CHEMDIV-ZINC04143541 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.6910 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -2.0970 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -2.7230 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -1.9960 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -0.6090 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 0.0520 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.1050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 2.2060 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 3.4220 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 1.5450 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 0.2010 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 -0.3460 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 2.3180 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 2.5800 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8230 3.3870 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 3.6480 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 4.4560 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0110 4.7130 4.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3530 4.2940 5.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -3.1240 -0.0110 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.8760 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -3.8020 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -2.5130 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 3.1840 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 1.7570 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 3.2690 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 3.1410 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6890 1.6290 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 2.8250 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6570 4.3370 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4970 4.2100 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 2.6980 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3430 3.8940 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4040 5.4060 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1340 5.4080 4.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3760 5.5480 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 39 40 1 0 0 0 0 M END