PUBCHEM-ZINC03741322 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0820 1.5550 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 0.0440 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.4900 0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -1.8550 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.7600 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -4.1370 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -4.6250 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -3.7360 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -2.3490 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -1.4570 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -0.6120 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 0.0160 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 0.9480 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5470 1.3590 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 0.8680 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 -0.0560 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 -0.4620 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -1.3430 0.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -1.8400 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7790 2.6100 -1.0330 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -0.4010 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -1.4770 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -1.2540 -4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -2.3500 -5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 2.0200 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.9470 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.8540 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.2260 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.3230 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.4270 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -4.8300 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -5.6980 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -4.1290 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 1.3390 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5800 1.1970 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9800 -0.4410 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 0.5890 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -0.3940 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -2.4690 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -1.4760 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.2750 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -1.2370 -4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -3.3360 -5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -2.3720 -5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.0900 -7.0960 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6130 -2.8230 -7.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -2.0700 -7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -1.1930 -7.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 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 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 45 1 M END