MMs00507385 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 32 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 -1.3038 -0.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5884 1.5166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2846 2.2582 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0096 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9018 -0.7251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9114 -2.2251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0332 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4998 -0.7085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 0.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0979 -0.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1074 -2.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4112 -2.9336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7055 -2.1753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6959 -0.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3921 0.0663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9901 0.0829 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -10.4208 -4.4336 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.7246 -5.1753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1266 -5.1919 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0354 -0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3115 -1.9417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6238 2.1232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0526 2.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1884 1.2331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7864 1.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0721 -2.7985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7485 -2.7687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3825 1.5663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4179 2.1729 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 25 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 26 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 30 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END