MMs03681678 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3037 -0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9018 -0.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9112 -2.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2149 -2.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5092 -2.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4998 -0.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0491 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8333 0.6491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0978 -0.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6958 -0.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7053 -2.1763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 -2.9345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1073 -2.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 -2.9509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8224 -4.4508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0818 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3058 1.8002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7839 3.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7408 4.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2197 4.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7416 2.7042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3416 3.7434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2204 2.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1773 3.6081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5934 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5934 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5382 -1.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0809 -1.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8758 -2.8319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2225 -4.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0307 -2.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1923 0.6327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3883 0.6654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7483 -2.7698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4185 -4.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6224 -4.4584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 -5.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0224 -4.4433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7156 1.6923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3134 0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7485 2.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0068 4.1209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6979 4.9551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1442 5.4918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2121 5.3104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4001 4.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7846 1.5490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7423 1.0467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9253 0.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 53 54 1 0 0 0 0 M END