PUBCHEM-ZINC05131803 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 0.1420 1.6580 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 0.1340 -0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7460 -0.1560 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -0.4000 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.2240 0.2860 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -2.5580 2.1990 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -2.5080 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -3.7610 3.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4170 -3.9410 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -3.7210 3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -5.0690 4.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7360 -5.0390 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 1.9660 -0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 2.9410 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 2.0180 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 2.1630 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 0.0570 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -0.1360 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -2.3950 4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -1.6080 2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -3.3750 4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -3.0840 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -5.0020 3.4750 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8710 -4.8960 4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -5.3500 2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -5.7110 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -0.4230 -1.2800 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1210 -1.3700 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 0.2270 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -0.4200 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 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 13 14 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 M CHG 1 23 1 M CHG 1 27 1 M END