PUBCHEM-ZINC00745807 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 1.5090 1.5520 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 0.0360 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -0.4730 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -1.9240 2.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -2.8230 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -3.2550 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -4.1940 3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.4320 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -1.6910 1.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -3.9200 2.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2940 -4.3820 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -4.5100 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -6.1020 1.0760 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -5.4300 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -4.1910 2.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -3.3650 3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -2.4190 4.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -3.6100 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -2.6050 5.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -2.8390 5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 -4.0710 5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -5.0740 4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -4.8460 4.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -6.2790 4.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 -6.4430 5.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9870 -1.8610 6.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 -2.1700 7.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.7880 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 1.9140 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 2.0320 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.2010 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -0.4440 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -0.2360 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 0.0080 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -3.7030 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -2.3060 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -2.3750 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -3.7730 4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -4.5010 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -5.0740 3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -3.6760 3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -3.8780 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -4.6780 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -5.2120 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -6.1360 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -1.6460 5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 -4.2500 6.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -5.6250 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -5.7090 5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 -7.4470 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -6.2970 6.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9630 -2.4260 6.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 -3.0150 7.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 -1.3050 7.6600 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 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 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END