PUBCHEM-ZINC06184856 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 38 0 0 1 0 0 0 0 0999 V2000 -0.0890 1.6070 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.0840 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.6290 -0.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9780 -0.2830 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -2.1710 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -2.6830 0.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 2.2970 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.7990 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 4.3720 0.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 4.4360 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 3.8970 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 5.8830 0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7980 6.4090 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 6.3220 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 6.4890 2.3340 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 5.4950 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 6.1850 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 5.3060 -0.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 7.5010 -0.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 8.0240 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 9.5480 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 10.0720 -1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 1.9590 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8970 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.1810 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.2720 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 1.9160 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 2.0940 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 5.6010 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 7.2930 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 8.2230 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 7.7820 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 7.5100 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -2.6580 -1.0980 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0140 -0.3630 1.2520 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9060 0.1300 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 0.0100 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -1.3790 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 10.0730 -1.9820 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 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 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 35 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 35 1 M CHG 1 39 -1 M END