PUBCHEM-ZINC05583101 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 0.2610 1.8180 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 0.4460 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.3750 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 0.1330 -0.1460 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6220 1.4860 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 2.3390 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 2.0930 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 2.2270 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 2.2240 -2.4420 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 3.3390 -1.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 0.8950 -1.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -0.8390 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -1.1460 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 -2.5230 0.7630 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 2.4800 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 0.0150 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -1.4570 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 3.4180 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 3.0820 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 1.5030 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 1.4000 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 3.1620 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -1.7400 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -0.4410 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 -0.2770 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -1.5370 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 2.4220 -3.8880 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 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 27 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 M CHG 1 4 1 M CHG 1 27 -1 M END