PUBCHEM-ZINC00648589 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.4340 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0310 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.8180 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1050 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.1050 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8620 -1.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.3240 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -3.7400 1.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -4.8150 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -5.4400 3.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -5.2360 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -4.4790 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -4.9160 2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 -6.0280 3.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -6.8160 3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -6.4700 3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -7.3020 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -8.4440 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -8.7920 5.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -7.9990 4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -9.5700 5.3660 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 -4.0980 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -4.5080 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8330 -3.7420 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6170 -2.5700 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 -2.1580 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 -2.9130 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.8140 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.7840 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.7950 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.4800 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.9790 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -4.1330 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -3.0860 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -3.2420 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -3.5610 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -7.0420 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -9.7020 5.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -8.2830 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9330 -5.4230 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8420 -4.0580 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4570 -1.9740 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1650 -1.2420 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -2.5890 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END