PUBCHEM-ZINC03139313 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.8220 0.1090 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0110 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 0.5110 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -0.7610 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -0.8740 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -1.5770 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -2.1750 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8880 -2.0660 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -1.3600 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -2.8680 0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9620 -2.1700 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -2.8360 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3430 -2.0770 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2500 -0.7480 0.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0740 -0.1510 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -0.8430 0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0130 1.3310 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 1.9810 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 3.3600 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8990 4.0970 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1210 3.4570 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1840 2.0790 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 5.9870 0.2830 Br 0 0 0 0 0 0 0 0 0 0 0 0 -9.6640 -2.7390 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8220 -1.9720 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0480 -2.5940 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1300 -3.9740 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9840 -4.7400 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7530 -4.1300 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 0.6960 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -0.8850 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 0.6030 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -0.4100 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -1.6650 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -2.5330 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -1.2710 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 -3.9160 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 1.4060 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 3.8640 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0270 4.0370 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1380 1.5800 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7590 -0.8940 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9460 -2.0010 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0920 -4.4560 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0540 -5.8180 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8590 -4.7280 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M END