PUBCHEM-ZINC04948310 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3720 -0.5110 0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.7460 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -0.5780 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -0.8780 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -1.3520 -3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -1.5260 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -1.2250 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -1.3260 0.8420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -0.7510 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.5120 2.7080 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -1.7770 3.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 0.6520 2.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -0.2090 -2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -0.7450 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -1.5860 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -1.8950 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.1700 3.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.0180 4.5720 H 0 0 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 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 24 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 3 1 M END