ASINEX-ZINC04455711 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.0180 1.3430 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.1160 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -0.8640 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -0.4280 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -0.8160 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -1.3500 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -1.5110 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -1.1220 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.5780 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -0.0440 -2.8640 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -2.0850 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 -2.7980 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -3.1080 -2.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -3.3540 -2.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -3.2470 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6670 -3.9660 -2.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 -4.2640 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9860 -4.1850 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -4.8370 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2750 -4.8800 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4530 -4.2770 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4190 -3.6300 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1660 -3.5730 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -3.0250 -0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.7470 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 2.0770 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.1140 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.1200 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -1.7630 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -0.4370 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.6930 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -1.6500 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -1.2440 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -1.9450 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9160 -5.3080 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1030 -5.3880 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4190 -4.3190 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5690 -3.1620 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 3 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 M END