PUBCHEM-ZINC06300865 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7000 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0800 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0670 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2560 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -5.0260 1.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -7.1550 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -6.3540 0.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -6.2960 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -5.0300 -1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -7.6760 -1.8580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -6.8150 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -7.8260 -4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -8.3060 -5.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -9.2320 -6.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -9.6790 -6.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -9.1980 -6.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -8.2680 -5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -10.9470 -8.0230 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5980 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1390 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -6.2030 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -6.1780 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -7.9570 -4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -9.6070 -6.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -9.5470 -6.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -7.8900 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 11 12 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 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 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 34 1 0 0 0 0 21 35 1 0 0 0 0 M END