PUBCHEM-ZINC05415470 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.0270 1.2230 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.2440 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -1.1960 1.5050 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -2.5570 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -1.9610 1.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8970 -1.3410 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -0.8980 -0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -3.0440 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -3.8410 2.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -4.9390 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -5.2560 1.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -5.6210 3.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -6.8690 4.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -7.4030 5.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -6.6680 5.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -0.3980 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.6530 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8310 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 1.3540 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -3.2860 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -3.0630 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -2.5960 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -3.6820 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -5.2660 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -6.6830 4.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -7.6010 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -0.0130 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -1.4450 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 0.1650 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -8.4950 5.7920 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 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 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 M CHG 1 30 -1 M END