PUBCHEM-ZINC03749150 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0940 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0730 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.2720 -2.8300 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8450 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -2.7900 3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -3.8210 4.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -4.2670 4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -3.6270 2.8020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -3.9790 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -4.8170 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -4.9680 4.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -5.4390 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -5.2190 2.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8580 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6010 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -2.2320 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -3.6510 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -6.2540 3.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -6.6390 3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 M END