IFLAB-ZINC04139276 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -1.6540 -0.7120 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -0.8340 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -1.3370 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -1.4590 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -1.0680 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -0.5570 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.4460 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.0970 -2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 0.9230 -2.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -0.4210 -3.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 0.0430 -5.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5970 1.1340 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -0.2670 -6.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -0.4710 -5.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5000 -0.1280 -4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -1.9920 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -2.8280 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -4.2050 -5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -4.3820 -6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -2.8960 -7.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -0.1540 -7.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 0.4340 -8.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 1.8490 -8.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 2.1790 -8.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 1.6710 -7.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 0.3370 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -1.1180 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -1.2750 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -1.6390 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -1.8530 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -1.1520 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 -0.2280 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -1.1490 -3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 0.0280 -7.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 0.2800 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -1.3280 -6.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -2.4730 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0250 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -5.3160 -6.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 0.2960 -6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -1.2380 -7.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -0.0240 -9.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 0.2470 -8.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 1.7700 -9.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 3.2690 -8.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 1.8870 -6.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 2.1150 -6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 0.1600 -6.9510 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6870 -0.2910 -7.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 48 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 48 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 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END