IFLAB-ZINC04194586 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 0.2870 2.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -1.8280 1.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -2.4480 2.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0660 -2.1800 3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -3.9590 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -4.0270 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.8340 0.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -5.2680 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -5.2070 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -6.3720 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -7.6000 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -7.6680 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -6.5110 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -9.1920 -1.8890 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -2.0400 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -1.5270 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -1.1520 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -1.2890 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 -1.8030 3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -2.1740 3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -2.6730 4.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -2.7830 6.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9840 -0.9200 2.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -0.3990 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -4.4170 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.4420 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -4.2500 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -6.3260 -2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -8.6290 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -6.5650 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.4200 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -0.7520 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -1.9110 4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -1.7970 6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -3.1950 6.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 -3.4430 5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4590 -1.1490 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 0.4940 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -0.1440 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 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 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END