PUBCHEM-ZINC04760722 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 56 0 0 1 0 0 0 0 0999 V2000 -2.6650 0.9400 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -0.5190 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -0.5860 -0.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7900 -0.0860 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 0.1080 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -2.0500 0.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9510 -2.0980 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -2.7350 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -3.4300 -1.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.5760 -0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -2.7200 0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -3.8060 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -4.2290 1.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -4.4960 1.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9430 -3.7960 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -4.9840 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 -5.5720 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -6.1500 -1.4440 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3950 -6.8020 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -5.6400 2.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -6.0970 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1990 -5.5600 2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 -7.1480 3.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 -7.5870 4.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -8.7650 5.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -8.5610 6.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -9.6420 7.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 -10.9270 6.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -11.1310 5.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -10.0500 4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 0.9880 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 1.5090 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 1.3620 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -0.9400 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -1.0880 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 1.1510 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -0.3920 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 0.0600 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -1.9640 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -3.0740 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -2.3820 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7770 -4.1460 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -5.7490 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -6.4090 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -4.8060 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3010 -7.6090 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0100 -6.0050 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8630 -7.1840 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -6.0680 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -6.7720 5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 -7.8780 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -7.5580 7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -9.4830 8.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -11.7720 7.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 -12.1350 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 -10.2100 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 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 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 M END