PUBCHEM-ZINC00569354 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -1.3910 1.6170 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 0.3510 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 0.3820 2.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -0.7920 1.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -2.1680 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.7520 2.3810 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -2.9310 0.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -4.2710 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 -4.8150 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -6.1190 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -6.9160 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -6.3610 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -5.0530 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -8.3260 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -8.7510 -2.1420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8400 2.4660 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 1.5490 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 1.7770 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.6120 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -2.4630 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -4.2400 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -6.5180 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -6.9510 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -4.6760 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -8.9770 -1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 2 0 0 0 0 M CHG 1 15 -1 M END