IBS-ZINC02228395 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 1 0 0 0 0 0999 V2000 0.1600 1.6780 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 0.1570 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -0.3740 -1.1340 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 1.2630 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 2.1070 -0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4640 3.1300 1.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4810 3.2010 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 4.3070 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 3.8960 -0.5540 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 2.9980 2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 1.9300 3.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 2.0270 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 2.0880 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.2280 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -0.2330 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 1.1560 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 1.6690 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 5.2500 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 4.4150 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 1.9170 0.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 1.1010 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 3.9770 3.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 22 -1 M END