PUBCHEM-ZINC02043758 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 0.5020 2.0650 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 0.3300 -0.3740 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -0.4230 -1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -1.9380 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -2.6410 -2.9160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1000 -2.3750 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -4.1620 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -4.7450 -2.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.2940 -3.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -1.2200 -3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -0.4240 -4.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -1.1190 -4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 0.0120 -5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 0.1670 -5.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 -0.5440 -4.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 2.2960 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 2.2840 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 2.7010 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.1730 -2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 0.0180 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -2.1690 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -2.3400 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -2.9460 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 -0.9660 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 -2.0770 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -0.1360 -6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 0.9670 -4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.6290 -2.7890 O 0 5 0 0 0 0 0 0 0 0 0 0 7.2670 1.0150 -6.1330 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 29 -1 M END