MMs02639987 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.5000 -0.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 1.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5171 2.5881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2757 3.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7757 3.8723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5171 2.5683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7585 1.2742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7413 -1.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9827 -2.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7241 -3.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2241 -3.9515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9826 -2.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2412 -1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2584 1.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7584 1.2544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2412 -1.3733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2583 1.2247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7511 1.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0727 2.8367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7786 3.5953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6573 2.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3172 2.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6826 4.9253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3825 4.9075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 2.5604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -1.0650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7827 -2.6297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1172 -4.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8172 -4.9947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1826 -2.6654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8653 2.2797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5482 0.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1721 3.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4852 2.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 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 25 26 2 0 0 0 0 26 42 1 0 0 0 0 M END