MMs01359798 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 -1.2977 0.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2949 2.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3032 2.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3004 0.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8985 0.7429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 2.2429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4966 0.7381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7915 -1.5143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0946 0.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2542 2.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7219 2.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4696 1.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4638 0.1207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9611 1.0741 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.5926 3.0048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1906 3.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1879 4.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8875 5.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5898 4.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0022 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 0.1543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0077 4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3435 2.8457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5959 -1.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4231 -0.9274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9658 -0.9302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3639 3.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 3.6294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1233 1.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 1.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6031 1.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 3.2201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 4.3033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5963 5.6379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6571 6.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1145 6.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4084 4.2942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1773 5.6316 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 20 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 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 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 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 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END