PUBCHEM-ZINC02574817 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0480 1.3980 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 1.6200 -0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 0.9320 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 0.0220 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -0.1990 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 0.4880 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -1.1740 2.0590 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0040 -1.4650 2.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -1.6850 2.0770 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8730 -0.8560 -0.1260 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -0.2040 0.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -2.2360 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -0.6230 -1.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 0.4430 -1.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -0.1680 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2140 -0.8860 -3.8210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 -2.0110 -3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -1.4800 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 -1.3140 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -1.9820 -5.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0430 -2.4050 -6.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3470 -2.1420 -6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5580 -1.4410 -4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 -1.0420 -4.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.9390 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 2.3310 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 1.1050 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 0.3150 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 1.2130 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 0.8780 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 0.6240 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 -0.8630 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -2.5550 -4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -2.6800 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.3150 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -0.8970 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8440 -2.9500 -7.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1800 -2.4760 -6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5620 -1.2200 -4.5700 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 27 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 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END