PUBCHEM-ZINC06910031 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 0.6870 -1.1200 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.5420 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 0.8930 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -1.4530 0.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5020 -2.4840 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -0.9810 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 -0.3480 1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -1.2910 2.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -0.9070 3.8870 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5200 -1.1650 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 0.5850 4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -1.6670 5.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -2.3420 5.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -1.4600 -0.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -2.3340 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -3.1850 -1.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.1740 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -1.3080 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -1.5240 -4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -0.9420 -5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3510 -1.3960 -6.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -2.4080 -7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -2.9960 -6.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -2.5370 -5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -2.9150 -4.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -3.9460 -4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -0.6910 -7.9020 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -0.5350 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.1520 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -1.1030 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -0.4850 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 1.3580 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 1.5130 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 0.9290 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -1.8450 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 0.8610 4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 1.1810 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 0.8800 5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -0.7750 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -0.5860 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 -0.1520 -5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -2.7530 -8.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7860 -7.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -4.7440 -3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -4.3590 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -3.4990 -4.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -1.5320 6.1710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 47 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M CHG 1 47 -1 M END