PUBCHEM-ZINC05799473 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.5470 0.7500 3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.1310 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -0.9470 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -2.0930 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -2.1380 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -2.8590 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -3.8870 1.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -3.7350 1.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1880 -3.1380 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -5.1480 0.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6410 -5.8830 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 -5.9770 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8170 -6.8380 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 -6.9700 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8860 -6.2380 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 -5.3760 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 -5.2430 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2150 -6.3610 1.1320 F 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 -6.4080 2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -5.8500 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -6.8800 -0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -5.1040 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -5.5150 1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -2.9800 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -2.0110 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -1.3310 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -1.6090 3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.5660 4.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -3.2470 3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 0.0700 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.6720 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 1.0060 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.7870 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.0850 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -0.8330 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -0.0150 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -3.0480 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -2.1980 2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -1.9040 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -1.5590 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.8680 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -2.1530 2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -3.3650 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2890 -7.4160 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7450 -7.6370 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7670 -4.8110 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 -4.5510 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -5.1180 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -1.7790 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -0.5870 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 -1.0850 4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 -2.7900 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -4.0000 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -1.1780 2.0980 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9060 -1.6280 2.9980 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 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 19 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 18 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END