PUBCHEM-ZINC03075297 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.2760 1.2670 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -0.2500 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -0.9180 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5710 1.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.8000 2.6860 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.1550 3.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 0.3120 2.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -2.2160 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -2.0890 2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -3.1990 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -4.4360 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -4.5620 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -3.4510 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -3.5850 2.2600 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4520 -4.6890 2.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -2.5920 2.3620 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3030 1.6320 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 1.5060 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 1.7430 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.6150 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.5530 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -1.9980 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.6790 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -0.6500 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -1.1230 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -3.1000 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -5.3030 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -5.5280 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 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 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END