MMs02427753 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 64 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 1.2983 -0.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 -2.2513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5951 -3.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5935 -4.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8918 -5.2539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -2.4063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1916 -4.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 -3.0052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8948 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8964 -0.7539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4899 -5.2565 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2938 -5.2513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -3.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0422 -3.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3013 -2.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6011 -2.9974 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8994 -2.2461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1992 -2.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4975 -2.2435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4959 -0.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8979 -0.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7927 1.5078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 -0.7409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0105 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.3923 -1.1895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3908 1.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6891 2.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6876 3.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9858 4.5131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6921 -0.7382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9904 0.0131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 1.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0386 0.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3005 -0.5193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2983 0.4487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6379 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9991 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4887 -6.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5297 -4.6576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2926 -6.4513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4161 -5.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1861 -4.2904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9152 -1.7895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0717 -1.3287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6023 -4.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2004 -4.1948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5373 -2.8424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1949 1.2052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -0.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0952 -1.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2092 1.3009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9792 2.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1006 1.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8706 2.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3878 4.5105 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -11.6936 -2.2382 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 9 2 0 0 0 0 8 10 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 35 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 61 1 0 0 0 0 35 36 2 0 0 0 0 35 62 1 0 0 0 0 M CHG 1 61 -1 M CHG 1 62 -1 M END