PUBCHEM-ZINC03870491 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 2.2370 0.4410 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -0.6750 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -1.1840 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -0.7030 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -2.2630 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -2.8220 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -3.8340 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -4.3040 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -3.7610 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -2.7450 2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -2.2160 2.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -4.2790 4.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2300 -3.6400 4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -5.7920 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -5.0770 5.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5610 -5.2280 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -4.9240 6.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -5.1590 7.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -5.4980 7.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -5.0180 8.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -5.3620 9.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -5.1110 11.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -5.4570 11.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -6.0440 11.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -6.2640 10.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -5.9190 9.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -6.5380 12.8740 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -5.2980 3.1690 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 0.0520 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 0.8100 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.2560 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -0.2860 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -1.4900 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -2.4590 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -4.2640 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -1.4640 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -6.4130 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -6.1480 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -4.6530 6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -4.6770 8.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -4.6530 11.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -5.2740 13.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -6.7210 9.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 5 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 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 39 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 40 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END