CHEMDIV-ZINC03660140 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.0170 1.1300 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 1.1140 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 1.4540 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 2.8930 3.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 3.4670 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 3.0480 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 3.6660 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 3.1760 5.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 5.1390 4.6340 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2520 5.3030 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 5.8630 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 6.3580 4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 6.7300 3.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 6.3260 5.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 5.8350 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 6.7130 6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 6.7580 8.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 7.1400 9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 7.4760 8.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 7.4320 7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 7.0450 6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 7.9990 10.0580 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.0400 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 1.5180 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.4940 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 1.6030 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 0.0350 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 0.8850 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.2100 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 3.0920 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 4.5540 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 3.3720 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 3.5100 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 5.1680 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 6.7020 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 6.6670 6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 5.1210 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 6.4960 8.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 7.1760 10.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 7.6960 7.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 7.0060 5.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.5860 1.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 M END