PUBCHEM-ZINC03745955 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.1620 1.5100 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.0000 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -0.6390 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -2.1570 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -2.7970 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -3.2460 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -3.8170 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -3.9210 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 -3.4860 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -2.9130 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -3.7480 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 -4.3380 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 -4.4200 0.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -4.7950 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0840 -4.8020 2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8750 -3.9470 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0970 -4.3820 3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5430 -5.6770 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7610 -6.5310 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5380 -6.1030 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3640 -8.2900 2.2790 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.5050 -3.4710 3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 -1.9720 4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7200 -1.4840 4.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 1.9460 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.7750 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.9650 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.4190 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -0.2300 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -0.2070 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -0.3970 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -2.5920 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -2.4060 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -3.1480 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0570 -4.1580 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -2.5490 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 -2.9310 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6940 -3.7050 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4930 -6.0060 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9310 -6.7840 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2570 -3.9850 4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -3.8720 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 -1.4020 4.2970 O 0 5 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 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 43 -1 M END