MMs03189260 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 53 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 1.5000 -0.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2526 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5051 2.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2577 3.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7577 3.8897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5051 2.5892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7526 1.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0051 2.5862 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4051 1.5470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8844 1.3710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3119 1.8317 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3119 0.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7376 1.3653 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.9376 1.3653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6216 2.5771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7423 3.7924 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8938 4.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3149 3.3317 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7149 4.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8892 3.7980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2087 5.2181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6362 5.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6391 7.1788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9397 7.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2372 7.1736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2343 5.6736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9337 4.9262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9426 9.4262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2135 7.6451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3294 6.4333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1983 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6649 -0.3769 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.1256 -1.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0024 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0024 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3051 2.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6597 4.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3597 4.9278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3505 0.2512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2723 5.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9830 10.0241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9046 10.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0096 -0.2268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1540 -1.2613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9836 -2.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4942 -2.9464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2676 -1.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 30 31 2 0 0 0 0 32 33 1 0 0 0 0 32 45 1 0 0 0 0 32 46 1 0 0 0 0 33 34 1 0 0 0 0 34 47 1 0 0 0 0 34 48 1 0 0 0 0 34 49 1 0 0 0 0 M END