PUBCHEM-ZINC02868134 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.2280 1.5340 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.0730 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -0.5510 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -1.9200 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -2.7040 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -2.0690 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.7000 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.1420 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -4.7700 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -6.1370 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -6.8660 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -8.2560 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -8.8860 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -8.1550 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -6.7880 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -6.1320 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -4.8160 1.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -10.7390 0.8530 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -6.7750 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -7.4510 -3.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -6.5310 -3.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -7.0550 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -6.2590 -5.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -6.8560 -7.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -6.2800 -9.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -5.4300 -10.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -5.7400 -10.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -5.4720 -9.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -6.3230 -8.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 2.0820 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 1.9740 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 1.6740 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 0.0220 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -2.3780 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -2.6370 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -0.2420 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -4.2000 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -8.8510 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -8.6280 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -6.2170 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -5.9890 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -8.1070 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -7.0090 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -5.2130 -5.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -6.2510 -5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -7.8930 -7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -6.8150 -7.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -6.0000 -9.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -7.3490 -9.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -5.6380 -11.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -4.3590 -10.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -5.7090 -9.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -4.4020 -9.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -7.3920 -8.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -6.0740 -7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -6.0490 -8.1530 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1610 -5.0530 -7.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END