MMs02556855 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 C 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 1.5000 0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2701 -3.8854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7701 -3.8777 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1701 -4.9169 0.0000 H 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 3.7567 -1.2797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0133 -2.5671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7566 -1.2642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2566 -1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0133 -2.5516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2431 1.3571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7431 1.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4998 0.0697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7565 -1.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2566 -1.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9998 0.0774 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.5268 -5.1729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9237 -6.5463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4581 -6.8657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0436 -7.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0514 -9.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3543 -9.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6494 -9.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6417 -7.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3388 -6.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0193 -5.3219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0173 -4.2021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9433 -1.3091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5812 -3.6404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8567 -1.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0946 1.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1446 -4.3017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4846 -5.0661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6269 -0.8596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9589 -0.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3945 1.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6378 2.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3378 2.4072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3619 -2.2693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6619 -2.2833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0152 -9.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3605 -10.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6917 -9.6254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6778 -6.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 24 25 1 0 0 0 0 24 33 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 32 2 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 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 32 33 1 0 0 0 0 33 34 2 0 0 0 0 M END