PUBCHEM-ZINC03688156 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1580 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4550 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8370 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.6130 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0040 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.8290 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.8900 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -3.8210 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -4.2880 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -5.1950 3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -5.6330 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -5.1780 2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -4.2700 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -3.6570 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -3.7860 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -5.6820 3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -6.0690 4.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -2.1420 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -2.9820 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -2.2220 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -3.0620 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -2.6630 -4.6950 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2360 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.1450 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -3.6900 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -3.9470 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -6.3370 4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.5240 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.9510 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -1.1950 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -3.1730 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -3.9290 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -2.0310 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -1.2750 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -3.2530 -4.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -4.0090 -3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -2.8660 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -2.3320 -4.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -2.0860 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 3 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 44 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 M END