PUBCHEM-ZINC05980296 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -1.5860 0.7410 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.7710 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.0400 1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -2.3460 2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -3.3460 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -4.6740 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -5.0110 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -4.0100 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -2.6780 3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -4.3470 4.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -3.3960 5.6300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -3.1170 6.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -4.0150 6.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -1.8580 5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -0.6910 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 0.5150 4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 0.5550 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -0.6120 3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -1.8180 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 -3.0670 4.1170 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1760 -3.0180 3.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -4.1430 4.4050 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6770 -6.3190 3.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -7.2920 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -8.6950 2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.1540 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 0.9460 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 1.2000 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -1.1850 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -1.2300 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -3.0850 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -5.4500 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -1.8990 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -5.1380 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -0.7220 5.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 1.4270 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 1.4970 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -0.5810 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -7.1410 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -7.1870 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -9.4380 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -8.8470 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -8.8000 3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END