PUBCHEM-ZINC00078558 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 27 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2090 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.3990 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.5700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 4.3020 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 6.0070 0.0160 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 5.5620 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 4.2640 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 6.5100 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 7.8870 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 8.3920 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 7.3890 0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 6.1920 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 5.2960 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 8.9050 0.0430 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.4180 -0.0220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -0.5140 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 1.9460 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 3.9100 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 9.4380 0.0750 H 0 0 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 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 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 M END