PUBCHEM-ZINC03704605 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.6710 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -4.0370 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5690 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -3.7180 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -2.3500 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -1.1930 3.6980 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -6.0400 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -6.7330 2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -8.0480 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -8.0740 1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -6.9600 0.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -9.1400 3.2250 N 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.2580 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.6960 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -4.1270 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -6.3160 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -9.0080 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -10.0380 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 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 24 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END