PUBCHEM-ZINC04651885 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.1690 1.5360 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.0390 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.7080 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -2.1110 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.7930 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -2.0500 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.6360 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.7770 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -4.1790 -2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -4.8300 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -4.1410 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -6.3010 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -6.9210 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -8.3120 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -9.1100 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -8.5290 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -7.1370 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -10.9910 -0.5680 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -2.1320 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -1.1330 -3.9200 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1590 -2.8860 2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 1.8630 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 1.9760 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 1.9250 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.1990 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0440 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -4.7340 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -6.3110 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -8.7520 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -9.1430 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -6.7120 -2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -3.5270 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.5020 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.2210 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -2.6700 -4.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 19 20 1 0 0 0 0 19 35 2 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 M CHG 1 20 -1 M END