CHEMDIV-ZINC00054844 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.2090 1.1860 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 0.0740 -1.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -0.5740 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -0.1450 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -0.7990 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -1.8930 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -2.3240 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -1.6650 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -3.3900 1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -2.5970 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2390 -1.9870 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 -2.9830 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -4.1590 0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9380 -5.0370 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -3.8980 -0.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 -0.5320 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 0.0770 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7240 1.4310 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 2.1850 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 1.5860 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 0.2310 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 4.0410 0.7070 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 1.6120 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.8530 -3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 1.9430 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 0.7030 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -0.4620 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -1.9980 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -4.2390 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1980 -2.8530 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 -0.5100 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4990 1.9040 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 2.1780 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 -0.2370 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M END