IBS-ZINC05100473 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 0 0 0 0 0 0999 V2000 0.0450 1.3700 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.0080 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -0.6920 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 0.0200 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 1.3980 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 2.0720 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 2.2860 0.5540 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.1730 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -2.9600 0.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -4.2160 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -4.2720 0.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -2.9180 0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -5.4810 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -5.6270 0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -6.6150 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -7.9340 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -8.9450 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -10.2330 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -11.1750 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -10.8510 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -9.5780 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -8.6270 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -12.0450 0.4160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -5.8760 0.0900 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 1.9010 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.5550 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -0.5060 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 3.1500 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -8.2410 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -10.4870 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -12.1690 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -9.3330 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -7.6370 1.0910 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 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 28 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 29 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 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 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 32 1 0 0 0 0 22 33 1 0 0 0 0 M END