PUBCHEM-ZINC00559624 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 0.2470 1.1670 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.1870 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.7080 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 0.1650 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 1.5050 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.0120 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 2.4220 0.7770 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9060 1.9440 1.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 3.7140 0.5310 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2710 -2.0940 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.8290 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -4.2110 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -4.4860 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -3.3190 0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.2870 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -1.1140 0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -5.7440 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -6.0060 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -7.3140 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -8.1520 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -7.2670 0.4680 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.5720 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.8460 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -0.2240 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 3.0740 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -2.5920 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -4.9360 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -5.2330 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 -7.6800 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -9.2280 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END