MMs00656640 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 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 -1.2954 -0.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6052 1.4876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3098 2.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0072 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9078 2.2314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 3.7314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2033 1.4752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5059 2.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8013 1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4915 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0896 -0.7934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0824 -2.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3779 -3.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6805 -2.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6876 -0.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 -0.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9759 -3.0620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2785 -2.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2857 -0.8182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5740 -3.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7236 -4.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1894 -4.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9455 -3.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9472 -2.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.4381 -3.4406 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0421 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2897 -1.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6344 -0.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3155 3.4438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0292 2.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7389 3.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2816 3.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2171 2.5884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9821 1.2488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2585 -1.7039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7158 -1.6966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0153 0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7803 -1.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0403 -2.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3721 -4.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7297 -0.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3979 1.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9702 -4.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8280 -5.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6722 -5.9843 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 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 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 M END