PUBCHEM-ZINC00138788 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -1.4090 1.3730 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -0.1280 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -0.8060 2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.7120 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -2.0590 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -2.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -3.9580 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -4.8050 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -4.2870 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -2.9120 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -2.3850 -0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 -3.0330 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -4.1100 1.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -2.4330 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7410 -3.1020 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9980 -2.5370 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -1.3100 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2040 -0.6420 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9410 -1.1940 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9580 -0.5430 0.7670 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 1.6590 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.8200 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 1.7240 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -1.9290 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -4.3670 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -5.8750 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -4.9510 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -1.5530 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 -4.0600 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 -3.0540 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 0.3150 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -0.6700 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 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 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 M END