IFLAB-ZINC05258961 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -0.5850 -0.0940 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.1790 -0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -2.1190 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -2.3230 0.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -3.1320 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -3.9220 -0.2970 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -3.3200 2.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -4.2200 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -4.2360 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -5.1240 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 -5.9990 2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -5.9870 3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -5.0920 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -6.8730 4.9060 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6140 -7.1890 5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -6.7480 5.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 -8.0920 6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -8.2900 7.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5960 -8.6610 6.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 -9.2880 8.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 -8.9640 9.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 -6.9880 7.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3760 -5.6400 8.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9740 -5.4990 9.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 0.1260 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 0.5780 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -1.3980 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -3.0760 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -1.6910 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -1.8760 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -2.8310 3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -3.5550 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6160 -5.1360 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -6.6920 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -5.0780 4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -7.2590 5.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -7.6380 7.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -9.0580 6.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2740 -7.1340 6.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2560 -7.7880 8.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4630 -5.5910 8.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 -4.8350 7.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -4.6650 10.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 -10.5370 8.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 -7.0080 7.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -6.2360 7.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -11.1420 9.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 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 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 45 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 44 47 1 0 0 0 0 45 46 1 0 0 0 0 M END