PUBCHEM-ZINC06546868 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 4.4850 -8.0650 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -7.0710 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -7.7940 0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -7.0630 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -5.8590 0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -7.7440 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -6.7360 0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -7.1150 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -8.2910 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -6.0780 0.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7820 -5.5180 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -5.1340 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -3.8870 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -3.2080 -2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -3.9030 -3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -5.5110 -2.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -6.7400 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -6.4700 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1010 -5.5020 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0680 -5.2390 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0740 -5.9370 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1130 -6.9000 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 -7.1730 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -8.2270 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1240 -7.6570 4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4100 -7.6080 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 -7.7820 -1.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -8.3420 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1050 -9.2680 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 -9.7540 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9390 -9.2880 -0.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0040 -8.2570 0.1760 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0500 -10.7520 -2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5020 -11.1680 -3.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2760 -11.2020 -2.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 -9.6580 -3.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 -7.5230 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -8.7520 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -8.6290 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -6.5080 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -6.3850 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -8.3030 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -8.4260 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -5.7950 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -3.4420 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -2.1920 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -3.5360 -4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 -4.9570 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8190 -4.4870 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8320 -5.7290 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -7.7890 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -9.0400 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -8.6150 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 -8.5540 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 -7.9410 4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5400 -7.0250 5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7130 -10.8700 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7210 -11.8580 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -9.2770 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -10.3120 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 44 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 17 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 17 18 1 0 0 0 0 17 26 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 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 50 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 36 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 M END