MMs00029487 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 65 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 1.2949 -0.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2866 -2.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0144 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 0.5856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6063 1.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3115 2.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9095 2.2284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9178 3.7283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8929 -0.7716 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8846 -2.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5814 -3.0143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1794 -3.0287 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1794 -1.8287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4826 -2.2860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7775 -3.0431 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8167 -3.6431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7692 -4.5431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -5.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1711 -4.5287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -5.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5731 -4.5143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8597 -6.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5565 -7.5143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5482 -9.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -9.7714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0807 -2.3004 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 -0.8004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6870 -0.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8355 -2.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3010 -2.6274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0582 -1.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0607 -0.2123 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6057 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6057 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2556 -1.3572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0866 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2799 -3.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4865 -2.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1178 3.7217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9245 4.9283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7179 3.7350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9354 -0.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7164 -1.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2591 -1.3710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9521 -4.3413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1733 -5.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2322 -6.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6896 -6.2009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0426 -6.5697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2638 -7.9014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1523 -6.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3736 -7.7161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1166 -2.9061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6259 0.8659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1686 0.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9393 -3.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7830 -3.7263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2523 -1.2137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -9.7570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2383 -10.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 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 16 27 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 19 52 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 63 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 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 34 35 1 0 0 0 0 34 62 1 0 0 0 0 63 64 1 0 0 0 0 M END