PUBCHEM-ZINC05280396 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.5130 2.9080 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 1.6710 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 0.5320 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 0.6810 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.9050 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 3.0390 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 1.6840 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 0.3420 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -0.2460 -0.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -1.2210 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 2.7080 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 3.5100 1.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3380 3.3170 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 5.0080 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 5.5800 1.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 3.2050 2.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 2.0700 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 1.1510 3.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 1.9990 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 2.0720 3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7870 1.9840 4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 1.8220 6.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 1.7500 6.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 1.8370 5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 1.7830 6.5430 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 3.7840 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 1.5910 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.4290 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 4.0110 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.2330 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 2.1930 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 3.3560 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 3.9580 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 2.1850 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8040 2.0400 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3980 1.7550 6.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 1.6340 7.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 5.4720 0.4840 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 38 -1 M END