MMs02698409 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 30 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 -0.7604 1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0209 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4791 2.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2395 1.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7394 1.3291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7393 1.3532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2393 1.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2602 -1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7602 -1.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0206 -2.5257 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5205 -2.5136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2811 -3.8307 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.4997 0.0844 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 2.6342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2185 3.9392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2186 3.9151 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5916 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9604 1.2833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6292 3.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1083 -1.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 -1.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 2.3876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8309 2.4093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1686 -2.2888 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 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 19 20 3 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END