PUBCHEM-ZINC03159360 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0980 1.5000 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.7020 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.0820 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7670 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.0710 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.6900 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 0.0550 -2.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.3950 -3.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 1.1190 -2.6130 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1520 -4.5280 -0.0310 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -4.8460 -1.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -4.8580 1.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -5.0550 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -6.5830 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -7.0110 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -7.3410 0.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 1.9070 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.8420 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 1.8410 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.1660 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -2.6260 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.6060 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -4.6730 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -4.6640 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -6.9650 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -6.9730 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 3 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END