CHEMBRIDGE-ZINC04991614 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 1.0980 1.3270 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -0.0810 -0.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -0.6880 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -2.0540 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -2.6730 1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -1.9270 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -0.5560 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 0.0570 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -2.5900 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 -1.9100 4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -3.0510 6.1410 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -4.3590 5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -3.8830 4.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -5.7700 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -6.1490 6.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -7.5710 7.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -8.5340 6.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -9.8800 6.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -10.9060 5.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -12.2010 6.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -12.5230 7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -11.5550 8.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -10.2060 7.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -9.2400 8.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 -7.9770 8.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -6.7760 9.7950 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -6.7430 4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -7.5160 4.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 1.5320 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 1.6840 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.8380 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -2.6320 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -3.7360 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 0.0260 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 1.1180 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -0.8510 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -5.4020 7.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -8.2530 5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -10.6690 4.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -12.9890 5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -13.5580 7.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -11.8220 9.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 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 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 3 0 0 0 0 M END