MMs02809229 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 -0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2512 1.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5025 2.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0025 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7488 1.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7463 3.8978 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7512 1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6318 0.0811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0588 0.5433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0602 2.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6341 2.5082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2746 2.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6443 2.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8587 3.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0730 4.0734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7997 0.8205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5853 -0.0601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1694 0.2091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3248 -1.2829 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.3640 -0.6829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2091 -2.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8179 -3.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3099 -3.5010 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.6459 -4.9629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7584 -3.8906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6231 -2.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1035 3.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9488 1.3009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2599 -1.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0289 -0.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1503 4.1173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1409 0.9135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5047 -1.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1693 -2.8845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6763 -4.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0663 -4.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1122 -0.9383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7640 -2.4060 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 3 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M END