PUBCHEM-ZINC05761659 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0280 1.3710 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.1520 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.8000 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -0.5660 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -0.2530 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.6600 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -1.3930 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -1.8330 4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -2.5670 5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -2.8690 5.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -2.4380 4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -1.7110 3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.2880 2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.7950 4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -4.1250 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -2.8370 5.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -1.4750 4.9730 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -2.1300 3.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -0.0150 4.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 1.8060 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 1.6520 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 1.8340 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -0.5040 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -0.4560 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -1.8910 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.5580 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 0.3050 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -0.3900 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -2.9100 6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -3.4530 6.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -1.5330 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -2.0090 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -4.9510 4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -4.3630 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.0940 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -1.9210 6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -2.9260 5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -3.6920 6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -2.0890 6.2710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 39 1 0 0 0 0 M CHG 1 39 -1 M END