PUBCHEM-ZINC05442603 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 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 -0.6980 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0890 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7840 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0690 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.2770 -2.8290 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1410 0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -4.8430 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.3530 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -3.1190 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.9130 3.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -3.9180 4.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -3.7110 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -2.5760 6.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -4.8630 6.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -4.6520 8.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -5.7310 8.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -7.0200 8.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -7.2360 6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -6.1660 6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -5.5610 2.1810 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 -0.1640 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5930 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -3.6460 8.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -5.5690 9.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -7.8610 9.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -8.2450 6.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -6.3360 5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -5.9010 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 12 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 28 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 M END