PUBCHEM-ZINC04473445 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.1340 1.2380 2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -0.2600 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -0.9900 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -2.3910 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -3.0350 2.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -3.0310 1.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -2.3650 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.9680 1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -0.2760 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -0.9480 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -2.3370 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -3.0430 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -4.4650 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -5.4180 0.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -4.4760 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -5.5720 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -6.8780 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -6.9830 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -8.2130 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -9.3490 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -9.2600 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -8.0310 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -7.9430 1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -8.3550 -1.6810 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -3.1980 0.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 1.5660 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 1.7090 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 1.5220 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -0.5000 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 0.7980 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5450 -0.3990 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 -5.4810 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -6.1010 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -10.3090 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -10.1500 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 -8.0450 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 M END