PUBCHEM-ZINC00610401 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -4.3930 1.4680 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -0.0380 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -0.6450 2.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -0.7750 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -0.0780 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.7710 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -2.1540 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -2.8570 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -2.1720 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -4.2560 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -4.9380 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 -4.3410 0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -6.2820 0.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -6.9960 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -8.3860 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -9.0820 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 -8.3600 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0770 -6.9800 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -6.3430 0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7900 -9.2580 0.2440 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 1.8320 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 1.8350 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 1.8290 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 1.0020 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.2320 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -2.6910 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -2.7160 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -4.7360 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -6.7530 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -8.9150 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 -10.1620 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9970 -6.4140 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 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 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 M END