CH(CH3)2Cd2B2C61N8H49(O2F)4 crystallizes in the triclinic P1 space group. The structure consists of three 02329_fluka molecules and six 02329_fluka molecules inside a Cd2B2C61N8H49(O2F)4 framework. In the Cd2B2C61N8H49(O2F)4 framework, there are six inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 6-coordinate geometry to two equivalent N(1,7); one O(1,5,9,13,17,21); one O(2,6,10,14,18,22); one O(3,7,11,15,19,23); and one O(4,8,12,16,24) atom. Both Cd(1)-N(1,7) bond lengths are 2.32 Å. The Cd(1)-O(1,5,9,13,17,21) bond length is 2.45 Å. The Cd(1)-O(2,6,10,14,18,22) bond length is 2.33 Å. The Cd(1)-O(3,7,11,15,19,23) bond length is 2.29 Å. The Cd(1)-O(4,8,12,16,24) bond length is 2.29 Å. In the second Cd site, Cd(2) is bonded in a 6-coordinate geometry to two equivalent N(3,9); one O(1,5,9,13,17,21); one O(2,6,10,14,18,22); one O(3,7,11,15,19,23); and one O(4,8,12,16,24) atom. Both Cd(2)-N(3,9) bond lengths are 2.32 Å. The Cd(2)-O(1,5,9,13,17,21) bond length is 2.45 Å. The Cd(2)-O(2,6,10,14,18,22) bond length is 2.33 Å. The Cd(2)-O(3,7,11,15,19,23) bond length is 2.29 Å. The Cd(2)-O(4,8,12,16,24) bond length is 2.29 Å. In the third Cd site, Cd(3) is bonded in a 6-coordinate geometry to two equivalent N(5,11); one O(1,5,9,13,17,21); one O(2,6,10,14,18,22); one O(20); and one O(3,7,11,15,19,23) atom. Both Cd(3)-N(5,11) bond lengths are 2.32 Å. The Cd(3)-O(1,5,9,13,17,21) bond length is 2.45 Å. The Cd(3)-O(2,6,10,14,18,22) bond length is 2.33 Å. The Cd(3)-O(20) bond length is 2.29 Å. The Cd(3)-O(3,7,11,15,19,23) bond length is 2.29 Å. In the fourth Cd site, Cd(4) is bonded in a 6-coordinate geometry to two equivalent N(13,17,19,23); one O(1,5,9,13,17,21); one O(2,6,10,14,18,22); one O(3,7,11,15,19,23); and one O(4,8,12,16,24) atom. Both Cd(4)-N(13,17,19,23) bond lengths are 2.32 Å. The Cd(4)-O(1,5,9,13,17,21) bond length is 2.45 Å. The Cd(4)-O(2,6,10,14,18,22) bond length is 2.33 Å. The Cd(4)-O(3,7,11,15,19,23) bond length is 2.29 Å. The Cd(4)-O(4,8,12,16,24) bond length is 2.29 Å. In the fifth Cd site, Cd(5) is bonded in a 6-coordinate geometry to two equivalent N(15,21); one O(1,5,9,13,17,21); one O(2,6,10,14,18,22); one O(3,7,11,15,19,23); and one O(4,8,12,16,24) atom. Both Cd(5)-N(15,21) bond lengths are 2.32 Å. The Cd(5)-O(1,5,9,13,17,21) bond length is 2.45 Å. The Cd(5)-O(2,6,10,14,18,22) bond length is 2.33 Å. The Cd(5)-O(3,7,11,15,19,23) bond length is 2.29 Å. The Cd(5)-O(4,8,12,16,24) bond length is 2.29 Å. In the sixth Cd site, Cd(6) is bonded in a 6-coordinate geometry to two equivalent N(13,17,19,23); one O(1,5,9,13,17,21); one O(2,6,10,14,18,22); one O(3,7,11,15,19,23); and one O(4,8,12,16,24) atom. Both Cd(6)-N(13,17,19,23) bond lengths are 2.32 Å. The Cd(6)-O(1,5,9,13,17,21) bond length is 2.45 Å. The Cd(6)-O(2,6,10,14,18,22) bond length is 2.33 Å. The Cd(6)-O(3,7,11,15,19,23) bond length is 2.29 Å. The Cd(6)-O(4,8,12,16,24) bond length is 2.29 Å. There are six inequivalent B sites. In the first B site, B(1) is bonded in a tetrahedral geometry to two equivalent N(2,8); one F(1,5,9); and one F(2,6,10) atom. Both B(1)-N(2,8) bond lengths are 1.46 Å. The B(1)-F(1,5,9) bond length is 1.39 Å. The B(1)-F(2,6,10) bond length is 1.59 Å. In the second B site, B(2) is bonded in a tetrahedral geometry to two equivalent N(4,10); one F(3,7,11); and one F(4,8,12) atom. Both B(2)-N(4,10) bond lengths are 1.46 Å. The B(2)-F(3,7,11) bond length is 1.39 Å. The B(2)-F(4,8,12) bond length is 1.59 Å. In the third B site, B(3) is bonded in a tetrahedral geometry to two equivalent N(6,12); one F(1,5,9); and one F(2,6,10) atom. Both B(3)-N(6,12) bond lengths are 1.46 Å. The B(3)-F(1,5,9) bond length is 1.39 Å. The B(3)-F(2,6,10) bond length is 1.59 Å. In the fourth B site, B(4) is bonded in a tetrahedral geometry to two equivalent N(14,20); one F(3,7,11); and one F(4,8,12) atom. Both B(4)-N(14,20) bond lengths are 1.46 Å. The B(4)-F(3,7,11) bond length is 1.39 Å. The B(4)-F(4,8,12) bond length is 1.59 Å. In the fifth B site, B(5) is bonded in a tetrahedral geometry to two equivalent N(16,22); one F(1,5,9); and one F(2,6,10) atom. Both B(5)-N(16,22) bond lengths are 1.46 Å. The B(5)-F(1,5,9) bond length is 1.39 Å. The B(5)-F(2,6,10) bond length is 1.59 Å. In the sixth B site, B(6) is bonded in a tetrahedral geometry to two equivalent N(18,24); one F(3,7,11); and one F(4,8,12) atom. Both B(6)-N(18,24) bond lengths are 1.46 Å. The B(6)-F(3,7,11) bond length is 1.39 Å. The B(6)-F(4,8,12) bond length is 1.59 Å. There are ninety-four inequivalent C sites. In the first C site, C(1) is bonded in a single-bond geometry to one C(16), one C(49), and one H(1) atom. The C(1)-C(16) bond length is 1.51 Å. The C(1)-C(49) bond length is 1.51 Å. The C(1)-H(1) bond length is 1.14 Å. In the second C site, C(5) is bonded in a single-bond geometry to one C(38), one C(71), and one H(3) atom. The C(5)-C(38) bond length is 1.51 Å. The C(5)-C(71) bond length is 1.51 Å. The C(5)-H(3) bond length is 1.14 Å. In the third C site, C(7,40) is bonded in a distorted bent 120 degrees geometry to one C(9,42); one N(1,7); and one H(4,40) atom. The C(7,40)-C(9,42) bond length is 1.36 Å. The C(7,40)-N(1,7) bond length is 1.31 Å. The C(7,40)-H(4,40) bond length is 1.14 Å. In the fourth C site, C(8,41) is bonded in a distorted bent 120 degrees geometry to one N(1,7) and one H(34,35,36,37,38,39,88,89,90,151,152,153) atom. The C(8,41)-N(1,7) bond length is 1.33 Å. The C(8,41)-H(34,35,36,37,38,39,88,89,90,151,152,153) bond length is 1.14 Å. In the fifth C site, C(9,42) is bonded in a distorted trigonal planar geometry to one C(11,44); one C(7,40); and one H(5,41) atom. The C(9,42)-C(11,44) bond length is 1.32 Å. The C(9,42)-H(5,41) bond length is 1.14 Å. In the sixth C site, C(10,43) is bonded in a distorted single-bond geometry to one C(11,44) and one H(6,42) atom. The C(10,43)-C(11,44) bond length is 1.37 Å. The C(10,43)-H(6,42) bond length is 1.14 Å. In the seventh C site, C(11,44) is bonded in a trigonal planar geometry to one C(10,43); one C(12); and one C(9,42) atom. The C(11,44)-C(12) bond length is 1.50 Å. In the eighth C site, C(12) is bonded in a trigonal planar geometry to one C(11,44); one C(13,46); and one C(14) atom. The C(12)-C(13,46) bond length is 1.30 Å. The C(12)-C(14) bond length is 1.36 Å. In the ninth C site, C(13,46) is bonded in a distorted trigonal planar geometry to one C(12); one C(15,48); and one N(2,8) atom. The C(13,46)-C(15,48) bond length is 1.55 Å. The C(13,46)-N(2,8) bond length is 1.39 Å. In the tenth C site, C(14) is bonded in a trigonal planar geometry to one C(12), one C(16), and one C(17) atom. The C(14)-C(16) bond length is 1.36 Å. The C(14)-C(17) bond length is 1.54 Å. In the eleventh C site, C(15,48) is bonded in a trigonal non-coplanar geometry to one C(13,46) and three equivalent H(7,8,9,43,44,45) atoms. All C(15,48)-H(7,8,9,43,44,45) bond lengths are 1.14 Å. In the twelfth C site, C(16) is bonded in a distorted single-bond geometry to one C(1); one C(14); and one N(2,8) atom. The C(16)-N(2,8) bond length is 1.31 Å. In the thirteenth C site, C(17) is bonded in a distorted trigonal non-coplanar geometry to one C(14) and three equivalent H(10,11,12) atoms. All C(17)-H(10,11,12) bond lengths are 1.14 Å. In the fourteenth C site, C(18,51) is bonded in a distorted bent 120 degrees geometry to one C(20,53); one N(3,9); and one H(14,50) atom. The C(18,51)-C(20,53) bond length is 1.36 Å. The C(18,51)-N(3,9) bond length is 1.31 Å. The C(18,51)-H(14,50) bond length is 1.14 Å. In the fifteenth C site, C(19,52) is bonded in a distorted bent 120 degrees geometry to one N(3,9) and one H(34,35,36,37,38,39,88,89,90,151,152,153) atom. The C(19,52)-N(3,9) bond length is 1.33 Å. The C(19,52)-H(34,35,36,37,38,39,88,89,90,151,152,153) bond length is 1.14 Å. In the sixteenth C site, C(20,53) is bonded in a distorted trigonal planar geometry to one C(18,51); one C(22,55); and one H(15,51) atom. The C(20,53)-C(22,55) bond length is 1.32 Å. The C(20,53)-H(15,51) bond length is 1.14 Å. In the seventeenth C site, C(21,54) is bonded in a distorted single-bond geometry to one C(22,55) and one H(16,52) atom. The C(21,54)-C(22,55) bond length is 1.37 Å. The C(21,54)-H(16,52) bond length is 1.14 Å. In the eighteenth C site, C(22,55) is bonded in a trigonal planar geometry to one C(20,53); one C(21,54); and one C(23,56) atom. The C(22,55)-C(23,56) bond length is 1.50 Å. In the nineteenth C site, C(23,56) is bonded in a trigonal planar geometry to one C(22,55); one C(24,57); and one C(25) atom. The C(23,56)-C(24,57) bond length is 1.30 Å. The C(23,56)-C(25) bond length is 1.36 Å. In the twentieth C site, C(24,57) is bonded in a distorted trigonal planar geometry to one C(23,56); one C(26,59); and one N(4,10) atom. The C(24,57)-C(26,59) bond length is 1.55 Å. The C(24,57)-N(4,10) bond length is 1.39 Å. In the twenty-first C site, C(25) is bonded in a trigonal planar geometry to one C(23,56); one C(27,60); and one C(28,61) atom. The C(25)-C(27,60) bond length is 1.36 Å. The C(25)-C(28,61) bond length is 1.54 Å. In the twenty-second C site, C(26,59) is bonded in a trigonal non-coplanar geometry to one C(24,57) and three equivalent H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) atoms. All C(26,59)-H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) bond lengths are 1.14 Å. In the twenty-third C site, C(27,60) is bonded in a distorted single-bond geometry to one C(25) and one N(4,10) atom. The C(27,60)-N(4,10) bond length is 1.31 Å. In the twenty-fourth C site, C(28,61) is bonded in a trigonal non-coplanar geometry to one C(25), one H(20), one H(21), and one H(22) atom. The C(28,61)-H(20) bond length is 1.14 Å. The C(28,61)-H(21) bond length is 1.14 Å. The C(28,61)-H(22) bond length is 1.14 Å. In the twenty-fifth C site, C(29,62) is bonded in a distorted bent 120 degrees geometry to one C(31,64); one N(5,11); and one H(24,60) atom. The C(29,62)-C(31,64) bond length is 1.36 Å. The C(29,62)-N(5,11) bond length is 1.31 Å. The C(29,62)-H(24,60) bond length is 1.14 Å. In the twenty-sixth C site, C(30,63) is bonded in a distorted bent 120 degrees geometry to one N(5,11) and one H(34,35,36,37,38,39,88,89,90,151,152,153) atom. The C(30,63)-N(5,11) bond length is 1.33 Å. The C(30,63)-H(34,35,36,37,38,39,88,89,90,151,152,153) bond length is 1.14 Å. In the twenty-seventh C site, C(31,64) is bonded in a distorted trigonal planar geometry to one C(29,62); one C(33,66); and one H(25,61) atom. The C(31,64)-C(33,66) bond length is 1.32 Å. The C(31,64)-H(25,61) bond length is 1.14 Å. In the twenty-eighth C site, C(32,65) is bonded in a distorted single-bond geometry to one C(33,66) and one H(26,62) atom. The C(32,65)-C(33,66) bond length is 1.37 Å. The C(32,65)-H(26,62) bond length is 1.14 Å. In the twenty-ninth C site, C(33,66) is bonded in a trigonal planar geometry to one C(31,64); one C(32,65); and one C(34) atom. The C(33,66)-C(34) bond length is 1.50 Å. In the thirtieth C site, C(34) is bonded in a trigonal planar geometry to one C(33,66); one C(35,68); and one C(36,69) atom. The C(34)-C(35,68) bond length is 1.30 Å. The C(34)-C(36,69) bond length is 1.36 Å. In the thirty-first C site, C(35,68) is bonded in a distorted trigonal planar geometry to one C(34); one C(37,70); and one N(6,12) atom. The C(35,68)-C(37,70) bond length is 1.55 Å. The C(35,68)-N(6,12) bond length is 1.39 Å. In the thirty-second C site, C(36,69) is bonded in a trigonal planar geometry to one C(34), one C(38), and one C(39) atom. The C(36,69)-C(38) bond length is 1.36 Å. The C(36,69)-C(39) bond length is 1.54 Å. In the thirty-third C site, C(37,70) is bonded in a trigonal non-coplanar geometry to one C(35,68) and three equivalent H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) atoms. All C(37,70)-H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) bond lengths are 1.14 Å. In the thirty-fourth C site, C(38) is bonded in a distorted single-bond geometry to one C(36,69); one C(5); and one N(6,12) atom. The C(38)-N(6,12) bond length is 1.31 Å. In the thirty-fifth C site, C(39) is bonded in a trigonal non-coplanar geometry to one C(36,69) and three equivalent H(30,31,32,66,67,68) atoms. All C(39)-H(30,31,32,66,67,68) bond lengths are 1.14 Å. In the thirty-sixth C site, C(45) is bonded in a trigonal planar geometry to one C(11,44); one C(13,46); and one C(47) atom. The C(45)-C(11,44) bond length is 1.50 Å. The C(45)-C(13,46) bond length is 1.30 Å. The C(45)-C(47) bond length is 1.36 Å. In the thirty-seventh C site, C(47) is bonded in a trigonal planar geometry to one C(45), one C(49), and one C(50) atom. The C(47)-C(49) bond length is 1.36 Å. The C(47)-C(50) bond length is 1.54 Å. In the thirty-eighth C site, C(49) is bonded in a distorted single-bond geometry to one C(1); one C(47); and one N(2,8) atom. The C(49)-N(2,8) bond length is 1.31 Å. In the thirty-ninth C site, C(50) is bonded in a trigonal non-coplanar geometry to one C(47), one H(46), one H(47), and one H(48) atom. The C(50)-H(46) bond length is 1.14 Å. The C(50)-H(47) bond length is 1.14 Å. The C(50)-H(48) bond length is 1.14 Å. In the fortieth C site, C(58) is bonded in a trigonal planar geometry to one C(23,56); one C(27,60); and one C(28,61) atom. The C(58)-C(23,56) bond length is 1.36 Å. The C(58)-C(27,60) bond length is 1.36 Å. The C(58)-C(28,61) bond length is 1.54 Å. In the forty-first C site, C(67) is bonded in a trigonal planar geometry to one C(33,66); one C(35,68); and one C(36,69) atom. The C(67)-C(33,66) bond length is 1.50 Å. The C(67)-C(35,68) bond length is 1.30 Å. The C(67)-C(36,69) bond length is 1.36 Å. In the forty-second C site, C(71) is bonded in a distorted single-bond geometry to one C(36,69); one C(5); and one N(6,12) atom. The C(71)-C(36,69) bond length is 1.36 Å. The C(71)-N(6,12) bond length is 1.31 Å. In the forty-third C site, C(72) is bonded in a distorted trigonal non-coplanar geometry to one C(36,69) and three equivalent H(30,31,32,66,67,68) atoms. The C(72)-C(36,69) bond length is 1.54 Å. All C(72)-H(30,31,32,66,67,68) bond lengths are 1.14 Å. In the forty-fourth C site, C(73,81,89,169,177) is bonded in a bent 120 degrees geometry to one C(74,82,90,170,178,186); one O(1,5,9,13,17,21); and one O(2,6,10,14,18,22) atom. The C(73,81,89,169,177)-C(74,82,90,170,178,186) bond length is 1.50 Å. The C(73,81,89,169,177)-O(1,5,9,13,17,21) bond length is 1.24 Å. The C(73,81,89,169,177)-O(2,6,10,14,18,22) bond length is 1.22 Å. In the forty-fifth C site, C(74,82,90,170,178,186) is bonded in a trigonal planar geometry to one C(73,81,89,169,177); one C(75,83,91,171,179); and one C(76,84,92,172,180) atom. The C(74,82,90,170,178,186)-C(75,83,91,171,179) bond length is 1.38 Å. The C(74,82,90,170,178,186)-C(76,84,92,172,180) bond length is 1.40 Å. In the forty-sixth C site, C(75,83,91,171,179) is bonded in a distorted trigonal planar geometry to one C(74,82,90,170,178,186); one C(77,85,93,173,181,189); and one H(70,74,78,154,158,162) atom. The C(75,83,91,171,179)-C(77,85,93,173,181,189) bond length is 1.40 Å. The C(75,83,91,171,179)-H(70,74,78,154,158,162) bond length is 1.14 Å. In the forty-seventh C site, C(76,84,92,172,180) is bonded in a distorted trigonal planar geometry to one C(74,82,90,170,178,186); one C(78,86,94,174,182,190); and one H(71,75,79,155,159,163) atom. The C(76,84,92,172,180)-C(78,86,94,174,182,190) bond length is 1.42 Å. The C(76,84,92,172,180)-H(71,75,79,155,159,163) bond length is 1.14 Å. In the forty-eighth C site, C(77,85,93,173,181,189) is bonded in a distorted single-bond geometry to one C(75,83,91,171,179); one C(79,87,95,175,183,191); and one H(72,76,80,156,160,164) atom. The C(77,85,93,173,181,189)-C(79,87,95,175,183,191) bond length is 1.38 Å. The C(77,85,93,173,181,189)-H(72,76,80,156,160,164) bond length is 1.14 Å. In the forty-ninth C site, C(78,86,94,174,182,190) is bonded in a distorted single-bond geometry to one C(76,84,92,172,180); one C(79,87,95,175,183,191); and one H(73,77,81,157,161,165) atom. The C(78,86,94,174,182,190)-C(79,87,95,175,183,191) bond length is 1.37 Å. The C(78,86,94,174,182,190)-H(73,77,81,157,161,165) bond length is 1.14 Å. In the fiftieth C site, C(79,87,95,175,183,191) is bonded in a trigonal planar geometry to one C(77,85,93,173,181,189); one C(78,86,94,174,182,190); and one C(80,88,96,176,184,192) atom. The C(79,87,95,175,183,191)-C(80,88,96,176,184,192) bond length is 1.49 Å. In the fifty-first C site, C(80,88,96,176,184,192) is bonded in a bent 120 degrees geometry to one C(79,87,95,175,183,191); one O(3,7,11,15,19,23); and one O(4,8,12,16,24) atom. The C(80,88,96,176,184,192)-O(3,7,11,15,19,23) bond length is 1.24 Å. The C(80,88,96,176,184,192)-O(4,8,12,16,24) bond length is 1.26 Å. In the fifty-second C site, C(99) is bonded in a single-bond geometry to one C(123), one C(156), and one H(86) atom. The C(99)-C(123) bond length is 1.51 Å. The C(99)-C(156) bond length is 1.51 Å. The C(99)-H(86) bond length is 1.14 Å. In the fifty-third C site, C(103,136) is bonded in a distorted bent 120 degrees geometry to one C(105,138); one N(13,17,19,23); and one H(91,111,121,141) atom. The C(103,136)-C(105,138) bond length is 1.36 Å. The C(103,136)-N(13,17,19,23) bond length is 1.31 Å. The C(103,136)-H(91,111,121,141) bond length is 1.14 Å. In the fifty-fourth C site, C(104,137) is bonded in a distorted bent 120 degrees geometry to one N(13,17,19,23) and one H(34,35,36,37,38,39,88,89,90,151,152,153) atom. The C(104,137)-N(13,17,19,23) bond length is 1.33 Å. The C(104,137)-H(34,35,36,37,38,39,88,89,90,151,152,153) bond length is 1.14 Å. In the fifty-fifth C site, C(105,138) is bonded in a distorted trigonal planar geometry to one C(103,136); one C(107,140); and one H(92,122) atom. The C(105,138)-C(107,140) bond length is 1.32 Å. The C(105,138)-H(92,122) bond length is 1.14 Å. In the fifty-sixth C site, C(106,139) is bonded in a distorted single-bond geometry to one C(107,140) and one H(93,123) atom. The C(106,139)-C(107,140) bond length is 1.37 Å. The C(106,139)-H(93,123) bond length is 1.14 Å. In the fifty-seventh C site, C(107,140) is bonded in a trigonal planar geometry to one C(105,138); one C(106,139); and one C(108,141) atom. The C(107,140)-C(108,141) bond length is 1.50 Å. In the fifty-eighth C site, C(108,141) is bonded in a trigonal planar geometry to one C(107,140); one C(109,142); and one C(110) atom. The C(108,141)-C(109,142) bond length is 1.30 Å. The C(108,141)-C(110) bond length is 1.36 Å. In the fifty-ninth C site, C(109,142) is bonded in a distorted trigonal planar geometry to one C(108,141); one C(111,144); and one N(14,20) atom. The C(109,142)-C(111,144) bond length is 1.55 Å. The C(109,142)-N(14,20) bond length is 1.39 Å. In the sixtieth C site, C(110) is bonded in a trigonal planar geometry to one C(108,141); one C(112,145); and one C(113,146) atom. The C(110)-C(112,145) bond length is 1.36 Å. The C(110)-C(113,146) bond length is 1.54 Å. In the sixty-first C site, C(111,144) is bonded in a trigonal non-coplanar geometry to one C(109,142) and three equivalent H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) atoms. All C(111,144)-H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) bond lengths are 1.14 Å. In the sixty-second C site, C(112,145) is bonded in a distorted single-bond geometry to one C(110) and one N(14,20) atom. The C(112,145)-N(14,20) bond length is 1.31 Å. In the sixty-third C site, C(113,146) is bonded in a trigonal non-coplanar geometry to one C(110), one H(97), one H(98), and one H(99) atom. The C(113,146)-H(97) bond length is 1.14 Å. The C(113,146)-H(98) bond length is 1.14 Å. The C(113,146)-H(99) bond length is 1.14 Å. In the sixty-fourth C site, C(114,147) is bonded in a distorted bent 120 degrees geometry to one C(116,149); one N(15,21); and one H(101,131) atom. The C(114,147)-C(116,149) bond length is 1.36 Å. The C(114,147)-N(15,21) bond length is 1.31 Å. The C(114,147)-H(101,131) bond length is 1.14 Å. In the sixty-fifth C site, C(115,148) is bonded in a distorted bent 120 degrees geometry to one N(15,21) and one H(34,35,36,37,38,39,88,89,90,151,152,153) atom. The C(115,148)-N(15,21) bond length is 1.33 Å. The C(115,148)-H(34,35,36,37,38,39,88,89,90,151,152,153) bond length is 1.14 Å. In the sixty-sixth C site, C(116,149) is bonded in a distorted trigonal planar geometry to one C(114,147); one C(118,151); and one H(102,132) atom. The C(116,149)-C(118,151) bond length is 1.32 Å. The C(116,149)-H(102,132) bond length is 1.14 Å. In the sixty-seventh C site, C(117,150) is bonded in a distorted single-bond geometry to one C(118,151) and one H(103,133) atom. The C(117,150)-C(118,151) bond length is 1.37 Å. The C(117,150)-H(103,133) bond length is 1.14 Å. In the sixty-eighth C site, C(118,151) is bonded in a trigonal planar geometry to one C(116,149); one C(117,150); and one C(119) atom. The C(118,151)-C(119) bond length is 1.50 Å. In the sixty-ninth C site, C(119) is bonded in a trigonal planar geometry to one C(118,151); one C(120,153); and one C(121) atom. The C(119)-C(120,153) bond length is 1.30 Å. The C(119)-C(121) bond length is 1.36 Å. In the seventieth C site, C(120,153) is bonded in a distorted trigonal planar geometry to one C(119); one C(122,155); and one N(16,22) atom. The C(120,153)-C(122,155) bond length is 1.55 Å. The C(120,153)-N(16,22) bond length is 1.39 Å. In the seventy-first C site, C(121) is bonded in a trigonal planar geometry to one C(119), one C(123), and one C(124) atom. The C(121)-C(123) bond length is 1.36 Å. The C(121)-C(124) bond length is 1.54 Å. In the seventy-second C site, C(122,155) is bonded in a trigonal non-coplanar geometry to one C(120,153) and three equivalent H(104,105,106,134,135,136) atoms. All C(122,155)-H(104,105,106,134,135,136) bond lengths are 1.14 Å. In the seventy-third C site, C(123) is bonded in a distorted single-bond geometry to one C(121); one C(99); and one N(16,22) atom. The C(123)-N(16,22) bond length is 1.31 Å. In the seventy-fourth C site, C(124) is bonded in a trigonal non-coplanar geometry to one C(121); one H(107); and two equivalent H(108,109) atoms. The C(124)-H(107) bond length is 1.14 Å. Both C(124)-H(108,109) bond lengths are 1.14 Å. In the seventy-fifth C site, C(125,158) is bonded in a distorted bent 120 degrees geometry to one C(127,160); one N(13,17,19,23); and one H(91,111,121,141) atom. The C(125,158)-C(127,160) bond length is 1.36 Å. The C(125,158)-N(13,17,19,23) bond length is 1.31 Å. The C(125,158)-H(91,111,121,141) bond length is 1.14 Å. In the seventy-sixth C site, C(126,159) is bonded in a distorted bent 120 degrees geometry to one N(13,17,19,23) and one H(34,35,36,37,38,39,88,89,90,151,152,153) atom. The C(126,159)-N(13,17,19,23) bond length is 1.33 Å. The C(126,159)-H(34,35,36,37,38,39,88,89,90,151,152,153) bond length is 1.14 Å. In the seventy-seventh C site, C(127,160) is bonded in a distorted trigonal planar geometry to one C(125,158); one C(129,162); and one H(112,142) atom. The C(127,160)-C(129,162) bond length is 1.32 Å. The C(127,160)-H(112,142) bond length is 1.14 Å. In the seventy-eighth C site, C(128,161) is bonded in a distorted single-bond geometry to one C(129,162) and one H(113,143) atom. The C(128,161)-C(129,162) bond length is 1.37 Å. The C(128,161)-H(113,143) bond length is 1.14 Å. In the seventy-ninth C site, C(129,162) is bonded in a trigonal planar geometry to one C(127,160); one C(128,161); and one C(130,163) atom. The C(129,162)-C(130,163) bond length is 1.50 Å. In the eightieth C site, C(130,163) is bonded in a trigonal planar geometry to one C(129,162); one C(131,164); and one C(132) atom. The C(130,163)-C(131,164) bond length is 1.30 Å. The C(130,163)-C(132) bond length is 1.36 Å. In the eighty-first C site, C(131,164) is bonded in a distorted trigonal planar geometry to one C(130,163); one C(133,166); and one N(18,24) atom. The C(131,164)-C(133,166) bond length is 1.55 Å. The C(131,164)-N(18,24) bond length is 1.39 Å. In the eighty-second C site, C(132) is bonded in a trigonal planar geometry to one C(130,163); one C(134,167); and one C(135,168) atom. The C(132)-C(134,167) bond length is 1.36 Å. The C(132)-C(135,168) bond length is 1.54 Å. In the eighty-third C site, C(133,166) is bonded in a trigonal non-coplanar geometry to one C(131,164) and three equivalent H(114,115,116,144,145,146) atoms. All C(133,166)-H(114,115,116,144,145,146) bond lengths are 1.14 Å. In the eighty-fourth C site, C(134,167) is bonded in a distorted single-bond geometry to one C(132) and one N(18,24) atom. The C(134,167)-N(18,24) bond length is 1.31 Å. In the eighty-fifth C site, C(135,168) is bonded in a trigonal non-coplanar geometry to one C(132); one H(119); and two equivalent H(117,118) atoms. The C(135,168)-H(119) bond length is 1.14 Å. Both C(135,168)-H(117,118) bond lengths are 1.14 Å. In the eighty-sixth C site, C(143) is bonded in a trigonal planar geometry to one C(108,141); one C(112,145); and one C(113,146) atom. The C(143)-C(108,141) bond length is 1.36 Å. The C(143)-C(112,145) bond length is 1.36 Å. The C(143)-C(113,146) bond length is 1.54 Å. In the eighty-seventh C site, C(152) is bonded in a trigonal planar geometry to one C(118,151); one C(120,153); and one C(154) atom. The C(152)-C(118,151) bond length is 1.50 Å. The C(152)-C(120,153) bond length is 1.30 Å. The C(152)-C(154) bond length is 1.36 Å. In the eighty-eighth C site, C(154) is bonded in a trigonal planar geometry to one C(152), one C(156), and one C(157) atom. The C(154)-C(156) bond length is 1.36 Å. The C(154)-C(157) bond length is 1.54 Å. In the eighty-ninth C site, C(156) is bonded in a distorted single-bond geometry to one C(154); one C(99); and one N(16,22) atom. The C(156)-N(16,22) bond length is 1.31 Å. In the ninetieth C site, C(157) is bonded in a trigonal non-coplanar geometry to one C(154) and three equivalent H(137,138,139) atoms. All C(157)-H(137,138,139) bond lengths are 1.14 Å. In the ninety-first C site, C(165) is bonded in a trigonal planar geometry to one C(130,163); one C(134,167); and one C(135,168) atom. The C(165)-C(130,163) bond length is 1.36 Å. The C(165)-C(134,167) bond length is 1.36 Å. The C(165)-C(135,168) bond length is 1.54 Å. In the ninety-second C site, C(185) is bonded in a bent 120 degrees geometry to one C(74,82,90,170,178,186); one O(1,5,9,13,17,21); and one O(2,6,10,14,18,22) atom. The C(185)-C(74,82,90,170,178,186) bond length is 1.50 Å. The C(185)-O(1,5,9,13,17,21) bond length is 1.24 Å. The C(185)-O(2,6,10,14,18,22) bond length is 1.22 Å. In the ninety-third C site, C(187) is bonded in a distorted trigonal planar geometry to one C(74,82,90,170,178,186); one C(77,85,93,173,181,189); and one H(70,74,78,154,158,162) atom. The C(187)-C(74,82,90,170,178,186) bond length is 1.38 Å. The C(187)-C(77,85,93,173,181,189) bond length is 1.40 Å. The C(187)-H(70,74,78,154,158,162) bond length is 1.14 Å. In the ninety-fourth C site, C(188) is bonded in a distorted trigonal planar geometry to one C(74,82,90,170,178,186); one C(78,86,94,174,182,190); and one H(71,75,79,155,159,163) atom. The C(188)-C(74,82,90,170,178,186) bond length is 1.40 Å. The C(188)-C(78,86,94,174,182,190) bond length is 1.42 Å. The C(188)-H(71,75,79,155,159,163) bond length is 1.14 Å. There are eleven inequivalent N sites. In the first N site, N(1,7) is bonded in a trigonal planar geometry to one Cd(1); one C(7,40); and one C(8,41) atom. In the second N site, N(2,8) is bonded in a trigonal planar geometry to one B(1); one C(13,46); and one C(16) atom. In the third N site, N(3,9) is bonded in a trigonal planar geometry to one Cd(2); one C(18,51); and one C(19,52) atom. In the fourth N site, N(4,10) is bonded in a trigonal planar geometry to one B(2); one C(24,57); and one C(27,60) atom. In the fifth N site, N(5,11) is bonded in a trigonal planar geometry to one Cd(3); one C(29,62); and one C(30,63) atom. In the sixth N site, N(6,12) is bonded in a trigonal planar geometry to one B(3); one C(35,68); and one C(38) atom. In the seventh N site, N(13,17,19,23) is bonded in a trigonal planar geometry to one Cd(4); one C(103,136); and one C(104,137) atom. In the eighth N site, N(14,20) is bonded in a trigonal planar geometry to one B(4); one C(109,142); and one C(112,145) atom. In the ninth N site, N(15,21) is bonded in a trigonal planar geometry to one Cd(5); one C(114,147); and one C(115,148) atom. In the tenth N site, N(16,22) is bonded in a trigonal planar geometry to one B(5); one C(120,153); and one C(123) atom. In the eleventh N site, N(18,24) is bonded in a trigonal planar geometry to one B(6); one C(131,164); and one C(134,167) atom. There are fifty-three inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(1) atom. In the second H site, H(3) is bonded in a single-bond geometry to one C(5) atom. In the third H site, H(4,40) is bonded in a single-bond geometry to one C(7,40) atom. In the fourth H site, H(5,41) is bonded in a single-bond geometry to one C(9,42) atom. In the fifth H site, H(6,42) is bonded in a single-bond geometry to one C(10,43) atom. In the sixth H site, H(7,8,9,43,44,45) is bonded in a single-bond geometry to one C(15,48) atom. In the seventh H site, H(10,11,12) is bonded in a single-bond geometry to one C(17) atom. In the eighth H site, H(14,50) is bonded in a single-bond geometry to one C(18,51) atom. In the ninth H site, H(15,51) is bonded in a single-bond geometry to one C(20,53) atom. In the tenth H site, H(16,52) is bonded in a single-bond geometry to one C(21,54) atom. In the eleventh H site, H(17,18,19,27,28,29,53,54,55,63,64,65,94,95,96,124,125,126) is bonded in a single-bond geometry to one C(26,59) atom. In the twelfth H site, H(20) is bonded in a single-bond geometry to one C(28,61) atom. In the thirteenth H site, H(21) is bonded in a single-bond geometry to one C(28,61) atom. In the fourteenth H site, H(22) is bonded in a single-bond geometry to one C(28,61) atom. In the fifteenth H site, H(24,60) is bonded in a single-bond geometry to one C(29,62) atom. In the sixteenth H site, H(25,61) is bonded in a single-bond geometry to one C(31,64) atom. In the seventeenth H site, H(26,62) is bonded in a single-bond geometry to one C(32,65) atom. In the eighteenth H site, H(30,31,32,66,67,68) is bonded in a single-bond geometry to one C(39) atom. In the nineteenth H site, H(34,35,36,37,38,39,88,89,90,151,152,153) is bonded in a single-bond geometry to one C(104,137) atom. In the twentieth H site, H(46) is bonded in a single-bond geometry to one C(50) atom. In the twenty-first H site, H(47) is bonded in a single-bond geometry to one C(50) atom. In the twenty-second H site, H(48) is bonded in a single-bond geometry to one C(50) atom. In the twenty-third H site, H(56) is bonded in a single-bond geometry to one C(28,61) atom. The H(56)-C(28,61) bond length is 1.14 Å. In the twenty-fourth H site, H(57) is bonded in a single-bond geometry to one C(28,61) atom. The H(57)-C(28,61) bond length is 1.14 Å. In the twenty-fifth H site, H(58) is bonded in a single-bond geometry to one C(28,61) atom. The H(58)-C(28,61) bond length is 1.14 Å. In the twenty-sixth H site, H(70,74,78,154,158,162) is bonded in a single-bond geometry to one C(75,83,91,171,179) atom. In the twenty-seventh H site, H(71,75,79,155,159,163) is bonded in a single-bond geometry to one C(76,84,92,172,180) atom. In the twenty-eighth H site, H(72,76,80,156,160,164) is bonded in a single-bond geometry to one C(77,85,93,173,181,189) atom. In the twenty-ninth H site, H(73,77,81,157,161,165) is bonded in a single-bond geometry to one C(78,86,94,174,182,190) atom. In the thirtieth H site, H(86) is bonded in a single-bond geometry to one C(99) atom. In the thirty-first H site, H(91,111,121,141) is bonded in a single-bond geometry to one C(103,136) atom. In the thirty-second H site, H(92,122) is bonded in a single-bond geometry to one C(105,138) atom. In the thirty-third H site, H(93,123) is bonded in a single-bond geometry to one C(106,139) atom. In the thirty-fourth H site, H(97) is bonded in a single-bond geometry to one C(113,146) atom. In the thirty-fifth H site, H(98) is bonded in a single-bond geometry to one C(113,146) atom. In the thirty-sixth H site, H(99) is bonded in a single-bond geometry to one C(113,146) atom. In the thirty-seventh H site, H(101,131) is bonded in a single-bond geometry to one C(114,147) atom. In the thirty-eighth H site, H(102,132) is bonded in a single-bond geometry to one C(116,149) atom. In the thirty-ninth H site, H(103,133) is bonded in a single-bond geometry to one C(117,150) atom. In the fortieth H site, H(104,105,106,134,135,136) is bonded in a single-bond geometry to one C(122,155) atom. In the forty-first H site, H(107) is bonded in a single-bond geometry to one C(124) atom. In the forty-second H site, H(108,109) is bonded in a single-bond geometry to one C(124) atom. In the forty-third H site, H(112,142) is bonded in a single-bond geometry to one C(127,160) atom. In the forty-fourth H site, H(113,143) is bonded in a single-bond geometry to one C(128,161) atom. In the forty-fifth H site, H(114,115,116,144,145,146) is bonded in a single-bond geometry to one C(133,166) atom. In the forty-sixth H site, H(117,118) is bonded in a single-bond geometry to one C(135,168) atom. In the forty-seventh H site, H(119) is bonded in a single-bond geometry to one C(135,168) atom. In the forty-eighth H site, H(127) is bonded in a single-bond geometry to one C(113,146) atom. The H(127)-C(113,146) bond length is 1.14 Å. In the forty-ninth H site, H(128) is bonded in a single-bond geometry to one C(113,146) atom. The H(128)-C(113,146) bond length is 1.14 Å. In the fiftieth H site, H(129) is bonded in a single-bond geometry to one C(113,146) atom. The H(129)-C(113,146) bond length is 1.14 Å. In the fifty-first H site, H(137,138,139) is bonded in a single-bond geometry to one C(157) atom. In the fifty-second H site, H(147,148) is bonded in a single-bond geometry to one C(135,168) atom. The H(147,148)-C(135,168) bond length is 1.14 Å. In the fifty-third H site, H(149) is bonded in a single-bond geometry to one C(135,168) atom. The H(149)-C(135,168) bond length is 1.14 Å. There are five inequivalent O sites. In the first O site, O(1,5,9,13,17,21) is bonded in a distorted L-shaped geometry to one Cd(1) and one C(73,81,89,169,177) atom. In the second O site, O(2,6,10,14,18,22) is bonded in an L-shaped geometry to one Cd(1) and one C(73,81,89,169,177) atom. In the third O site, O(3,7,11,15,19,23) is bonded in a 2-coordinate geometry to one Cd(2) and one C(80,88,96,176,184,192) atom. In the fourth O site, O(4,8,12,16,24) is bonded in a distorted water-like geometry to one Cd(5) and one C(80,88,96,176,184,192) atom. In the fifth O site, O(20) is bonded in a distorted water-like geometry to one Cd(3) and one C(80,88,96,176,184,192) atom. The O(20)-C(80,88,96,176,184,192) bond length is 1.26 Å. There are four inequivalent F sites. In the first F site, F(1,5,9) is bonded in a single-bond geometry to one B(1) atom. In the second F site, F(2,6,10) is bonded in a single-bond geometry to one B(1) atom. In the third F site, F(3,7,11) is bonded in a single-bond geometry to one B(2) atom. In the fourth F site, F(4,8,12) is bonded in a single-bond geometry to one B(2) atom. Linkers: 6 [O]C(=O)c1ccc(C([O])=O)cc1. Metal clusters: 3 [C]1O[Cd]2(O1)O[C]O[Cd]1(O[C]O1)O[C]O2. RCSR code: kgm. The MOF has largest included sphere 15.61 A, density 0.62 g/cm3, surface area 4657.69 m2/g, accessible volume 1.22 cm3/g