MMs02207818 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 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 -0.0079 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2871 -2.2568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5901 -1.5137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8852 -2.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8772 -3.7706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1881 -1.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4832 -2.2843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7862 -1.5412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4991 0.7156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3109 -2.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3188 -3.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6218 -4.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9169 -3.7293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -2.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -1.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -1.4725 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.6298 -5.9862 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3347 -6.7430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9327 -6.7293 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0063 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5965 -0.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4769 -3.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8222 -2.1467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8365 0.5533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5054 1.9156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2828 -4.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9593 -4.3238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6341 0.6192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 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 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END