IFLAB-ZINC04315259 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0300 0.4760 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -0.8470 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -1.3950 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -0.5880 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 0.7240 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.2950 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 1.2160 0.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 2.1520 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 0.2180 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -0.8820 1.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 0.3750 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 0.5130 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8800 0.6370 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 1.6530 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 1.5390 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 2.0920 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1470 3.5730 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 4.3580 -0.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4860 3.8630 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0430 5.1270 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4360 5.1990 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0630 6.4090 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3030 7.5610 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9080 7.5110 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2880 6.2880 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 8.7530 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7050 9.7270 1.7400 F 0 0 0 0 0 0 0 0 0 0 0 0 10.7200 9.3200 -0.1570 F 0 0 0 0 0 0 0 0 0 0 0 0 9.9080 8.5040 1.6870 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 0.8780 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -1.4590 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -2.4210 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 2.3220 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 -0.5490 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -0.3570 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 1.3920 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -0.2620 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 0.8410 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 2.5390 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5650 0.7630 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 2.4850 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 1.3980 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0900 1.8770 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4470 1.4410 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1580 3.1060 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0590 4.3190 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1460 6.4530 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8060 8.4970 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2050 6.2770 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 1.7940 -0.2080 N 0 3 0 0 0 0 0 0 0 0 0 0 7.9100 2.6600 -0.5330 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 50 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END