MMs01980496 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 0.7579 -1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0158 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7737 -3.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2737 -3.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0158 -2.5797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 -1.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2548 -0.1645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6288 -0.7662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4811 -2.2589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9232 -0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9141 1.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2085 2.2496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5121 1.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5212 0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2268 -0.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8248 -0.7345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1193 0.0234 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3614 1.3178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8772 -1.2711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4137 0.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7173 0.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0117 0.7971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0026 2.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6990 3.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4046 2.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2970 3.0550 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0356 0.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6063 1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0356 -0.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1841 -2.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1801 -4.9353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -4.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3777 -3.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8712 2.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2012 3.4495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5476 2.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2341 -1.9504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8321 -1.9345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7246 -1.1608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0546 0.2035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6917 4.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3617 2.8749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END