PUBCHEM-ZINC06187965 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 1.6480 1.6250 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 0.1270 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -0.4860 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -1.8420 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -2.6250 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.0040 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -0.6240 -1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -3.0160 -2.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -2.9120 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -4.1960 -2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -3.9580 -0.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -5.5300 -2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -6.6390 -1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -7.9460 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -9.1150 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -10.3400 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -10.4190 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -9.2630 -4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -8.0320 -3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -9.3810 -5.8130 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -11.6300 -4.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -12.7830 -3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -13.9850 -3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -13.0750 -3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -5.6630 -4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -5.7680 -5.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 1.8910 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 1.9810 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 2.0870 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.1150 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -2.3090 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -0.1410 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -6.5520 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -9.0550 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -11.2410 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -7.1350 -4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -12.5970 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -14.1700 -4.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -14.8640 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -13.7770 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -12.2190 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -13.9540 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -13.2600 -4.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 33 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 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 38 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 43 1 0 0 0 0 25 26 3 0 0 0 0 M END