PUBCHEM-ZINC06824902 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.1310 1.5410 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.0470 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.6460 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.0430 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.7240 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.9380 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.5840 -1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.2260 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -4.6960 -1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -6.3340 -1.6190 P 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -6.6940 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -2.7910 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.1730 3.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.0240 4.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -3.6110 5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -4.4880 6.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.7830 6.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -4.1880 6.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -3.3050 5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -2.5140 4.8870 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.0510 2.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 1.8750 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 1.9120 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 1.9860 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.3880 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -4.6550 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -4.5410 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -3.8890 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -3.3970 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -4.9470 6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -5.4770 7.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.4200 7.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.6300 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -6.8050 -0.8510 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1660 -6.5680 -3.1210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 35 -1 M END