PUBCHEM-ZINC06187901 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -5.6310 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -5.3340 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 -4.5020 -3.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 -5.9920 -2.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5770 -5.7030 -3.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5140 -4.6430 -3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 -6.0560 -3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4970 -5.1520 -2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0240 -3.9210 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3180 -3.4540 -0.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9940 -4.3500 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4830 -5.4270 -0.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1630 -6.2420 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 -6.5220 -4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 -7.2700 -4.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -3.7040 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -4.9640 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -6.6810 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -5.4210 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -6.6570 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -5.9260 -4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0680 -7.0940 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1820 -3.4000 -3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 -4.2480 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 -6.4200 -5.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 -6.9650 -6.6010 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 45 46 1 0 0 0 0 M END