PUBCHEM-ZINC06247743 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.2190 1.4820 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.0700 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.5700 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -1.9690 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -2.6090 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -1.8550 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -0.4760 -3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 0.1830 -2.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.7700 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.9090 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -3.8350 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -4.3720 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -5.2800 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -5.6650 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -5.1450 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -4.2350 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.5750 0.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -3.6710 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -5.6770 3.0580 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -5.9310 4.0970 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -2.2390 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -2.9910 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 -2.2910 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 -3.0330 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 1.7410 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 1.9460 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 1.8810 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -3.6940 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -2.3330 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 0.1570 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -4.0820 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -6.3720 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -2.1670 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -1.2080 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -3.0680 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -4.0170 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -2.2320 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -1.2600 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -3.0600 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -4.0510 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7400 -2.3260 -4.1810 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0510 -2.8030 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -1.3590 -4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5490 -2.2870 -3.5460 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 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 31 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 41 1 M END