PUBCHEM-ZINC06436998 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -2.1420 1.3010 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 1.3040 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 3.2950 2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 3.7750 3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 5.1860 3.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 6.1570 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 5.8740 2.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 7.5820 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 8.5350 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 9.8820 3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 10.2750 3.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 9.3350 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 7.9620 4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 7.0270 4.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 7.3590 5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 8.7010 5.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 9.7060 5.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 11.0580 5.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 8.9750 6.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8570 7.9600 6.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 6.6430 6.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 6.3570 5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 4.5150 5.5440 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 0.2100 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 1.7430 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 1.6050 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 1.7970 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 0.2200 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 1.5400 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 3.5450 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 3.7480 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 3.2360 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 3.6110 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 5.5060 4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 8.2310 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 10.6260 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 11.3440 4.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 11.7920 5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 11.3590 5.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 9.9930 6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 8.2040 7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1830 5.8480 6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 1.7870 2.2060 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1440 1.3600 2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 43 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 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 42 1 0 0 0 0 22 23 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END