PUBCHEM-ZINC02592901 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0670 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.2730 -2.8310 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2520 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.8650 1.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.9200 -1.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.3850 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -6.8800 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -6.0910 -3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5990 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.4310 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -6.7390 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -6.7630 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -8.1990 -2.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -8.4680 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 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 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 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 2 0 0 0 0 13 24 1 0 0 0 0 24 25 1 0 0 0 0 M END