MMs00382413 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 -0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0025 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5981 -1.2025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5995 1.4975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8964 -0.7537 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1976 1.4951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4945 -0.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0074 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0926 -0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2479 -2.2506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7149 -2.5638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4661 -1.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4634 -0.1498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7767 1.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2037 1.7793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5170 3.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4032 4.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9762 3.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6629 2.3219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2359 1.8597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1222 2.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4354 4.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 -1.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7092 0.1882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1762 -0.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3316 -1.6170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9607 -2.2258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6474 -3.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 0.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5261 -1.6698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0688 -1.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7995 1.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6006 2.6975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3995 1.4987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8953 -1.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7223 -1.6747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2649 -1.6761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6492 1.3774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6586 3.6159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6538 5.4245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0852 4.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4853 1.8474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 3.3150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 4.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6860 5.5049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 4.5820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4657 0.7366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0687 0.6771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4739 -3.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3968 -4.8662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8209 -3.9433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END