Cu2C57H32(N3O2)4(CH)4 crystallizes in the tetragonal P4_22_12 space group. The structure consists of sixteen 02329_fluka molecules inside a Cu2C57H32(N3O2)4 framework. In each Cu2C57H32(N3O2)4 framework, Cu(1) is bonded in a distorted rectangular see-saw-like geometry to one O(1), one O(2), one O(3), and one O(4) atom. The Cu(1)-O(1) bond length is 1.94 Å. The Cu(1)-O(2) bond length is 1.95 Å. The Cu(1)-O(3) bond length is 1.95 Å. The Cu(1)-O(4) bond length is 1.97 Å. There are twenty-nine inequivalent C sites. In the first C site, C(31) is bonded in a tetrahedral geometry to two equivalent C(1) and two equivalent C(2) atoms. Both C(31)-C(1) bond lengths are 1.55 Å. Both C(31)-C(2) bond lengths are 1.54 Å. In the second C site, C(1) is bonded in a trigonal planar geometry to one C(18), one C(31), and one C(8) atom. The C(1)-C(18) bond length is 1.36 Å. The C(1)-C(8) bond length is 1.36 Å. In the third C site, C(2) is bonded in a trigonal planar geometry to one C(12), one C(31), and one C(7) atom. The C(2)-C(12) bond length is 1.38 Å. The C(2)-C(7) bond length is 1.44 Å. In the fourth C site, C(3) is bonded in a trigonal planar geometry to one C(13), one C(20), and one C(9) atom. The C(3)-C(13) bond length is 1.36 Å. The C(3)-C(20) bond length is 1.40 Å. The C(3)-C(9) bond length is 1.52 Å. In the fifth C site, C(4) is bonded in a trigonal planar geometry to one C(16), one C(17), and one C(5) atom. The C(4)-C(16) bond length is 1.37 Å. The C(4)-C(17) bond length is 1.39 Å. The C(4)-C(5) bond length is 1.46 Å. In the sixth C site, C(5) is bonded in a distorted trigonal planar geometry to one C(11), one C(4), and one N(3) atom. The C(5)-C(11) bond length is 1.37 Å. The C(5)-N(3) bond length is 1.38 Å. In the seventh C site, C(6) is bonded in a trigonal planar geometry to one C(10), one C(14), and one C(23) atom. The C(6)-C(10) bond length is 1.40 Å. The C(6)-C(14) bond length is 1.37 Å. The C(6)-C(23) bond length is 1.47 Å. In the eighth C site, C(7) is bonded in a distorted single-bond geometry to one C(10), one C(2), and one H(1) atom. The C(7)-C(10) bond length is 1.39 Å. The C(7)-H(1) bond length is 0.93 Å. In the ninth C site, C(8) is bonded in a distorted single-bond geometry to one C(1), one C(17), and one H(2) atom. The C(8)-C(17) bond length is 1.39 Å. The C(8)-H(2) bond length is 0.93 Å. In the tenth C site, C(9) is bonded in a distorted bent 120 degrees geometry to one C(3), one O(1), and one O(2) atom. The C(9)-O(1) bond length is 1.26 Å. The C(9)-O(2) bond length is 1.26 Å. In the eleventh C site, C(10) is bonded in a distorted trigonal planar geometry to one C(6), one C(7), and one H(3) atom. The C(10)-H(3) bond length is 0.93 Å. In the twelfth C site, C(11) is bonded in a 3-coordinate geometry to one C(5), one N(1), and one H(4) atom. The C(11)-N(1) bond length is 1.38 Å. The C(11)-H(4) bond length is 0.93 Å. In the thirteenth C site, C(12) is bonded in a distorted single-bond geometry to one C(2) and one H(5) atom. The C(12)-H(5) bond length is 0.93 Å. In the fourteenth C site, C(13) is bonded in a distorted single-bond geometry to one C(3) and one H(6) atom. The C(13)-H(6) bond length is 0.93 Å. In the fifteenth C site, C(14) is bonded in a distorted single-bond geometry to one C(6) and one H(7) atom. The C(14)-H(7) bond length is 0.93 Å. In the sixteenth C site, C(15) is bonded in a distorted bent 120 degrees geometry to one C(23), one N(2), and one H(8) atom. The C(15)-C(23) bond length is 1.32 Å. The C(15)-N(2) bond length is 1.29 Å. The C(15)-H(8) bond length is 0.93 Å. In the seventeenth C site, C(16) is bonded in a distorted trigonal planar geometry to one C(18), one C(4), and one H(9) atom. The C(16)-C(18) bond length is 1.38 Å. The C(16)-H(9) bond length is 0.93 Å. In the eighteenth C site, C(17) is bonded in a distorted trigonal planar geometry to one C(4), one C(8), and one H(10) atom. The C(17)-H(10) bond length is 0.93 Å. In the nineteenth C site, C(18) is bonded in a distorted single-bond geometry to one C(1), one C(16), and one H(11) atom. The C(18)-H(11) bond length is 0.93 Å. In the twentieth C site, C(19) is bonded in a distorted single-bond geometry to one C(21) and one N(1) atom. The C(19)-C(21) bond length is 1.36 Å. The C(19)-N(1) bond length is 1.44 Å. In the twenty-first C site, C(20) is bonded in a distorted single-bond geometry to one C(21), one C(3), and one H(12) atom. The C(20)-C(21) bond length is 1.35 Å. The C(20)-H(12) bond length is 0.93 Å. In the twenty-second C site, C(21) is bonded in a distorted trigonal planar geometry to one C(19), one C(20), and one H(13) atom. The C(21)-H(13) bond length is 0.93 Å. In the twenty-third C site, C(23) is bonded in a distorted trigonal planar geometry to one C(15), one C(6), and one N(5) atom. The C(23)-N(5) bond length is 1.30 Å. In the twenty-fourth C site, C(24) is bonded in a single-bond geometry to one C(25) and one N(2) atom. The C(24)-C(25) bond length is 1.30 Å. The C(24)-N(2) bond length is 1.48 Å. In the twenty-fifth C site, C(25) is bonded in a distorted trigonal planar geometry to one C(24), one C(26), and one H(15) atom. The C(25)-C(26) bond length is 1.41 Å. The C(25)-H(15) bond length is 0.93 Å. In the twenty-sixth C site, C(26) is bonded in a distorted single-bond geometry to one C(25), one C(29), and one H(16) atom. The C(26)-C(29) bond length is 1.38 Å. The C(26)-H(16) bond length is 0.93 Å. In the twenty-seventh C site, C(28) is bonded in a distorted single-bond geometry to one C(29) and one H(18) atom. The C(28)-C(29) bond length is 1.35 Å. The C(28)-H(18) bond length is 0.93 Å. In the twenty-eighth C site, C(29) is bonded in a trigonal planar geometry to one C(26), one C(28), and one C(30) atom. The C(29)-C(30) bond length is 1.50 Å. In the twenty-ninth C site, C(30) is bonded in a distorted bent 120 degrees geometry to one C(29), one O(3), and one O(4) atom. The C(30)-O(3) bond length is 1.25 Å. The C(30)-O(4) bond length is 1.27 Å. There are six inequivalent N sites. In the first N site, N(1) is bonded in a distorted trigonal planar geometry to one C(11), one C(19), and one N(4) atom. The N(1)-N(4) bond length is 1.37 Å. In the second N site, N(2) is bonded in a distorted trigonal planar geometry to one C(15), one C(24), and one N(6) atom. The N(2)-N(6) bond length is 1.30 Å. In the third N site, N(3) is bonded in a distorted water-like geometry to one C(5) and one N(4) atom. The N(3)-N(4) bond length is 1.32 Å. In the fourth N site, N(4) is bonded in a water-like geometry to one N(1) and one N(3) atom. In the fifth N site, N(5) is bonded in a distorted single-bond geometry to one C(23) and one N(6) atom. The N(5)-N(6) bond length is 1.31 Å. In the sixth N site, N(6) is bonded in a water-like geometry to one N(2) and one N(5) atom. There are sixteen inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(7) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(8) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(10) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(11) 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(14) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one C(15) atom. In the ninth H site, H(9) is bonded in a single-bond geometry to one C(16) 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(18) atom. In the twelfth H site, H(12) is bonded in a single-bond geometry to one C(20) atom. In the thirteenth H site, H(13) is bonded in a single-bond geometry to one C(21) atom. In the fourteenth H site, H(15) is bonded in a single-bond geometry to one C(25) atom. In the fifteenth H site, H(16) is bonded in a single-bond geometry to one C(26) atom. In the sixteenth H site, H(18) is bonded in a single-bond geometry to one C(28) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(9) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(9) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(30) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(30) atom. Linkers: 4 [O]C(=O)c1ccc(-n2cc(-c3ccc(C(c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)(c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)cc3)nn2)cc1 ,4 [O]C(=O)c1ccc(-n2cc(-c3ccc(C(c4ccc(-c5cn(-c6c[c]c([C]=O)cc6)nn5)cc4)(c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)cc3)nn2)cc1 ,4 [O]C(=O)c1ccc(-n2cc(-c3ccc(C(c4ccc(-c5cn(-c6ccc([C]=O)cc6)nn5)cc4)(c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)c4ccc(-c5cn(-c6ccc(C([O])=O)cc6)nn5)cc4)cc3)nn2)cc1. Metal clusters: 4 [C]1O[Cu]234O[C]O[Cu]2(O1)(O[C]O3)O[C]O4. The MOF has largest included sphere 7.96 A, density 0.70 g/cm3, surface area 4637.83 m2/g, accessible volume 1.03 cm3/g