IBS-ZINC03984723 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.1490 1.6920 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.5310 -1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 0.0860 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 0.8500 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 2.0240 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 2.4470 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 2.5380 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 1.6570 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 0.6500 -2.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -0.1300 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 3.7980 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 3.6110 1.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6790 2.6920 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 4.8060 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 4.7690 3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 3.5520 1.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 3.0130 3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 2.2810 3.9210 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5530 2.6980 5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 2.3710 6.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 3.4480 5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 3.9140 7.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 4.5700 7.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 4.7510 6.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 4.2850 5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 3.6440 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 3.1960 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 3.0110 3.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 0.5460 3.8620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 2.0160 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.0420 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -0.8210 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 3.3460 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 1.6700 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 4.1290 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 4.5880 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 2.3540 3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 3.7690 7.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 4.9370 8.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 5.2620 7.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 4.4360 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 5.6580 1.1900 O 0 5 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 9 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 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 42 -1 M END