PUBCHEM-ZINC06021101 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.3180 2.0530 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 0.5460 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5000 0.3040 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.0850 1.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7800 -1.0050 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 0.5530 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 1.6850 1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -0.3530 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 0.2120 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -0.5950 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -1.9670 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -2.5290 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -1.7240 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 0.6580 2.8350 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -0.7370 3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -1.2890 3.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.1080 4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.2390 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 0.2750 0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -1.5580 -0.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -2.2210 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -3.4040 -1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -3.8200 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -2.4980 -0.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3120 -2.1100 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -2.7850 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -2.6070 2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 2.6270 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 2.2900 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 2.4150 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 1.2820 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -0.1540 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -2.5960 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 -3.5970 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.1880 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -1.0360 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -2.1430 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -0.4500 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -1.5580 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -2.5560 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -3.0810 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -4.2080 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -4.3580 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -4.4930 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -3.2030 1.8150 O 0 5 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 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 45 -1 M END