PUBCHEM-ZINC02046955 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4510 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8300 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.6030 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -3.0410 0.2540 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -3.9590 -2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -4.5210 -3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -6.0480 -3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -6.6500 -4.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -8.1770 -4.4630 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5710 -8.5080 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -8.7790 -5.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -10.3010 -5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -10.8950 -6.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -10.1740 -7.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -8.6280 -3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -7.8130 -2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.3860 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 0.6780 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 1.8520 -3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4600 2.0790 -2.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 1.1970 -3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 0.0600 -3.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -0.2350 -4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -1.4270 -4.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7160 1.4710 -3.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2390 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.3060 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -4.1990 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -4.1840 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.3700 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -6.3850 -3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -6.3280 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -6.3130 -4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -8.3830 -6.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -8.5200 -5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -10.6980 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -10.5600 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -0.1570 -5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 1.3230 -4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 2.5770 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -1.6340 -5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -2.0560 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 2.3010 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4100 0.8340 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -12.2240 -7.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -9.9370 -2.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -10.1780 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -12.5580 -7.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 53 1 0 0 0 0 20 21 2 0 0 0 0 20 54 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END