CHEMBRIDGE-ZINC01173490 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0480 1.5260 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.0040 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.4770 1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -1.8220 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.6690 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -4.0340 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -4.5680 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -3.7140 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.3490 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -1.1910 3.7110 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -6.0310 1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -6.7720 0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -6.5440 2.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -7.8790 2.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -8.9240 1.8010 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -8.3930 4.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -9.7710 4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -10.2870 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -11.6570 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -12.4670 4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -11.8870 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -10.5760 3.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -12.2560 6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.9060 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.8870 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.8750 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -0.3840 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.3520 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.2560 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -4.6920 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -4.1230 3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -5.9520 3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -7.8030 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -9.6270 6.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -13.5410 4.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -12.5130 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -12.3440 7.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -13.2440 6.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 -11.6140 7.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 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 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END