PUBCHEM-ZINC05187632 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -5.3680 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -5.1660 1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -5.5680 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -5.6970 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -6.1290 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -6.2480 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -5.9400 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -5.5110 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -5.3930 3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -5.0930 6.5200 Br 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -6.4230 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -5.1660 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -4.7580 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -5.8070 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -6.3700 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -6.5820 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -6.0350 5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -5.0630 3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 M END