IFLAB-ZINC05146550 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0740 1.6280 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.3960 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.3430 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 0.1460 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 1.3940 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.1300 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 1.9250 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 1.2410 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 3.1670 -1.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -0.5970 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -1.9370 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -2.5060 0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -2.7290 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -4.1930 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -4.9840 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -6.5920 -0.0610 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -6.0640 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -4.7320 1.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -4.3200 2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -5.4060 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -6.4590 2.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -5.4300 5.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -6.6210 5.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -6.6380 7.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -5.4750 7.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -4.2890 7.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -4.2620 5.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -5.5030 9.6160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 2.1970 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 0.0110 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -1.3020 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 3.0910 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 3.7120 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 3.5170 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 -0.1500 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 -2.5760 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 -2.3940 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -4.7080 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -3.3180 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -7.5290 5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -7.5610 7.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -3.3840 7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -3.3380 5.4060 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 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 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END