PUBCHEM-ZINC03647395 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 -0.0450 -2.2260 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -1.9140 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.4240 0.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5310 0.1600 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -0.1120 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -1.0000 1.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 0.1290 -1.3230 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 1.9500 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 2.6590 -2.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8620 2.6150 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 4.1170 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 4.2670 -3.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -3.2880 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.0040 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -1.6500 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -2.5180 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -2.2480 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 2.2720 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 2.2000 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 1.0070 1.9130 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6950 4.8960 -1.4890 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1850 2.0190 -3.6290 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8710 1.8880 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 1.1550 -3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 2.7950 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 7 8 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 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M CHG 1 20 -1 M CHG 1 21 -1 M CHG 1 22 1 M END