MMs02439471 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 -0.7433 -1.3029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0134 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5134 -2.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 -1.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7567 -1.2796 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5134 -2.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7701 -3.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2701 -3.8854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5268 -5.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0268 -5.1651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7701 -3.8622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0134 -2.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -3.8544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7835 -6.4757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2433 -1.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9865 -2.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4865 -2.6213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2432 -1.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2567 1.2874 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7567 1.2951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0134 2.5825 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.7432 -1.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4865 -2.6368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0465 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3999 0.9927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7432 -1.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2431 -1.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9864 -2.6601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4864 -2.6678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7566 1.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2566 1.2409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0423 -0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5946 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1121 -3.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2279 -3.7787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6513 -0.2513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8754 -4.8905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8647 -2.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5835 -6.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3889 -7.5118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3812 -3.6497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0811 -3.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1053 1.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9053 1.0035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6134 -1.7540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9454 -2.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0409 -0.1744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3729 -0.9526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2297 -3.9552 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -9.0133 2.5515 0.0000 O 0 5 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 16 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 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 41 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 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 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 34 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 54 1 0 0 0 0 34 35 2 0 0 0 0 34 55 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 54 -1 M CHG 1 55 -1 M END