PUBCHEM-ZINC06072802 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 -0.0460 1.4400 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.0710 -0.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4320 -0.5830 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -0.5390 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -1.5300 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -1.9850 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 -1.4580 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -0.4740 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -0.0150 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -0.0040 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -0.2520 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -1.5740 3.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -2.2520 4.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -1.9470 4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 -2.9180 5.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -4.1320 5.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -4.4180 5.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -3.4550 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -3.4980 3.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3550 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -1.9130 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 -5.1010 6.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -4.7270 8.4550 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 -5.9440 9.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -3.4990 8.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -4.3930 8.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -5.4500 9.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -5.1840 9.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.8730 9.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -2.8170 8.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -3.0740 8.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -3.6210 9.4170 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 1.7590 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 1.7190 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 2.0200 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -1.9580 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -2.7500 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -1.8110 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -0.0620 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 0.7590 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 1.0610 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -0.5820 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 -0.1320 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 0.4580 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -1.0080 4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 -2.7180 6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -5.3500 5.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.4660 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -2.1000 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -6.0830 6.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -6.4730 9.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -5.9870 9.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -1.8030 8.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -2.2480 8.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -0.4210 1.1980 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2110 0.0850 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 55 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 55 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END