MMs02594708 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 -0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2441 -1.3091 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8441 -2.3484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4883 -2.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2325 -3.9072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7441 -1.3159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7558 1.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7558 1.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2558 1.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2441 -1.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 -1.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2557 1.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7482 1.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7469 0.2793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0667 2.8643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7710 3.6202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6209 5.1126 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6518 2.6215 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.4397 3.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0054 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0054 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2969 1.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6295 0.3986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3394 -2.3578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1605 2.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8604 2.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8394 -2.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1394 -2.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0952 -1.0891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9229 2.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5382 3.9514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9566 4.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0117 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6164 -3.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 39 40 1 0 0 0 0 M END