MMs01838605 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 -0.7408 1.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0183 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5183 2.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2591 1.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7591 1.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7407 -1.3255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7407 -1.3466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2406 -1.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9815 -2.6615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2589 1.2197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2406 -1.3784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7405 -1.3889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4997 -0.0952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9996 -0.1058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7404 -1.4101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9813 -2.7038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4813 -2.6932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7222 -3.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4630 -5.2912 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2774 3.8811 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6073 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9408 1.3128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5743 3.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0926 -1.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 2.4558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8896 1.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6072 0.9927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1334 -2.3816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4071 0.9800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6662 2.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6332 -2.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9070 0.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6069 0.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9404 -1.4186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5740 -3.7473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2222 -3.9764 0.0000 O 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 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 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 2 0 0 0 0 M CHG 1 25 -1 M END