CHEMBRIDGE-ZINC04980560 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0500 1.3540 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0270 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -0.6890 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 0.0280 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 1.4150 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 2.0760 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 2.1420 -0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 3.5860 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 4.3490 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 2.4740 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 1.7100 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7650 4.6820 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 4.5030 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 3.6890 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3100 3.5240 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 4.1730 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 4.9880 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 5.1500 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5040 2.6510 -3.6840 N 0 3 0 0 0 0 0 0 0 0 0 0 10.8830 2.0790 -2.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1080 2.5050 -4.7320 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2210 -2.1930 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -2.6900 -0.1200 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.7000 -1.1320 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -2.5870 1.1450 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 1.8680 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.5900 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 -0.4900 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 3.1550 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 3.8140 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 3.8840 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 5.4190 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 4.1430 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 2.2460 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 2.1760 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 0.6410 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 1.9170 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 4.3240 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 5.7390 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9630 3.1810 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 4.0430 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 5.4950 -5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 3.9170 -1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 5.9470 -3.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 6.8840 -3.3610 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 43 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END