PUBCHEM-ZINC03995852 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.0870 1.4540 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.0820 -0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0410 -0.4860 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -0.3650 -0.6370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4670 -0.9810 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 1.0210 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 3.4500 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 3.9030 -1.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -1.0820 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -0.3350 1.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -0.5950 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -0.8850 -2.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.8350 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.7700 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 1.0570 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 1.2780 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 3.9950 0.3070 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8890 1.8160 1.4000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6070 2.5660 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 0.8430 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 1.9480 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -2.2880 0.2140 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2320 -0.6420 -0.2220 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 23 -1 M CHG 1 24 -1 M END