PUBCHEM-ZINC04773690 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 3.3760 -5.0170 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -4.1660 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -2.7880 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -2.2330 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 -3.1100 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -4.4890 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 -0.0600 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 -0.4020 -0.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 0.5250 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 0.8340 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1890 1.7110 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 2.2720 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 1.9540 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0610 1.0770 -2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 1.5730 0.5810 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 1.7980 1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -6.0870 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -4.5680 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -2.1450 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 -2.7410 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -5.1490 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2430 0.3960 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0140 1.9580 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8930 2.9590 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0010 2.3900 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 0.8270 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 2.8120 0.2900 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0270 -0.8410 0.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -0.3320 1.0730 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 27 -1 M END