PUBCHEM-ZINC05113455 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 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 1.4170 2.0550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9540 1.6330 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 3.5580 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 4.1090 -0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 1.5780 1.5390 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 2.1500 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 1.8170 2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7950 0.7390 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 2.2920 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 3.3320 2.7820 O 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 -1.9050 -0.1400 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 1.6540 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 3.2290 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 2.2310 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.5210 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 4.2840 0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 1.5600 1.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 2.4860 3.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 3.4880 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9530 1.9060 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 5.2440 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 17 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 23 28 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 M END