PUBCHEM-ZINC06709672 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -0.7020 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -1.1480 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -1.3820 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -1.1710 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.7290 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -1.9490 -4.9620 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -1.5750 -6.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -1.5500 -4.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -3.6040 -4.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -4.2980 -4.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -5.5980 -4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -6.3250 -4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -7.6800 -4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -8.1240 -4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -7.1620 -4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -5.5830 -4.8120 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -7.4560 -4.7390 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -0.5190 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -1.3130 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -1.3540 -4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.5680 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -4.0930 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -6.1420 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -8.3510 -4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -9.1730 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M END