PUBCHEM-ZINC02954867 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 0.8240 0.8530 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 2.6610 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 3.1680 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 1.8810 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 1.4040 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 3.7370 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 5.2500 5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 5.7860 3.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 7.2190 3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 7.7180 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 7.4280 2.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 7.5650 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 8.3070 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 8.4210 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 7.8040 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 7.0670 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 6.9560 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 6.1660 2.5720 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6790 5.1250 2.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 6.5730 3.1770 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9150 0.7670 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 1.5150 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.1480 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 3.3940 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 2.5960 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 2.5090 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 4.1810 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 2.0160 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 1.1750 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 0.4080 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 2.0720 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 3.2000 5.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 3.5170 5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 5.6700 5.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 5.5010 5.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 7.6060 4.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 7.5400 3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 8.8010 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 7.1990 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 8.8240 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 9.0060 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 7.9060 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6820 6.5920 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.3390 2.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 3.2190 3.7860 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4630 3.9300 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 44 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 45 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 45 1 M END