COMGENEX-ZINC06870593 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0270 1.5030 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0100 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4900 -0.4960 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.5260 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -0.8220 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -0.6600 -0.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -1.0630 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -0.0710 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 0.0390 -2.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 0.5540 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.4000 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -0.3030 1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -1.1390 1.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8010 -2.0230 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -1.6100 2.9570 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.1960 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 0.1830 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 0.8900 2.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -0.3490 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -0.8560 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 0.0650 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 1.3200 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 1.3840 0.8980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.8900 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.7150 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.9800 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -2.0670 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -1.0470 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -0.4280 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 0.9050 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 0.6480 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 1.5330 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 0.0550 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -1.3360 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.5080 4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 0.6290 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -1.9050 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 -0.2110 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 2.1670 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END