IFLAB-ZINC02692947 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.5630 1.2530 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.1400 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.5130 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -1.7870 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -2.6990 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -2.3160 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -1.0380 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -3.2940 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -4.0670 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -4.9700 -0.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -4.3250 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -5.5570 -2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -5.5620 -4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -6.6520 -5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -6.4100 -6.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -5.1100 -7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -4.1050 -6.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -4.2780 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -3.0950 -3.5970 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -4.8480 -8.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -8.0560 -4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -6.6840 -2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -2.1920 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 1.2670 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 1.5540 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 1.9440 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 0.1940 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -0.7390 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -3.2770 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -3.0160 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -4.2970 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -7.2260 -7.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -4.6630 -8.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -3.9750 -8.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -5.7150 -9.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -8.2730 -4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -8.7610 -5.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -8.1480 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -6.9080 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -2.0580 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -3.2390 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -1.5730 -0.0660 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 22 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 21 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END