PUBCHEM-ZINC05394984 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 5.6410 0.1480 -3.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 -1.0280 -3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 -1.3080 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -0.4080 -1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 0.7790 -1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 1.0510 -2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 1.6920 -0.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -0.7620 0.1460 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 -2.4560 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7650 -2.5340 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -2.8010 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -1.9340 1.1600 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1710 -2.4090 1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -0.7380 0.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5070 -3.4150 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -3.4940 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 -4.3740 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -5.1750 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -5.0970 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 -4.2200 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -5.9540 -2.4420 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8870 -6.7280 -2.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -5.8840 -3.3760 O 0 5 0 0 0 0 0 0 0 0 0 0 6.0410 0.3600 -4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -1.7300 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -2.2280 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 1.9690 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 1.5000 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 2.5170 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -3.8420 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -2.6500 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -2.8690 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1450 -4.4360 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -5.8620 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -4.1610 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 21 1 M CHG 1 23 -1 M END