PUBCHEM-ZINC05077497 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.0570 1.5050 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.0020 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.7000 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.0790 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.7710 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.0600 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.6810 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.0880 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.2490 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.8480 -1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -4.9320 1.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -6.3210 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -7.0530 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -8.4300 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -9.0930 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -8.3830 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -6.9880 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -6.2230 3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -5.0080 3.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -10.9800 1.1000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 1.8710 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.8740 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.8600 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -0.1630 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.6230 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.5890 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 0.2760 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -0.4940 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.0370 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -4.4550 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -6.5440 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -8.9950 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -8.9040 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 -6.8700 4.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -6.3260 4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 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 26 1 0 0 0 0 7 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 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 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 34 35 1 0 0 0 0 M END