MMs02995726 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -1.5000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2415 1.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 2.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0169 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7584 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2246 3.9117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7245 3.9215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4661 5.2253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 5.2351 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9758 3.7351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9563 6.7351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 5.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2244 3.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7244 3.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4659 5.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7075 6.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2075 6.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9659 5.2742 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.4661 5.2058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2077 6.5097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4492 7.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0508 7.7941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7923 6.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0338 5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1067 -1.0255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4415 1.3215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6237 3.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9584 1.2863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8593 6.2606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6312 2.9076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3312 2.9252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3007 7.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6008 7.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4076 6.5175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0424 8.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9923 6.4824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6271 4.1529 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END