PUBCHEM-ZINC01542600 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7420 1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.0600 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.3980 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.9690 -1.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.0540 1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.2410 1.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.6460 3.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -3.6340 4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -2.9130 5.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -2.2020 5.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -1.4970 7.0310 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3120 -1.5330 7.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -0.8540 7.2840 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -3.4050 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -1.6990 3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -4.2700 4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -4.2460 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -3.6430 6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.2100 5.6770 H 0 0 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 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 2 0 0 0 0 13 15 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END