PUBCHEM-ZINC03133903 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.7430 1.2670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0410 -1.8130 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -0.4100 2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -0.3300 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -0.0300 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 0.1910 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 0.1130 4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.1870 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.2470 4.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -0.9030 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -0.3520 2.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3580 0.7340 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -0.9530 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -0.4910 2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2410 0.0790 1.2060 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.6710 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -1.8870 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.0080 -2.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.6790 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -1.9350 -3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -2.6110 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -2.0380 -5.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.7880 -5.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -0.1050 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.8460 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.8180 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8080 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -0.5020 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 0.4250 4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 0.2850 5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -0.7060 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -1.9760 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -2.0410 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -0.6470 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -0.8330 1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 0.9740 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -2.3830 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -3.5880 -4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -2.5690 -6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -0.3430 -6.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 0.8740 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END