PUBCHEM-ZINC06166646 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.1770 2.7320 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 1.2680 -0.7440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2860 0.9870 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 1.0240 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.1660 0.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 0.3920 -1.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -0.5650 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -0.7230 -2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.3670 -3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -2.4160 -4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -3.0260 -4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -2.9110 -5.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -3.4960 -5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -4.1970 -4.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -4.3280 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -3.7450 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -4.7460 -4.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -5.2150 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -0.7500 -3.1440 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 0.4780 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 1.2740 -1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 3.1430 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 2.8460 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 3.3490 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -2.9000 -4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.3560 -6.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -3.4010 -6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -4.8640 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -3.8410 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 2.0190 1.4810 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 M CHG 1 30 -1 M END