PUBCHEM-ZINC03871308 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -1.7430 1.2010 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.3390 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 3.2860 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 3.8430 3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 5.2380 3.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 6.2500 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 6.0240 2.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 7.6510 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 8.6700 3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 9.9980 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 10.3050 3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 9.3100 4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 7.9560 4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 6.9930 4.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 7.3480 5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 8.7080 5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 9.6700 5.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 9.0710 6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 8.1150 6.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7590 6.7700 6.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 6.3990 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 4.5380 5.7330 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 0.1130 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 1.6140 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 1.4750 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 1.8040 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.2490 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 1.6440 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 3.4890 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 3.7210 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 3.2900 4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 3.7590 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 5.5120 4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 8.4340 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 10.7920 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 11.3470 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4330 10.1270 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9670 8.4240 7.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 6.0190 6.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 1.7740 2.3460 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0110 1.3770 3.0330 H 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 40 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END