IFLAB-ZINC04315240 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 0.0290 2.8580 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.5440 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 0.7050 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.2110 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 2.5220 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 3.3790 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 2.6860 -0.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 3.5320 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 1.5070 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 0.6020 -1.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 1.2950 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 1.3720 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 1.1040 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 1.9980 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 2.2610 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 1.9730 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3450 2.9000 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0390 2.3190 3.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 3.3370 3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 4.6050 3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6110 4.1300 1.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 3.4890 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 1.1670 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -0.3150 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 4.4000 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 0.2760 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 2.3600 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 0.6400 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 1.2350 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9380 0.0930 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 1.0030 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7500 2.7610 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 2.1590 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 3.3010 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4790 2.3270 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2200 0.9220 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4200 3.1150 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 3.0620 3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7310 3.3990 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7490 5.3300 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5130 5.0830 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 2.0800 0.4750 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2440 3.0420 0.7940 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 42 1 0 0 0 0 15 33 1 0 0 0 0 15 34 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 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END