PUBCHEM-ZINC04879171 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0790 0.6300 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.6160 -0.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -0.6300 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 0.5820 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 1.4080 -0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 2.8310 -0.9200 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0050 3.1990 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 3.3360 -2.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3370 3.4170 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 4.7400 -2.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2400 5.1840 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 4.5470 -1.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3570 4.1950 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 3.4760 -0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 5.7530 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 5.3530 0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 4.4650 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 5.6310 -1.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 5.6270 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 2.6640 -3.2460 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3820 0.7910 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 1.8410 0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -0.3590 0.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -0.2640 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.5950 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -2.8850 1.5090 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -1.7120 0.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.5810 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 1.0390 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 6.1000 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 6.5820 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 20 -1 M END