PUBCHEM-ZINC04749419 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -2.6270 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -3.3070 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 -3.3850 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 -4.3550 -3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -3.8790 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -3.7860 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 -4.3900 -5.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5530 -5.5160 -5.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 -5.5500 -7.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -6.6650 -7.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -7.7470 -7.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -7.7160 -6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -6.6010 -5.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -9.2720 -8.3960 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 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -4.6370 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -3.5870 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.0100 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 -2.6070 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -4.2940 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3350 -3.7420 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2500 -2.3960 -3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4930 -5.3520 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -4.5880 -4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -2.8970 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 -4.7700 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -3.4340 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2870 -3.6310 -5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4620 -4.7060 -7.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 -6.6930 -8.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 -8.5620 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 -6.5760 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -2.8470 -1.3460 N 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 M END