PUBCHEM-ZINC06073715 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 58 0 0 1 0 0 0 0 0999 V2000 0.4090 1.2730 -1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.0220 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.0520 0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -1.1260 -1.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.5090 -1.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1040 -3.1120 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -2.7880 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -2.3500 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -3.0080 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -2.6020 -2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -1.5310 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -0.8830 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -1.2780 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -1.1460 -2.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -0.0490 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5400 1.3040 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5210 2.6130 -2.0950 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7890 -1.8140 -3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5650 -3.0590 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2770 -3.8610 -4.9890 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -2.9390 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -2.1670 -0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -4.2770 -0.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -4.9420 0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1630 -4.2460 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 -5.4310 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -4.2860 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -4.9390 -2.5730 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 -3.3640 -3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -6.2240 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -6.6330 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.1870 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.5280 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 2.0690 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.9850 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -3.8640 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -2.3350 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -3.8550 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -3.1750 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -0.0410 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -0.7330 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0350 -0.2050 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -0.0680 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 1.5210 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 1.3370 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4780 -1.1180 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -2.0430 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 -3.7880 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3810 -2.8010 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -4.9270 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 -6.0730 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -6.0550 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -3.7190 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -3.6140 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 -2.7540 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 -3.5560 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 -2.8190 -3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -6.6810 1.7860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 2 0 0 0 0 30 58 1 0 0 0 0 M CHG 1 58 -1 M END