IFLAB-ZINC01840418 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 0.0850 0.8180 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.4330 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -1.1210 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -0.1210 1.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 1.1460 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -2.4250 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -2.7020 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 -1.7870 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -0.5880 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -2.3080 -0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -3.6360 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 -4.5200 -0.6900 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -4.2890 -0.4060 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 -1.4480 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -1.2950 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -1.8500 1.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -0.5410 1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6900 -0.4810 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3910 -1.4680 3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9320 -1.4070 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7700 -0.3620 5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0710 0.6240 4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5380 0.5660 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8380 1.5330 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -2.6420 5.9410 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 1.4890 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -0.8330 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 2.0880 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -3.2020 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 -1.8980 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -0.4680 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 -0.0400 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 -2.2830 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1900 -0.3180 6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7250 1.4380 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 2.2850 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 24 36 1 0 0 0 0 M END