PUBCHEM-ZINC04534237 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.0360 1.4710 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 0.3760 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -0.1820 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 0.3510 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 1.4560 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 1.9890 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 3.0460 0.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 3.6170 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 3.2080 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 2.2500 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 2.0490 0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 3.2530 0.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0360 3.9020 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8880 2.8060 -0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3210 2.0550 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8240 4.0100 -0.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5070 4.6570 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8720 4.8040 0.9920 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4990 5.6940 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 5.1550 1.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9770 5.7620 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 3.9500 1.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 6.0470 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 5.9500 3.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 3.9650 1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3280 3.6540 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1430 3.5410 -0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 2.9100 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 2.1820 -1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 1.4740 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.2470 -1.5470 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -1.6630 -2.9990 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 1.8980 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -0.0360 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 3.9770 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 6.8550 2.8350 O 0 5 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 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 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 36 -1 M END