CdC2N4H3Cl crystallizes in the triclinic P1 space group. There are twenty-four inequivalent Cd sites. In the first Cd site, Cd(1) is bonded to one N(10), one N(12), one N(2), one N(5), one Cl(1), and one Cl(17) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(1)-N(10) bond length is 2.31 Å. The Cd(1)-N(12) bond length is 2.43 Å. The Cd(1)-N(2) bond length is 2.45 Å. The Cd(1)-N(5) bond length is 2.37 Å. The Cd(1)-Cl(1) bond length is 2.53 Å. The Cd(1)-Cl(17) bond length is 2.55 Å. In the second Cd site, Cd(2) is bonded to one N(1), one N(40), one N(6), one N(91), one Cl(1), and one Cl(2) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(2)-N(1) bond length is 2.36 Å. The Cd(2)-N(40) bond length is 2.41 Å. The Cd(2)-N(6) bond length is 2.39 Å. The Cd(2)-N(91) bond length is 2.40 Å. The Cd(2)-Cl(1) bond length is 2.61 Å. The Cd(2)-Cl(2) bond length is 2.56 Å. In the third Cd site, Cd(3) is bonded to one N(11), one N(3), one N(68), one N(9), one Cl(21), and one Cl(6) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(3)-N(11) bond length is 2.30 Å. The Cd(3)-N(3) bond length is 2.39 Å. The Cd(3)-N(68) bond length is 2.40 Å. The Cd(3)-N(9) bond length is 2.48 Å. The Cd(3)-Cl(21) bond length is 2.53 Å. The Cd(3)-Cl(6) bond length is 2.51 Å. In the fourth Cd site, Cd(4) is bonded to one N(14), one N(17), one N(22), one N(24), one Cl(18), and one Cl(3) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(4)-N(14) bond length is 2.45 Å. The Cd(4)-N(17) bond length is 2.37 Å. The Cd(4)-N(22) bond length is 2.31 Å. The Cd(4)-N(24) bond length is 2.43 Å. The Cd(4)-Cl(18) bond length is 2.55 Å. The Cd(4)-Cl(3) bond length is 2.53 Å. In the fifth Cd site, Cd(5) is bonded to one N(13), one N(18), one N(28), one N(79), one Cl(3), and one Cl(4) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(5)-N(13) bond length is 2.36 Å. The Cd(5)-N(18) bond length is 2.39 Å. The Cd(5)-N(28) bond length is 2.41 Å. The Cd(5)-N(79) bond length is 2.40 Å. The Cd(5)-Cl(3) bond length is 2.61 Å. The Cd(5)-Cl(4) bond length is 2.56 Å. In the sixth Cd site, Cd(6) is bonded to one N(15), one N(21), one N(23), one N(56), one Cl(22), and one Cl(8) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(6)-N(15) bond length is 2.39 Å. The Cd(6)-N(21) bond length is 2.48 Å. The Cd(6)-N(23) bond length is 2.30 Å. The Cd(6)-N(56) bond length is 2.40 Å. The Cd(6)-Cl(22) bond length is 2.53 Å. The Cd(6)-Cl(8) bond length is 2.51 Å. In the seventh Cd site, Cd(7) is bonded to one N(26), one N(29), one N(34), one N(36), one Cl(19), and one Cl(5) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(7)-N(26) bond length is 2.45 Å. The Cd(7)-N(29) bond length is 2.37 Å. The Cd(7)-N(34) bond length is 2.31 Å. The Cd(7)-N(36) bond length is 2.43 Å. The Cd(7)-Cl(19) bond length is 2.55 Å. The Cd(7)-Cl(5) bond length is 2.53 Å. In the eighth Cd site, Cd(8) is bonded to one N(25), one N(30), one N(4), one N(67), one Cl(5), and one Cl(6) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(8)-N(25) bond length is 2.36 Å. The Cd(8)-N(30) bond length is 2.39 Å. The Cd(8)-N(4) bond length is 2.41 Å. The Cd(8)-N(67) bond length is 2.40 Å. The Cd(8)-Cl(5) bond length is 2.61 Å. The Cd(8)-Cl(6) bond length is 2.56 Å. In the ninth Cd site, Cd(9) is bonded to one N(27), one N(33), one N(35), one N(80), one Cl(23), and one Cl(4) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(9)-N(27) bond length is 2.39 Å. The Cd(9)-N(33) bond length is 2.48 Å. The Cd(9)-N(35) bond length is 2.30 Å. The Cd(9)-N(80) bond length is 2.40 Å. The Cd(9)-Cl(23) bond length is 2.53 Å. The Cd(9)-Cl(4) bond length is 2.51 Å. In the tenth Cd site, Cd(10) is bonded to one N(38), one N(41), one N(46), one N(48), one Cl(20), and one Cl(7) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(10)-N(38) bond length is 2.45 Å. The Cd(10)-N(41) bond length is 2.37 Å. The Cd(10)-N(46) bond length is 2.31 Å. The Cd(10)-N(48) bond length is 2.43 Å. The Cd(10)-Cl(20) bond length is 2.55 Å. The Cd(10)-Cl(7) bond length is 2.53 Å. In the eleventh Cd site, Cd(11) is bonded to one N(16), one N(37), one N(42), one N(55), one Cl(7), and one Cl(8) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(11)-N(16) bond length is 2.41 Å. The Cd(11)-N(37) bond length is 2.36 Å. The Cd(11)-N(42) bond length is 2.39 Å. The Cd(11)-N(55) bond length is 2.40 Å. The Cd(11)-Cl(7) bond length is 2.61 Å. The Cd(11)-Cl(8) bond length is 2.56 Å. In the twelfth Cd site, Cd(12) is bonded to one N(39), one N(45), one N(47), one N(92), one Cl(2), and one Cl(24) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(12)-N(39) bond length is 2.39 Å. The Cd(12)-N(45) bond length is 2.48 Å. The Cd(12)-N(47) bond length is 2.30 Å. The Cd(12)-N(92) bond length is 2.40 Å. The Cd(12)-Cl(2) bond length is 2.51 Å. The Cd(12)-Cl(24) bond length is 2.53 Å. In the thirteenth Cd site, Cd(13) is bonded to one N(50), one N(53), one N(58), one N(60), one Cl(19), and one Cl(9) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(13)-N(50) bond length is 2.45 Å. The Cd(13)-N(53) bond length is 2.37 Å. The Cd(13)-N(58) bond length is 2.31 Å. The Cd(13)-N(60) bond length is 2.43 Å. The Cd(13)-Cl(19) bond length is 2.55 Å. The Cd(13)-Cl(9) bond length is 2.53 Å. In the fourteenth Cd site, Cd(14) is bonded to one N(43); one N(49); one N(54); one N(64,88); one Cl(10); and one Cl(9) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(14)-N(43) bond length is 2.40 Å. The Cd(14)-N(49) bond length is 2.36 Å. The Cd(14)-N(54) bond length is 2.39 Å. The Cd(14)-N(64,88) bond length is 2.41 Å. The Cd(14)-Cl(10) bond length is 2.56 Å. The Cd(14)-Cl(9) bond length is 2.61 Å. In the fifteenth Cd site, Cd(15) is bonded to one N(20), one N(51), one N(57), one N(59), one Cl(14), and one Cl(22) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(15)-N(20) bond length is 2.40 Å. The Cd(15)-N(51) bond length is 2.39 Å. The Cd(15)-N(57) bond length is 2.48 Å. The Cd(15)-N(59) bond length is 2.30 Å. The Cd(15)-Cl(14) bond length is 2.51 Å. The Cd(15)-Cl(22) bond length is 2.53 Å. In the sixteenth Cd site, Cd(16) is bonded to one N(62), one N(65), one N(70), one N(72), one Cl(11), and one Cl(20) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(16)-N(62) bond length is 2.45 Å. The Cd(16)-N(65) bond length is 2.37 Å. The Cd(16)-N(70) bond length is 2.31 Å. The Cd(16)-N(72) bond length is 2.43 Å. The Cd(16)-Cl(11) bond length is 2.53 Å. The Cd(16)-Cl(20) bond length is 2.55 Å. In the seventeenth Cd site, Cd(17) is bonded to one N(31), one N(61), one N(66), one N(76), one Cl(11), and one Cl(12) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(17)-N(31) bond length is 2.40 Å. The Cd(17)-N(61) bond length is 2.36 Å. The Cd(17)-N(66) bond length is 2.39 Å. The Cd(17)-N(76) bond length is 2.41 Å. The Cd(17)-Cl(11) bond length is 2.61 Å. The Cd(17)-Cl(12) bond length is 2.56 Å. In the eighteenth Cd site, Cd(18) is bonded to one N(63), one N(69), one N(71), one N(8), one Cl(16), and one Cl(21) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(18)-N(63) bond length is 2.39 Å. The Cd(18)-N(69) bond length is 2.48 Å. The Cd(18)-N(71) bond length is 2.30 Å. The Cd(18)-N(8) bond length is 2.40 Å. The Cd(18)-Cl(16) bond length is 2.51 Å. The Cd(18)-Cl(21) bond length is 2.53 Å. In the nineteenth Cd site, Cd(19) is bonded to one N(74), one N(77), one N(82), one N(84), one Cl(13), and one Cl(17) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(19)-N(74) bond length is 2.45 Å. The Cd(19)-N(77) bond length is 2.37 Å. The Cd(19)-N(82) bond length is 2.31 Å. The Cd(19)-N(84) bond length is 2.43 Å. The Cd(19)-Cl(13) bond length is 2.53 Å. The Cd(19)-Cl(17) bond length is 2.55 Å. In the twentieth Cd site, Cd(20) is bonded to one N(19), one N(52), one N(73), one N(78), one Cl(13), and one Cl(14) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(20)-N(19) bond length is 2.40 Å. The Cd(20)-N(52) bond length is 2.41 Å. The Cd(20)-N(73) bond length is 2.36 Å. The Cd(20)-N(78) bond length is 2.39 Å. The Cd(20)-Cl(13) bond length is 2.61 Å. The Cd(20)-Cl(14) bond length is 2.56 Å. In the twenty-first Cd site, Cd(21) is bonded to one N(32), one N(75), one N(81), one N(83), one Cl(12), and one Cl(23) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(21)-N(32) bond length is 2.40 Å. The Cd(21)-N(75) bond length is 2.39 Å. The Cd(21)-N(81) bond length is 2.48 Å. The Cd(21)-N(83) bond length is 2.30 Å. The Cd(21)-Cl(12) bond length is 2.51 Å. The Cd(21)-Cl(23) bond length is 2.53 Å. In the twenty-second Cd site, Cd(22) is bonded to one N(86), one N(89), one N(94), one N(96), one Cl(15), and one Cl(18) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 81-85°. The Cd(22)-N(86) bond length is 2.45 Å. The Cd(22)-N(89) bond length is 2.37 Å. The Cd(22)-N(94) bond length is 2.31 Å. The Cd(22)-N(96) bond length is 2.43 Å. The Cd(22)-Cl(15) bond length is 2.53 Å. The Cd(22)-Cl(18) bond length is 2.55 Å. In the twenty-third Cd site, Cd(23) is bonded to one N(64,88); one N(7); one N(85); one N(90); one Cl(15); and one Cl(16) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 84-85°. The Cd(23)-N(64,88) bond length is 2.41 Å. The Cd(23)-N(7) bond length is 2.40 Å. The Cd(23)-N(85) bond length is 2.36 Å. The Cd(23)-N(90) bond length is 2.39 Å. The Cd(23)-Cl(15) bond length is 2.61 Å. The Cd(23)-Cl(16) bond length is 2.56 Å. In the twenty-fourth Cd site, Cd(24) is bonded to one N(44), one N(87), one N(93), one N(95), one Cl(10), and one Cl(24) atom to form corner-sharing CdN4Cl2 octahedra. The corner-sharing octahedral tilt angles range from 82-84°. The Cd(24)-N(44) bond length is 2.40 Å. The Cd(24)-N(87) bond length is 2.39 Å. The Cd(24)-N(93) bond length is 2.48 Å. The Cd(24)-N(95) bond length is 2.30 Å. The Cd(24)-Cl(10) bond length is 2.51 Å. The Cd(24)-Cl(24) bond length is 2.53 Å. There are thirty-three inequivalent C sites. In the first C site, C(1) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(1); and one N(4) atom. The C(1)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(1)-N(1) bond length is 1.34 Å. The C(1)-N(4) bond length is 1.34 Å. In the second C site, C(2,6,10,14,18,22,26,30) is bonded in a distorted trigonal non-coplanar geometry to one C(1) and three equivalent H(1,2,3,43,44,45) atoms. All C(2,6,10,14,18,22,26,30)-H(1,2,3,43,44,45) bond lengths are 1.14 Å. In the third C site, C(3) is bonded in a distorted trigonal planar geometry to one C(4,8); one N(10); and one N(7) atom. The C(3)-C(4,8) bond length is 1.49 Å. The C(3)-N(10) bond length is 1.33 Å. The C(3)-N(7) bond length is 1.35 Å. In the fourth C site, C(4,8) is bonded in a distorted trigonal non-coplanar geometry to one C(3) and three equivalent H(4,5,6) atoms. All C(4,8)-H(4,5,6) bond lengths are 1.14 Å. In the fifth C site, C(5) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(13); and one N(16) atom. The C(5)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(5)-N(13) bond length is 1.34 Å. The C(5)-N(16) bond length is 1.34 Å. In the sixth C site, C(7) is bonded in a distorted trigonal planar geometry to one C(4,8); one N(19); and one N(22) atom. The C(7)-C(4,8) bond length is 1.49 Å. The C(7)-N(19) bond length is 1.35 Å. The C(7)-N(22) bond length is 1.33 Å. In the seventh C site, C(9) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(25); and one N(28) atom. The C(9)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(9)-N(25) bond length is 1.34 Å. The C(9)-N(28) bond length is 1.34 Å. In the eighth C site, C(11) is bonded in a distorted trigonal planar geometry to one C(12,24,28,32); one N(31); and one N(34) atom. The C(11)-C(12,24,28,32) bond length is 1.49 Å. The C(11)-N(31) bond length is 1.35 Å. The C(11)-N(34) bond length is 1.33 Å. In the ninth C site, C(12,24,28,32) is bonded in a distorted trigonal non-coplanar geometry to one C(11) and three equivalent H(10,11,12,16,17,18) atoms. All C(12,24,28,32)-H(10,11,12,16,17,18) bond lengths are 1.14 Å. In the tenth C site, C(13) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(37); and one N(40) atom. The C(13)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(13)-N(37) bond length is 1.34 Å. The C(13)-N(40) bond length is 1.34 Å. In the eleventh C site, C(15) is bonded in a distorted trigonal planar geometry to one C(16,20); one N(43); and one N(46) atom. The C(15)-C(16,20) bond length is 1.49 Å. The C(15)-N(43) bond length is 1.35 Å. The C(15)-N(46) bond length is 1.33 Å. In the twelfth C site, C(16,20) is bonded in a distorted trigonal non-coplanar geometry to one C(15) and three equivalent H(22,23,24) atoms. All C(16,20)-H(22,23,24) bond lengths are 1.14 Å. In the thirteenth C site, C(17) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(49); and one N(52) atom. The C(17)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(17)-N(49) bond length is 1.34 Å. The C(17)-N(52) bond length is 1.34 Å. In the fourteenth C site, C(19) is bonded in a distorted trigonal planar geometry to one C(16,20); one N(55); and one N(58) atom. The C(19)-C(16,20) bond length is 1.49 Å. The C(19)-N(55) bond length is 1.35 Å. The C(19)-N(58) bond length is 1.33 Å. In the fifteenth C site, C(21) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(61); and one N(64,88) atom. The C(21)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(21)-N(61) bond length is 1.34 Å. The C(21)-N(64,88) bond length is 1.34 Å. In the sixteenth C site, C(23) is bonded in a distorted trigonal planar geometry to one C(12,24,28,32); one N(67); and one N(70) atom. The C(23)-C(12,24,28,32) bond length is 1.49 Å. The C(23)-N(67) bond length is 1.35 Å. The C(23)-N(70) bond length is 1.33 Å. In the seventeenth C site, C(25) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(73); and one N(76) atom. The C(25)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(25)-N(73) bond length is 1.34 Å. The C(25)-N(76) bond length is 1.34 Å. In the eighteenth C site, C(27) is bonded in a distorted trigonal planar geometry to one C(12,24,28,32); one N(79); and one N(82) atom. The C(27)-C(12,24,28,32) bond length is 1.49 Å. The C(27)-N(79) bond length is 1.35 Å. The C(27)-N(82) bond length is 1.33 Å. In the nineteenth C site, C(29) is bonded in a distorted trigonal planar geometry to one C(2,6,10,14,18,22,26,30); one N(64,88); and one N(85) atom. The C(29)-C(2,6,10,14,18,22,26,30) bond length is 1.49 Å. The C(29)-N(64,88) bond length is 1.34 Å. The C(29)-N(85) bond length is 1.34 Å. In the twentieth C site, C(31) is bonded in a distorted trigonal planar geometry to one C(12,24,28,32); one N(91); and one N(94) atom. The C(31)-C(12,24,28,32) bond length is 1.49 Å. The C(31)-N(91) bond length is 1.35 Å. The C(31)-N(94) bond length is 1.33 Å. In the twenty-first C site, C(33) is bonded in a distorted trigonal planar geometry to one C(34,38,42,46); one N(6); and one N(78) atom. The C(33)-C(34,38,42,46) bond length is 1.52 Å. The C(33)-N(6) bond length is 1.34 Å. The C(33)-N(78) bond length is 1.34 Å. In the twenty-second C site, C(34,38,42,46) is bonded in a distorted trigonal non-coplanar geometry to one C(33) and three equivalent H(49,50,51,67,68,69) atoms. All C(34,38,42,46)-H(49,50,51,67,68,69) bond lengths are 1.14 Å. In the twenty-third C site, C(35) is bonded in a trigonal planar geometry to one C(36), one N(11), and one N(83) atom. The C(35)-C(36) bond length is 1.48 Å. The C(35)-N(11) bond length is 1.33 Å. The C(35)-N(83) bond length is 1.33 Å. In the twenty-fourth C site, C(36) is bonded in a distorted trigonal non-coplanar geometry to one C(35) and three equivalent H(52,53,54) atoms. All C(36)-H(52,53,54) bond lengths are 1.14 Å. In the twenty-fifth C site, C(37) is bonded in a distorted trigonal planar geometry to one C(34,38,42,46); one N(18); and one N(90) atom. The C(37)-C(34,38,42,46) bond length is 1.52 Å. The C(37)-N(18) bond length is 1.34 Å. The C(37)-N(90) bond length is 1.34 Å. In the twenty-sixth C site, C(39) is bonded in a trigonal planar geometry to one C(40), one N(23), and one N(95) atom. The C(39)-C(40) bond length is 1.48 Å. The C(39)-N(23) bond length is 1.33 Å. The C(39)-N(95) bond length is 1.33 Å. In the twenty-seventh C site, C(40) is bonded in a distorted trigonal non-coplanar geometry to one C(39) and three equivalent H(58,59,60,64,65,66,70,71,72) atoms. All C(40)-H(58,59,60,64,65,66,70,71,72) bond lengths are 1.14 Å. In the twenty-eighth C site, C(41) is bonded in a distorted trigonal planar geometry to one C(34,38,42,46); one N(30); and one N(54) atom. The C(41)-C(34,38,42,46) bond length is 1.52 Å. The C(41)-N(30) bond length is 1.34 Å. The C(41)-N(54) bond length is 1.34 Å. In the twenty-ninth C site, C(43) is bonded in a trigonal planar geometry to one C(44), one N(35), and one N(59) atom. The C(43)-C(44) bond length is 1.48 Å. The C(43)-N(35) bond length is 1.33 Å. The C(43)-N(59) bond length is 1.33 Å. In the thirtieth C site, C(44) is bonded in a distorted trigonal non-coplanar geometry to one C(43) and three equivalent H(58,59,60,64,65,66,70,71,72) atoms. All C(44)-H(58,59,60,64,65,66,70,71,72) bond lengths are 1.14 Å. In the thirty-first C site, C(45) is bonded in a distorted trigonal planar geometry to one C(34,38,42,46); one N(42); and one N(66) atom. The C(45)-C(34,38,42,46) bond length is 1.52 Å. The C(45)-N(42) bond length is 1.34 Å. The C(45)-N(66) bond length is 1.34 Å. In the thirty-second C site, C(47) is bonded in a trigonal planar geometry to one C(48), one N(47), and one N(71) atom. The C(47)-C(48) bond length is 1.48 Å. The C(47)-N(47) bond length is 1.33 Å. The C(47)-N(71) bond length is 1.33 Å. In the thirty-third C site, C(48) is bonded in a distorted trigonal non-coplanar geometry to one C(47) and three equivalent H(58,59,60,64,65,66,70,71,72) atoms. All C(48)-H(58,59,60,64,65,66,70,71,72) bond lengths are 1.14 Å. There are ninety-five inequivalent N sites. In the first N site, N(1) is bonded in a 3-coordinate geometry to one Cd(2), one C(1), and one N(2) atom. The N(1)-N(2) bond length is 1.35 Å. In the second N site, N(2) is bonded in a trigonal planar geometry to one Cd(1), one N(1), and one N(3) atom. The N(2)-N(3) bond length is 1.30 Å. In the third N site, N(3) is bonded in a trigonal planar geometry to one Cd(3), one N(2), and one N(4) atom. The N(3)-N(4) bond length is 1.33 Å. In the fourth N site, N(4) is bonded in a 3-coordinate geometry to one Cd(8), one C(1), and one N(3) atom. In the fifth N site, N(5) is bonded in a trigonal planar geometry to one Cd(1), one N(6), and one N(77) atom. The N(5)-N(6) bond length is 1.35 Å. The N(5)-N(77) bond length is 1.31 Å. In the sixth N site, N(6) is bonded in a 3-coordinate geometry to one Cd(2), one C(33), and one N(5) atom. In the seventh N site, N(7) is bonded in a 3-coordinate geometry to one Cd(23), one C(3), and one N(8) atom. The N(7)-N(8) bond length is 1.34 Å. In the eighth N site, N(8) is bonded in a trigonal planar geometry to one Cd(18), one N(7), and one N(9) atom. The N(8)-N(9) bond length is 1.31 Å. In the ninth N site, N(9) is bonded in a trigonal planar geometry to one Cd(3), one N(10), and one N(8) atom. The N(9)-N(10) bond length is 1.35 Å. In the tenth N site, N(10) is bonded in a 3-coordinate geometry to one Cd(1), one C(3), and one N(9) atom. In the eleventh N site, N(11) is bonded in a distorted trigonal planar geometry to one Cd(3), one C(35), and one N(12) atom. The N(11)-N(12) bond length is 1.35 Å. In the twelfth N site, N(12) is bonded in a trigonal planar geometry to one Cd(1), one N(11), and one N(84) atom. The N(12)-N(84) bond length is 1.30 Å. In the thirteenth N site, N(13) is bonded in a 3-coordinate geometry to one Cd(5), one C(5), and one N(14) atom. The N(13)-N(14) bond length is 1.35 Å. In the fourteenth N site, N(14) is bonded in a trigonal planar geometry to one Cd(4), one N(13), and one N(15) atom. The N(14)-N(15) bond length is 1.30 Å. In the fifteenth N site, N(15) is bonded in a trigonal planar geometry to one Cd(6), one N(14), and one N(16) atom. The N(15)-N(16) bond length is 1.33 Å. In the sixteenth N site, N(16) is bonded in a 3-coordinate geometry to one Cd(11), one C(5), and one N(15) atom. In the seventeenth N site, N(17) is bonded in a trigonal planar geometry to one Cd(4), one N(18), and one N(89) atom. The N(17)-N(18) bond length is 1.35 Å. The N(17)-N(89) bond length is 1.31 Å. In the eighteenth N site, N(18) is bonded in a 3-coordinate geometry to one Cd(5), one C(37), and one N(17) atom. In the nineteenth N site, N(19) is bonded in a 3-coordinate geometry to one Cd(20), one C(7), and one N(20) atom. The N(19)-N(20) bond length is 1.34 Å. In the twentieth N site, N(20) is bonded in a trigonal planar geometry to one Cd(15), one N(19), and one N(21) atom. The N(20)-N(21) bond length is 1.31 Å. In the twenty-first N site, N(21) is bonded in a trigonal planar geometry to one Cd(6), one N(20), and one N(22) atom. The N(21)-N(22) bond length is 1.35 Å. In the twenty-second N site, N(22) is bonded in a 3-coordinate geometry to one Cd(4), one C(7), and one N(21) atom. In the twenty-third N site, N(23) is bonded in a distorted trigonal planar geometry to one Cd(6), one C(39), and one N(24) atom. The N(23)-N(24) bond length is 1.35 Å. In the twenty-fourth N site, N(24) is bonded in a trigonal planar geometry to one Cd(4), one N(23), and one N(96) atom. The N(24)-N(96) bond length is 1.30 Å. In the twenty-fifth N site, N(25) is bonded in a 3-coordinate geometry to one Cd(8), one C(9), and one N(26) atom. The N(25)-N(26) bond length is 1.35 Å. In the twenty-sixth N site, N(26) is bonded in a trigonal planar geometry to one Cd(7), one N(25), and one N(27) atom. The N(26)-N(27) bond length is 1.30 Å. In the twenty-seventh N site, N(27) is bonded in a trigonal planar geometry to one Cd(9), one N(26), and one N(28) atom. The N(27)-N(28) bond length is 1.33 Å. In the twenty-eighth N site, N(28) is bonded in a 3-coordinate geometry to one Cd(5), one C(9), and one N(27) atom. In the twenty-ninth N site, N(29) is bonded in a trigonal planar geometry to one Cd(7), one N(30), and one N(53) atom. The N(29)-N(30) bond length is 1.35 Å. The N(29)-N(53) bond length is 1.31 Å. In the thirtieth N site, N(30) is bonded in a 3-coordinate geometry to one Cd(8), one C(41), and one N(29) atom. In the thirty-first N site, N(31) is bonded in a 3-coordinate geometry to one Cd(17), one C(11), and one N(32) atom. The N(31)-N(32) bond length is 1.34 Å. In the thirty-second N site, N(32) is bonded in a trigonal planar geometry to one Cd(21), one N(31), and one N(33) atom. The N(32)-N(33) bond length is 1.31 Å. In the thirty-third N site, N(33) is bonded in a trigonal planar geometry to one Cd(9), one N(32), and one N(34) atom. The N(33)-N(34) bond length is 1.35 Å. In the thirty-fourth N site, N(34) is bonded in a 3-coordinate geometry to one Cd(7), one C(11), and one N(33) atom. In the thirty-fifth N site, N(35) is bonded in a distorted trigonal planar geometry to one Cd(9), one C(43), and one N(36) atom. The N(35)-N(36) bond length is 1.35 Å. In the thirty-sixth N site, N(36) is bonded in a trigonal planar geometry to one Cd(7), one N(35), and one N(60) atom. The N(36)-N(60) bond length is 1.30 Å. In the thirty-seventh N site, N(37) is bonded in a 3-coordinate geometry to one Cd(11), one C(13), and one N(38) atom. The N(37)-N(38) bond length is 1.35 Å. In the thirty-eighth N site, N(38) is bonded in a trigonal planar geometry to one Cd(10), one N(37), and one N(39) atom. The N(38)-N(39) bond length is 1.30 Å. In the thirty-ninth N site, N(39) is bonded in a trigonal planar geometry to one Cd(12), one N(38), and one N(40) atom. The N(39)-N(40) bond length is 1.33 Å. In the fortieth N site, N(40) is bonded in a 3-coordinate geometry to one Cd(2), one C(13), and one N(39) atom. In the forty-first N site, N(41) is bonded in a trigonal planar geometry to one Cd(10), one N(42), and one N(65) atom. The N(41)-N(42) bond length is 1.35 Å. The N(41)-N(65) bond length is 1.31 Å. In the forty-second N site, N(42) is bonded in a 3-coordinate geometry to one Cd(11), one C(45), and one N(41) atom. In the forty-third N site, N(43) is bonded in a 3-coordinate geometry to one Cd(14), one C(15), and one N(44) atom. The N(43)-N(44) bond length is 1.34 Å. In the forty-fourth N site, N(44) is bonded in a trigonal planar geometry to one Cd(24), one N(43), and one N(45) atom. The N(44)-N(45) bond length is 1.31 Å. In the forty-fifth N site, N(45) is bonded in a trigonal planar geometry to one Cd(12), one N(44), and one N(46) atom. The N(45)-N(46) bond length is 1.35 Å. In the forty-sixth N site, N(46) is bonded in a 3-coordinate geometry to one Cd(10), one C(15), and one N(45) atom. In the forty-seventh N site, N(47) is bonded in a distorted trigonal planar geometry to one Cd(12), one C(47), and one N(48) atom. The N(47)-N(48) bond length is 1.35 Å. In the forty-eighth N site, N(48) is bonded in a trigonal planar geometry to one Cd(10), one N(47), and one N(72) atom. The N(48)-N(72) bond length is 1.30 Å. In the forty-ninth N site, N(49) is bonded in a 3-coordinate geometry to one Cd(14), one C(17), and one N(50) atom. The N(49)-N(50) bond length is 1.35 Å. In the fiftieth N site, N(50) is bonded in a trigonal planar geometry to one Cd(13), one N(49), and one N(51) atom. The N(50)-N(51) bond length is 1.30 Å. In the fifty-first N site, N(51) is bonded in a trigonal planar geometry to one Cd(15), one N(50), and one N(52) atom. The N(51)-N(52) bond length is 1.33 Å. In the fifty-second N site, N(52) is bonded in a 3-coordinate geometry to one Cd(20), one C(17), and one N(51) atom. In the fifty-third N site, N(53) is bonded in a trigonal planar geometry to one Cd(13), one N(29), and one N(54) atom. The N(53)-N(54) bond length is 1.35 Å. In the fifty-fourth N site, N(54) is bonded in a 3-coordinate geometry to one Cd(14), one C(41), and one N(53) atom. In the fifty-fifth N site, N(55) is bonded in a 3-coordinate geometry to one Cd(11), one C(19), and one N(56) atom. The N(55)-N(56) bond length is 1.34 Å. In the fifty-sixth N site, N(56) is bonded in a trigonal planar geometry to one Cd(6), one N(55), and one N(57) atom. The N(56)-N(57) bond length is 1.31 Å. In the fifty-seventh N site, N(57) is bonded in a trigonal planar geometry to one Cd(15), one N(56), and one N(58) atom. The N(57)-N(58) bond length is 1.35 Å. In the fifty-eighth N site, N(58) is bonded in a 3-coordinate geometry to one Cd(13), one C(19), and one N(57) atom. In the fifty-ninth N site, N(59) is bonded in a distorted trigonal planar geometry to one Cd(15), one C(43), and one N(60) atom. The N(59)-N(60) bond length is 1.35 Å. In the sixtieth N site, N(60) is bonded in a trigonal planar geometry to one Cd(13), one N(36), and one N(59) atom. In the sixty-first N site, N(61) is bonded in a 3-coordinate geometry to one Cd(17), one C(21), and one N(62) atom. The N(61)-N(62) bond length is 1.35 Å. In the sixty-second N site, N(62) is bonded in a trigonal planar geometry to one Cd(16), one N(61), and one N(63) atom. The N(62)-N(63) bond length is 1.30 Å. In the sixty-third N site, N(63) is bonded in a trigonal planar geometry to one Cd(18); one N(62); and one N(64,88) atom. The N(63)-N(64,88) bond length is 1.33 Å. In the sixty-fourth N site, N(64,88) is bonded in a 3-coordinate geometry to one Cd(23), one C(21), and one N(63) atom. In the sixty-fifth N site, N(65) is bonded in a trigonal planar geometry to one Cd(16), one N(41), and one N(66) atom. The N(65)-N(66) bond length is 1.35 Å. In the sixty-sixth N site, N(66) is bonded in a 3-coordinate geometry to one Cd(17), one C(45), and one N(65) atom. In the sixty-seventh N site, N(67) is bonded in a 3-coordinate geometry to one Cd(8), one C(23), and one N(68) atom. The N(67)-N(68) bond length is 1.34 Å. In the sixty-eighth N site, N(68) is bonded in a trigonal planar geometry to one Cd(3), one N(67), and one N(69) atom. The N(68)-N(69) bond length is 1.31 Å. In the sixty-ninth N site, N(69) is bonded in a trigonal planar geometry to one Cd(18), one N(68), and one N(70) atom. The N(69)-N(70) bond length is 1.35 Å. In the seventieth N site, N(70) is bonded in a 3-coordinate geometry to one Cd(16), one C(23), and one N(69) atom. In the seventy-first N site, N(71) is bonded in a distorted trigonal planar geometry to one Cd(18), one C(47), and one N(72) atom. The N(71)-N(72) bond length is 1.35 Å. In the seventy-second N site, N(72) is bonded in a trigonal planar geometry to one Cd(16), one N(48), and one N(71) atom. In the seventy-third N site, N(73) is bonded in a 3-coordinate geometry to one Cd(20), one C(25), and one N(74) atom. The N(73)-N(74) bond length is 1.35 Å. In the seventy-fourth N site, N(74) is bonded in a trigonal planar geometry to one Cd(19), one N(73), and one N(75) atom. The N(74)-N(75) bond length is 1.30 Å. In the seventy-fifth N site, N(75) is bonded in a trigonal planar geometry to one Cd(21), one N(74), and one N(76) atom. The N(75)-N(76) bond length is 1.33 Å. In the seventy-sixth N site, N(76) is bonded in a 3-coordinate geometry to one Cd(17), one C(25), and one N(75) atom. In the seventy-seventh N site, N(77) is bonded in a trigonal planar geometry to one Cd(19), one N(5), and one N(78) atom. The N(77)-N(78) bond length is 1.35 Å. In the seventy-eighth N site, N(78) is bonded in a 3-coordinate geometry to one Cd(20), one C(33), and one N(77) atom. In the seventy-ninth N site, N(79) is bonded in a 3-coordinate geometry to one Cd(5), one C(27), and one N(80) atom. The N(79)-N(80) bond length is 1.34 Å. In the eightieth N site, N(80) is bonded in a trigonal planar geometry to one Cd(9), one N(79), and one N(81) atom. The N(80)-N(81) bond length is 1.31 Å. In the eighty-first N site, N(81) is bonded in a trigonal planar geometry to one Cd(21), one N(80), and one N(82) atom. The N(81)-N(82) bond length is 1.35 Å. In the eighty-second N site, N(82) is bonded in a 3-coordinate geometry to one Cd(19), one C(27), and one N(81) atom. In the eighty-third N site, N(83) is bonded in a distorted trigonal planar geometry to one Cd(21), one C(35), and one N(84) atom. The N(83)-N(84) bond length is 1.35 Å. In the eighty-fourth N site, N(84) is bonded in a trigonal planar geometry to one Cd(19), one N(12), and one N(83) atom. In the eighty-fifth N site, N(85) is bonded in a 3-coordinate geometry to one Cd(23), one C(29), and one N(86) atom. The N(85)-N(86) bond length is 1.35 Å. In the eighty-sixth N site, N(86) is bonded in a trigonal planar geometry to one Cd(22), one N(85), and one N(87) atom. The N(86)-N(87) bond length is 1.30 Å. In the eighty-seventh N site, N(87) is bonded in a trigonal planar geometry to one Cd(24); one N(64,88); and one N(86) atom. The N(87)-N(64,88) bond length is 1.33 Å. In the eighty-eighth N site, N(89) is bonded in a trigonal planar geometry to one Cd(22), one N(17), and one N(90) atom. The N(89)-N(90) bond length is 1.35 Å. In the eighty-ninth N site, N(90) is bonded in a 3-coordinate geometry to one Cd(23), one C(37), and one N(89) atom. In the ninetieth N site, N(91) is bonded in a 3-coordinate geometry to one Cd(2), one C(31), and one N(92) atom. The N(91)-N(92) bond length is 1.34 Å. In the ninety-first N site, N(92) is bonded in a trigonal planar geometry to one Cd(12), one N(91), and one N(93) atom. The N(92)-N(93) bond length is 1.31 Å. In the ninety-second N site, N(93) is bonded in a trigonal planar geometry to one Cd(24), one N(92), and one N(94) atom. The N(93)-N(94) bond length is 1.35 Å. In the ninety-third N site, N(94) is bonded in a 3-coordinate geometry to one Cd(22), one C(31), and one N(93) atom. In the ninety-fourth N site, N(95) is bonded in a distorted trigonal planar geometry to one Cd(24), one C(39), and one N(96) atom. The N(95)-N(96) bond length is 1.35 Å. In the ninety-fifth N site, N(96) is bonded in a trigonal planar geometry to one Cd(22), one N(24), and one N(95) atom. There are eighteen inequivalent H sites. In the first H site, H(1,2,3,43,44,45) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. In the second H site, H(4,5,6) is bonded in a single-bond geometry to one C(4,8) atom. In the third H site, H(7,8,9) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. The H(7,8,9)-C(2,6,10,14,18,22,26,30) bond length is 1.14 Å. In the fourth H site, H(10,11,12,16,17,18) is bonded in a single-bond geometry to one C(4,8) atom. The H(10,11,12,16,17,18)-C(4,8) bond length is 1.14 Å. In the fifth H site, H(13,14,15) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. The H(13,14,15)-C(2,6,10,14,18,22,26,30) bond length is 1.14 Å. In the sixth H site, H(19,20,21) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. The H(19,20,21)-C(2,6,10,14,18,22,26,30) bond length is 1.14 Å. In the seventh H site, H(22,23,24) is bonded in a single-bond geometry to one C(16,20) atom. In the eighth H site, H(25,26,27,40,41,42) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. The H(25,26,27,40,41,42)-C(2,6,10,14,18,22,26,30) bond length is 1.14 Å. In the ninth H site, H(28,29,30) is bonded in a single-bond geometry to one C(16,20) atom. The H(28,29,30)-C(16,20) bond length is 1.14 Å. In the tenth H site, H(31,32,33) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. The H(31,32,33)-C(2,6,10,14,18,22,26,30) bond length is 1.14 Å. In the eleventh H site, H(34,35,36) is bonded in a single-bond geometry to one C(12,24,28,32) atom. The H(34,35,36)-C(12,24,28,32) bond length is 1.14 Å. In the twelfth H site, H(37,38,39) is bonded in a single-bond geometry to one C(2,6,10,14,18,22,26,30) atom. The H(37,38,39)-C(2,6,10,14,18,22,26,30) bond length is 1.14 Å. In the thirteenth H site, H(46,47,48) is bonded in a single-bond geometry to one C(12,24,28,32) atom. The H(46,47,48)-C(12,24,28,32) bond length is 1.14 Å. In the fourteenth H site, H(49,50,51,67,68,69) is bonded in a single-bond geometry to one C(34,38,42,46) atom. In the fifteenth H site, H(52,53,54) is bonded in a single-bond geometry to one C(36) atom. In the sixteenth H site, H(55,56,57) is bonded in a single-bond geometry to one C(34,38,42,46) atom. The H(55,56,57)-C(34,38,42,46) bond length is 1.14 Å. In the seventeenth H site, H(58,59,60,64,65,66,70,71,72) is bonded in a single-bond geometry to one C(40) atom. In the eighteenth H site, H(61,62,63) is bonded in a single-bond geometry to one C(34,38,42,46) atom. The H(61,62,63)-C(34,38,42,46) bond length is 1.14 Å. There are twenty-four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in an L-shaped geometry to one Cd(1) and one Cd(2) atom. In the second Cl site, Cl(2) is bonded in an L-shaped geometry to one Cd(12) and one Cd(2) atom. In the third Cl site, Cl(3) is bonded in an L-shaped geometry to one Cd(4) and one Cd(5) atom. In the fourth Cl site, Cl(4) is bonded in an L-shaped geometry to one Cd(5) and one Cd(9) atom. In the fifth Cl site, Cl(5) is bonded in an L-shaped geometry to one Cd(7) and one Cd(8) atom. In the sixth Cl site, Cl(6) is bonded in an L-shaped geometry to one Cd(3) and one Cd(8) atom. In the seventh Cl site, Cl(7) is bonded in an L-shaped geometry to one Cd(10) and one Cd(11) atom. In the eighth Cl site, Cl(8) is bonded in an L-shaped geometry to one Cd(11) and one Cd(6) atom. In the ninth Cl site, Cl(9) is bonded in an L-shaped geometry to one Cd(13) and one Cd(14) atom. In the tenth Cl site, Cl(10) is bonded in an L-shaped geometry to one Cd(14) and one Cd(24) atom. In the eleventh Cl site, Cl(11) is bonded in an L-shaped geometry to one Cd(16) and one Cd(17) atom. In the twelfth Cl site, Cl(12) is bonded in an L-shaped geometry to one Cd(17) and one Cd(21) atom. In the thirteenth Cl site, Cl(13) is bonded in an L-shaped geometry to one Cd(19) and one Cd(20) atom. In the fourteenth Cl site, Cl(14) is bonded in an L-shaped geometry to one Cd(15) and one Cd(20) atom. In the fifteenth Cl site, Cl(15) is bonded in an L-shaped geometry to one Cd(22) and one Cd(23) atom. In the sixteenth Cl site, Cl(16) is bonded in an L-shaped geometry to one Cd(18) and one Cd(23) atom. In the seventeenth Cl site, Cl(17) is bonded in a water-like geometry to one Cd(1) and one Cd(19) atom. In the eighteenth Cl site, Cl(18) is bonded in a water-like geometry to one Cd(22) and one Cd(4) atom. In the nineteenth Cl site, Cl(19) is bonded in a water-like geometry to one Cd(13) and one Cd(7) atom. In the twentieth Cl site, Cl(20) is bonded in a water-like geometry to one Cd(10) and one Cd(16) atom. In the twenty-first Cl site, Cl(21) is bonded in a water-like geometry to one Cd(18) and one Cd(3) atom. In the twenty-second Cl site, Cl(22) is bonded in a water-like geometry to one Cd(15) and one Cd(6) atom. In the twenty-third Cl site, Cl(23) is bonded in a water-like geometry to one Cd(21) and one Cd(9) atom. In the twenty-fourth Cl site, Cl(24) is bonded in a water-like geometry to one Cd(12) and one Cd(24) atom. Linkers: 23 CC1=NN=N[N]1. Metal clusters: 24 [Cd]. The MOF has largest included sphere 9.95 A, density 2.00 g/cm3, surface area 2830.08 m2/g, accessible volume 0.19 cm3/g