PUBCHEM-ZINC05133422 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0260 1.5230 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -0.0020 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -0.4020 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -1.4830 1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 0.6660 0.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 1.8160 -0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7350 2.6970 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 1.9850 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.0240 -2.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 3.2500 -2.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 4.4170 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 5.5960 -2.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 4.5440 -4.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 3.5450 -3.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3830 2.6200 -4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 4.1220 -3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 4.2810 -2.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 1.9410 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.9270 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -0.3470 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.4260 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 0.6130 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 4.1540 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 4.8520 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 4.0250 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 5.1550 -4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 4.3690 -4.6540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 M CHG 1 27 -1 M END