IFLAB-ZINC04087162 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0960 1.6590 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 0.1340 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.3740 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -1.9270 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -2.3370 -2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -1.8030 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -0.7760 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -0.3430 -2.9390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -1.4740 -4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -2.2410 -4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -3.3140 -5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -3.5020 -5.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -4.1400 -5.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -1.5290 -5.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -0.8350 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -0.0940 -4.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 -1.1160 -6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -0.1110 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 2.0850 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 2.0120 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 2.0660 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.2150 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.4670 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -0.0020 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -0.0290 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.1120 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -2.4670 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -3.4300 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -1.9470 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -4.0760 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -4.8760 -6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -2.1390 -5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 -2.1560 -6.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -0.9370 -7.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 -0.4560 -6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -0.4770 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 0.9770 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.4310 -1.1430 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2750 0.0350 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 38 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END