PUBCHEM-ZINC02866154 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 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 -5.4530 -2.8560 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2340 -3.7740 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5690 -4.4730 -2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7350 -3.7310 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9630 -4.3720 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0190 -5.7620 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8460 -6.5000 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6240 -5.8540 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9170 -8.3900 -2.6380 Br 0 0 0 0 0 0 0 0 0 0 0 0 -12.2220 -6.3950 -2.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8390 -6.7060 -3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1540 -7.4010 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2180 -7.0470 -4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1110 -3.6430 -2.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9770 -2.2200 -2.6110 C 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 0.7470 -4.6370 -0.0510 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 -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 -5.5490 -1.8960 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -3.4730 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -4.3970 -3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3430 -2.8200 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6890 -2.6520 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7110 -6.4300 -2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0140 -5.7860 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1850 -7.3610 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2170 -8.1900 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1550 -6.2580 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1600 -7.5440 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9650 -1.7620 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4010 -1.9010 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4620 -1.9130 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 -3.5370 -1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -4.4000 -0.8730 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 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 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 52 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 42 1 0 0 0 0 16 17 1 0 0 0 0 16 25 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 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 52 53 1 0 0 0 0 M END