PUBCHEM-ZINC06604083 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.3190 -1.7950 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.5100 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -0.7710 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -0.9200 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -1.0690 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -0.9790 3.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.8270 2.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -0.7500 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.6330 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -0.5450 4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -0.5810 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -0.7090 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -0.7970 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 -0.4730 4.0010 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -1.2980 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -0.7010 4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -0.9210 5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -1.7470 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -2.3560 4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -2.1340 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9840 -2.0480 6.4050 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -0.8680 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -0.0720 0.7160 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.4150 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -1.5600 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.4070 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 0.0260 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.1790 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -0.5990 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -0.4500 5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 -0.7490 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -0.9290 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -0.0550 5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 -0.4440 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 -3.0010 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -2.6230 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -1.6240 -0.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 2 0 0 0 0 M CHG 1 23 -1 M END