty-fourth H site, H(45,46) is bonded in a single-bond geometry to one C(23) atom. In the twenty-fifth H site, H(47,48) is bonded in a single-bond geometry to one C(21) atom. In the twenty-sixth H site, H(49,50) is bonded in a single-bond geometry to one C(23) atom. In the twenty-seventh H site, H(51,52) is bonded in a single-bond geometry to one C(33,34) atom. In the twenty-eighth H site, H(53,54) is bonded in a single-bond geometry to one C(35,36) atom. In the twenty-ninth H site, H(55,56,57,58) is bonded in a single-bond geometry to one C(37,38) atom. In the thirtieth H site, H(59,60) is bonded in a single-bond geometry to one C(49,50) atom. In the thirty-first H site, H(61,62) is bonded in a single-bond geometry to one C(51,52) atom. In the thirty-second H site, H(63,64) is bonded in a single-bond geometry to one C(53,54) atom. In the thirty-third H site, H(65,66) is bonded in a single-bond geometry to one C(55,56) atom. In the thirty-fourth H site, H(67,68) is bonded in a single-bond geometry to one C(65) atom. In the thirty-fifth H site, H(69,70,73,74) is bonded in a single-bond geometry to one C(67,68) atom. In the thirty-sixth H site, H(71,72) is bonded in a single-bond geometry to one C(69) atom. In the thirty-seventh H site, H(75) is bonded in a single-bond geometry to one O(33) atom. The H(75)-O(33) bond length is 1.00 Å. In the thirty-eighth H site, H(76) is bonded in a single-bond geometry to one O(34) atom. The H(76)-O(34) bond length is 1.00 Å. In the thirty-ninth H site, H(77) is bonded in a single-bond geometry to one O(33) atom. The H(77)-O(33) bond length is 1.00 Å. In the fortieth H site, H(78) is bonded in a single-bond geometry to one O(34) atom. The H(78)-O(34) bond length is 1.00 Å. There are twenty-six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Cu(1), one Cu(3), one Cu(6), and one H(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Cu(2), one Cu(4), one Cu(5), and one H(2) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Cu(3) and one C(25) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Cu(4) and one C(26) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one Cu(5) and one C(27) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Cu(6) and one C(28) atom. In the seventh O site, O(7) is bonded in a single-bond geometry to one C(25) atom. In the eighth O site, O(8) is bonded in a single-bond geometry to one C(26) atom. In the ninth O site, O(9) is bonded in a single-bond geometry to one C(27) atom. In the tenth O site, O(10) is bonded in a single-bond geometry to one C(28) atom. In the eleventh O site, O(11) is bonded in a bent 120 degrees geometry to one Cu(7) and one C(57) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one Cu(8) and one C(58) atom. In the thirteenth O site, O(13) is bonded in a bent 120 degrees geometry to one Cu(8) and one C(59) atom. In the fourteenth O site, O(14) is bonded in a bent 120 degrees geometry to one Cu(7) and one C(60) atom. In the fifteenth O site, O(15) is bonded in a bent 120 degrees geometry to one Cu(8) and one C(57) atom. In the sixteenth O site, O(16) is bonded in a bent 120 degrees geometry to one Cu(7) and one C(58) atom. In the seventeenth O site, O(17) is bonded in a bent 120 degrees geometry to one Cu(7) and one C(59) atom. In the eighteenth O site, O(18) is bonded in a bent 120 degrees geometry to one Cu(8) and one C(60) atom. In the nineteenth O site, O(19,20) is bonded in a water-like geometry to one Cu(9) and one C(41,42) atom. In the twentieth O site, O(21,22) is bonded in a water-like geometry to one Cu(9) and one C(43,44) atom. In the twenty-first O site, O(23,24) is bonded in a single-bond geometry to one C(41,42) atom. In the twenty-second O site, O(25,26) is bonded in a single-bond geometry to one C(43,44) atom. In the twenty-third O site, O(27) is bonded in a distorted trigonal non-coplanar geometry to one Cu(1); one H(3); and one H(5,6) atom. In the twenty-fourth O site, O(28) is bonded in a trigonal non-coplanar geometry to one Cu(2); one H(4); and one H(5,6) atom. The O(28)-H(5,6) bond length is 0.97 Å. In the twenty-fifth O site, O(33) is bonded in a distorted trigonal planar geometry to one H(3), one H(75), and one H(77) atom. In the twenty-sixth O site, O(34) is bonded in a distorted trigonal planar geometry to one H(4), one H(76), and one H(78) atom. Linkers: 2 Cc1nnc(C)n1[Cu](OC(=O)c1ccc(C([O])=O)cc1)(OC(=O)c1ccc(C([O])=O)cc1)n1c(C)nnc1C ,2 [O]C(=O)c1ccc(C([O])=O)cc1 ,2 CC1=NN=C(C)[N]1. Metal clusters: 2 O.O=[C]O[Cu]1[N]N=[Cu@@](O)(O[C]=O)/N=N\[Cu]/N=N\1 ,1 [C]1O[Cu]234O[C]O[Cu]2(O1)(O[C]O3)O[C]O4. The MOF has largest included sphere 9.29 A, density 0.85 g/cm3, surface area 4284.27 m2/g, accessible volume 0.73 cm3/g