PUBCHEM-ZINC03871271 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5120 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6380 -0.3650 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -0.4950 -1.3590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0730 -0.0020 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -1.9850 -1.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0320 -2.5640 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -2.0210 -0.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7990 -2.6500 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.6600 0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -2.5390 -1.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -3.7870 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -3.8330 -1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -5.0210 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -5.1050 -2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -6.0610 -1.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -5.9560 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -4.8580 -0.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 -6.8870 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -7.0290 0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -2.6290 -2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -1.8640 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -0.0870 -2.5490 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -2.4700 -2.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -0.2030 -1.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.3570 -1.1010 P 0 0 3 0 0 0 0 0 0 0 0 0 2.2840 2.1070 -2.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 1.9470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8820 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8730 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -7.8460 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -6.9690 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -3.4070 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 1.4430 -0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 2.3450 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 24 33 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 26 34 1 0 0 0 0 34 35 1 0 0 0 0 M END