CHEMDIV-ZINC02679885 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 -0.1320 1.6640 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 0.1490 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.4510 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.5260 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -0.1420 2.7950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0510 0.9420 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.7490 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -1.8420 4.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -0.7000 3.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -0.0720 2.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 1.0570 2.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -0.9290 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 -0.2590 3.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -0.9050 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -0.1920 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4360 -0.7260 3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5420 -1.9840 4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 -2.6960 4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -2.1650 4.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5310 -4.4050 5.1780 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 1.9150 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 2.1110 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 2.1440 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.0550 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -0.2810 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -1.5310 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -0.0050 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -1.6160 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -0.3000 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -1.6150 3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -1.8760 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -1.1040 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 0.7910 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3310 -0.1610 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5250 -2.3970 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 -2.7450 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -0.0850 3.7490 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 M CHG 1 37 -1 M END