PUBCHEM-ZINC00404591 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -0.1580 -1.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -0.5520 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -1.2860 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -1.6860 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -1.3590 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -0.6300 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -0.2150 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 0.5720 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 0.9570 -4.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 0.7650 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 1.6710 -5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 2.3030 -6.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 2.9480 -7.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 2.9690 -6.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 2.3520 -5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 1.6920 -4.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 1.0120 -3.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8150 -1.9150 -1.8550 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -1.5450 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -2.2580 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -0.3760 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 2.2890 -7.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 3.4400 -8.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 3.4780 -6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 2.3750 -4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 15 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 M END