PUBCHEM-ZINC03654266 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.0620 1.8310 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.3370 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.1980 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.5690 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -2.4060 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.8710 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.5000 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -2.9380 -2.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -2.1960 -3.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -4.1850 -2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -3.2240 -3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.3950 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -5.6010 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -6.5700 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -6.3710 -2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -5.1950 -3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -4.1920 -3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -2.9400 -3.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -2.5310 -4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -2.3580 -3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -1.0160 -4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.6380 -4.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -0.2050 -4.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -8.1960 -1.2680 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -2.1510 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 2.1730 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 2.0880 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 2.3140 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.4560 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -3.4770 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.0830 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -5.7640 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 -7.1480 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -5.0500 -3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 -0.5060 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 0.6800 -5.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.2720 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -3.1220 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.4800 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 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 32 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M END