PUBCHEM-ZINC04622459 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 1.0100 2.8440 -2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 3.1940 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 4.5280 -4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 5.5150 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 5.1700 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 3.8320 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4800 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 4.2320 0.9930 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 5.6290 0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 3.5830 2.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 3.8760 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 4.7730 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 4.5020 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 3.3340 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 2.4250 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 2.7080 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 1.1730 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 0.9320 0.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.2990 1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 -0.9100 1.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2580 -1.1860 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 -2.0640 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -2.4130 3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -1.2550 4.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 -0.7160 2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4820 -0.1760 3.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9630 2.9950 -1.3180 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 5.0050 -5.8360 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 1.8020 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 2.4260 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 6.5560 -3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 5.9410 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 2.7950 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 5.6880 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 5.2060 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 2.0120 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -1.7290 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -2.9170 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -2.5660 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 -3.3040 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M END