PUBCHEM-ZINC05646910 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 1.8360 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7520 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 0.7090 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.3540 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 0.6940 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 1.9540 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 1.6620 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8360 1.5150 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1510 1.2540 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1190 1.2570 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 1.5100 1.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 1.0270 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1030 1.0560 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1840 0.8400 3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4350 0.5950 3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6110 0.5640 1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5370 0.7730 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9120 0.3000 4.3430 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 -0.1520 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 2.5330 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 2.5240 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5020 1.5830 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0150 1.0850 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1270 1.2480 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0540 0.8630 4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5900 0.3730 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6740 0.7450 -0.0850 H 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 32 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 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 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 36 1 0 0 0 0 23 37 1 0 0 0 0 M END