MMs00630925 MOE2007 2D CORINA 3.40 0006 02.08.2006 27 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 -1.1343 0.9815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8515 2.4546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5656 2.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 1.9647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4171 0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1171 2.4564 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9859 3.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8586 4.9306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2407 5.5135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2222 4.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4466 3.0952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4281 1.9609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8102 2.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6829 4.0384 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.0942 1.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4763 2.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4578 1.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6822 -0.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2215 0.2737 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2262 -1.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2681 0.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7919 4.1247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3246 -0.2935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7489 3.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6534 1.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1485 -1.1728 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 M END