NIH-ZINC06191411 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.2860 1.5900 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.4320 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 0.4740 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -0.3240 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -0.1660 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 0.7980 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -0.9360 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -1.1990 -2.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5910 -1.5700 0.1160 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.3200 1.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -2.8530 -0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -1.2230 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 0.0770 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 0.1370 -2.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8610 0.1240 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 1.3720 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9720 1.5470 -3.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 2.6270 -3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4180 2.7690 -4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2930 3.8290 -4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5540 4.7530 -3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 4.6220 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 3.5590 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7360 6.1920 -4.2950 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -1.0540 -2.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -1.7580 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 2.3310 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 2.0460 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 0.3540 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.9350 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 -1.2820 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 0.9130 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 0.1120 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6730 2.2550 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 1.2310 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 2.0460 -5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7590 3.9210 -5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1510 5.3380 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6230 3.4860 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -1.2170 -3.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 40 2 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 8 -1 M END