PUBCHEM-ZINC02581482 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.1930 1.4990 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0130 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3960 -0.5120 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.3210 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.7980 1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.7640 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.4960 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -0.7870 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -1.3470 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -1.6160 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -1.3200 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -1.6810 3.7110 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 1.7220 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 1.8530 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 1.9980 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -0.0600 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -0.5790 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -1.5740 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -2.0530 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -0.0650 -0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -0.2790 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 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 12 13 1 0 0 0 0 21 22 1 0 0 0 0 M END