PUBCHEM-ZINC04460979 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.9370 0.5300 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -0.9690 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -1.1770 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -2.6120 0.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -3.0360 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.2300 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -4.5120 1.4800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7020 -5.0430 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -5.0330 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -6.5890 1.3710 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -5.9240 3.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8590 -5.6350 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -4.7430 2.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -3.9330 3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -3.0440 3.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -4.1260 5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -3.1940 6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -3.3800 7.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 -4.4880 7.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -5.4160 6.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 -5.2440 5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -6.9460 3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -6.8050 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -7.7400 4.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -8.8210 5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -8.9630 5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -8.0250 4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -10.0230 5.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -10.1040 5.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -9.7420 6.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -9.5320 6.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 0.9860 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 0.6780 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 0.9930 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -1.4250 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -1.4320 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -0.7210 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7140 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.2560 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -5.2380 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -4.3410 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.3290 6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -2.6600 8.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -4.6290 8.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -6.2780 6.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -5.9720 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -5.9620 3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -7.6270 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -8.1360 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -10.9930 5.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 -10.1620 4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -9.2170 5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -9.5220 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -10.3360 7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -8.5770 6.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 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 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END