PUBCHEM-ZINC06403322 MOE2007 3D CORINA 3.40 0006 02.08.2006 20 19 0 0 1 0 0 0 0 0999 V2000 -0.1320 1.4890 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0130 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5560 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.9070 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.6630 0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.3900 0.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4380 -1.9080 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -2.1820 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -3.3430 -1.4140 S 0 5 0 0 0 0 0 0 0 0 0 0 -2.9380 -3.8680 0.4040 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8100 -4.1470 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -4.1010 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -4.3720 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 1.9500 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 1.7330 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 1.9330 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.4460 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.2430 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -1.1290 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -2.3660 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 1 0 0 0 0 8 19 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 13 1 0 0 0 0 M CHG 1 9 -1 M CHG 1 10 1 M END