MMs02405758 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 70 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 1.4210 -0.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5475 0.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9685 0.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0951 1.0199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5161 0.5394 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 6.0356 -0.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9965 1.9604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0061 3.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4866 4.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4962 5.6345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9766 7.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9370 0.0590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2314 -1.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6524 -1.8923 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8039 -2.7408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0990 -3.3243 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0597 -3.9243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5989 -3.3421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7580 -3.6527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0793 -1.9211 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0793 -0.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8763 -1.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5113 -1.4746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.7143 -2.3706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9382 -1.5034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4916 -0.0714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9917 -0.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2572 1.2543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0573 1.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0226 2.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5225 2.5265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2570 1.2186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7569 1.2008 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.0454 -4.7741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8215 -5.6413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6185 -4.7452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9896 -6.8895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5331 -6.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3844 1.1368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1368 0.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3844 -1.1368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8451 -1.5332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3577 -1.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6108 1.2599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1235 1.5627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 -1.0233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9053 -0.7205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2561 2.1502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9534 3.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5393 3.9320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2365 5.4447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7462 4.6977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4434 6.2104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1134 6.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3610 8.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8398 7.4398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0318 -1.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0503 -2.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7000 -3.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4350 3.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9911 -6.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3242 -7.8881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9882 -7.5550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4767 -7.5310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1023 -8.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5894 -6.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 51 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 53 1 0 0 0 0 11 54 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 58 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 M END