PUBCHEM-ZINC05955794 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.1530 1.0730 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.4200 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.7570 -1.5260 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.3680 -2.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -2.5770 -1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -3.2430 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -4.7760 -2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3750 -5.0970 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -5.2550 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -5.7010 -3.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -5.3660 -1.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -5.5530 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -5.2480 0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -6.2110 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 1.5750 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 1.5290 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.2700 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.8540 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -0.9060 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.8200 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -2.8850 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -2.8660 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -2.9390 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -5.6700 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -5.9250 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -7.2970 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -5.9010 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -5.1570 -4.8690 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 M CHG 1 28 -1 M END