PUBCHEM-ZINC05589455 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 0.1090 1.0580 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.0390 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -0.2930 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 0.3920 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.4150 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 1.7470 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 2.1110 -0.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 3.4520 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 4.2910 -0.2080 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 4.1320 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 5.5320 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 6.2200 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 7.6010 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 8.3000 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 7.6160 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 6.2350 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 9.6500 0.1180 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 0.0350 -2.1980 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7660 -0.9300 -2.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 0.7050 -2.0210 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8140 1.3190 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -0.4980 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -1.0900 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 2.5430 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 1.6280 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 3.6520 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 5.6760 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 8.1360 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 8.1620 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 5.7020 -1.5830 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 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 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END