PUBCHEM-ZINC05131766 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 23 0 0 1 0 0 0 0 0999 V2000 -0.0310 1.5520 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.0130 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4500 -0.3240 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.5940 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -1.1750 -1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -0.4620 1.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 0.0390 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -0.9620 1.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1750 -0.6490 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.4740 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -3.4490 -0.1360 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -2.6780 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2470 -0.3410 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 0.2400 3.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 2.1230 -0.5400 S 0 5 0 0 0 0 0 0 0 0 0 0 -0.7930 1.8690 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 1.9700 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -2.8040 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -2.7740 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -0.4760 2.5590 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8670 -0.4810 -1.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3850 -1.3310 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 0.3260 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.5940 -1.8980 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 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 M CHG 1 15 -1 M CHG 1 20 -1 M CHG 1 21 1 M END