PUBCHEM-ZINC05444309 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -4.1670 1.6760 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 0.2620 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4240 -0.4000 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7580 -0.7040 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -2.0760 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -2.3840 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -3.7890 0.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -4.8020 1.9220 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9000 -4.6150 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -6.1650 1.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3520 -6.6800 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -8.1420 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 -8.5960 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 -9.9610 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -10.8760 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -10.4290 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -9.0630 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -5.9050 0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -5.7880 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -6.5500 -0.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -4.3080 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.7330 -1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -4.7280 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.2720 2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -4.2450 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -4.6800 4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -5.1500 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -5.1730 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -5.6420 4.5610 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 2.2820 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 2.1650 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 1.6810 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 0.2290 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.1740 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 -1.0400 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6660 0.6450 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 -0.0630 3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 -0.5180 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 -1.7450 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -2.3140 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -2.6710 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -1.7960 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -2.1310 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7010 -7.8940 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -10.3100 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -11.9380 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -11.1470 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -8.7570 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -6.8920 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -3.9300 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -3.8880 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -4.6580 5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -5.5030 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -0.6020 0.9320 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4440 -0.2920 1.7820 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END