CHEMDIV-ZINC02266507 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 -0.0580 1.1860 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.1460 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.7170 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.0440 -0.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.2510 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.8970 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 3.7020 0.9990 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.9190 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -0.6660 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -1.8810 -0.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -2.8130 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -4.1180 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -5.1490 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -6.5020 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -6.6120 1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.6550 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -1.7620 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 1.7610 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -1.9700 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -2.3640 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -2.9880 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -4.5210 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -3.9200 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -4.7590 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -5.3280 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -7.3550 0.6980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 M CHG 1 26 -1 M END