IFLAB-ZINC04139282 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 1.0090 1.1210 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.1860 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -0.6160 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -1.8510 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -2.6750 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -2.2540 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.0210 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -3.0980 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -3.0440 -3.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -3.9360 -2.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -4.8650 -3.9310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4060 -4.2440 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -5.3710 -4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -5.9850 -3.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2140 -5.4910 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -6.7840 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -6.5930 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -7.5200 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -8.3980 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -8.1070 -2.4510 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -7.7840 -4.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -8.6940 -5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -7.9220 -6.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -7.1170 -7.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -6.1290 -6.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 0.9730 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.5570 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 1.8470 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 0.0090 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -2.1740 1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -3.6460 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.7080 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -3.9090 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -5.8210 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -4.5330 -4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -6.0990 -5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -5.8160 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -7.5440 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -9.2010 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -8.3810 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -7.1160 -4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -9.3040 -5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -9.3760 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -6.5670 -8.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -7.7650 -7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -5.4470 -5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -5.5720 -6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -6.8860 -4.8340 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2430 -7.4990 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 48 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 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END