MMs01096846 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 36 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 1.3047 0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3161 2.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6208 2.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9141 2.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 0.7204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3257 0.2461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6879 -0.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2166 1.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3441 2.6731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7165 1.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4567 0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9566 0.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6967 -1.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1967 -1.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9565 0.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2164 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7164 1.4187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9763 2.7234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4764 2.7348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7362 4.0395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9368 -2.4953 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5921 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0438 -0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 -1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2814 2.8479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6299 4.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5889 -1.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8488 -0.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0889 -2.2139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1565 0.0936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8243 2.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M END