PUBCHEM-ZINC04771960 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 1 0 0 0 0 0999 V2000 0.0120 1.0440 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -0.2810 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -0.4860 0.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -1.6370 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -1.6330 0.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -0.4400 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 0.7630 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 0.7060 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 1.6560 0.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 1.7200 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 1.1010 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -0.2270 -0.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -1.2280 -0.9340 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0230 -2.1210 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -1.5430 -2.4050 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6500 -0.6140 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2350 -1.8160 -2.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8080 -1.6560 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6350 -0.8540 -1.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8090 0.1480 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 -0.7150 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8300 -1.2920 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0820 -0.3000 0.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 -0.0960 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 -3.1840 -1.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 -3.5510 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -2.6620 -2.8290 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7500 3.5100 -1.2640 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 1.5930 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -1.0580 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -2.5750 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 1.4730 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6350 -2.2300 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7290 -1.4030 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 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 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 27 -1 M END