MMs00247933 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 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 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2414 1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4829 2.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0171 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7585 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 3.8921 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7414 1.3237 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7512 -0.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7315 2.8237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2413 1.3336 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9828 2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4827 2.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2413 1.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 0.0494 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6998 0.0494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2584 -1.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7512 -1.3916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0727 -2.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7786 -3.6153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6573 -2.6190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4470 -3.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7411 -2.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8624 -3.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2613 -5.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7685 -4.9230 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5931 -1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1068 -1.0254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 3.6511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 1.2862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8525 3.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1834 3.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2666 3.8278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6076 3.0652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1554 2.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1656 0.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 -0.3783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 -1.1409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8586 -1.5051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0345 -3.4384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8681 -6.1052 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 M END