PUBCHEM-ZINC03609615 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -1.8770 0.8210 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 1.0720 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 3.1080 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 3.6680 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 3.1450 3.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 3.3980 4.7710 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3700 4.3260 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 3.6100 5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 4.8490 6.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 5.0780 7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 4.0770 8.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 2.8440 7.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 2.5930 6.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 1.2930 5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 0.5560 5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 0.9270 5.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 2.2480 4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 2.5250 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 1.5170 5.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 0.2190 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2890 -0.0710 5.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.0380 4.3240 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -0.2340 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 0.9750 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 1.1650 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 1.2280 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 0.0080 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 1.6060 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 3.2970 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 3.5350 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 4.7620 2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 3.3700 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 5.6500 6.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 6.0390 8.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 4.2540 9.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 2.0760 7.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 0.9290 5.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 3.5380 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 1.7460 5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 -0.5700 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -1.0960 5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 1.6070 1.4080 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4760 1.5030 2.4260 H 0 0 0 0 0 0 0 0 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 1 42 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 22 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 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END