PUBCHEM-ZINC03755225 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0970 1.8340 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 0.4140 0.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.2400 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 0.3650 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -0.4140 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -1.8100 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -2.4160 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -1.6330 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.2450 0.8510 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -2.6020 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -3.7250 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 -4.0660 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4020 -5.0760 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7010 -5.1200 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1370 -4.1880 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 -3.1820 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 -3.1490 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -2.2910 0.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -1.5300 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8890 -6.4720 -0.8980 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -4.4400 -1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -5.8310 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -5.8630 -0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 2.1920 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 2.1670 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 2.2650 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 1.4390 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 0.0820 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -3.4950 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0600 -5.8110 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1490 -4.2350 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6110 -2.4560 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -4.5310 -2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -3.8730 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -6.7880 -1.6550 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 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 10 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 31 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 18 19 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 2 0 0 0 0 22 35 1 0 0 0 0 M CHG 1 35 -1 M END