IFLAB-ZINC02454611 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -1.3080 3.4050 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 2.0890 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.2310 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 1.6890 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 3.0140 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 3.8690 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 3.4820 0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 4.7870 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 5.5750 -0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 5.2670 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 6.7760 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 7.2430 -0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 7.2700 -1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 6.9170 -2.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4630 7.7570 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 7.8940 -2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6370 8.5460 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6960 8.3240 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9110 8.9400 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0840 9.7760 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0390 10.0000 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8170 9.3960 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6170 10.5460 -1.7700 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.7260 8.1280 0.0680 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 7.6500 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 7.6980 2.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 0.8460 -0.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 4.0730 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 1.7310 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 0.2040 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 4.8980 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 2.8670 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 5.0470 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 4.7580 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 6.9960 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 7.2850 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 7.5230 -3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 7.6720 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7290 8.7700 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1820 10.6530 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 9.5750 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.8300 -1.5130 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 33 1 0 0 0 0 10 34 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 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 42 1 0 0 0 0 M END