Index of

Last updated : Thu May 18 02:15:23 JST 2017
Total : 68 (41) in this page
043025186.b3lyp_6-31g(d).inp

043025186.b3lyp_6-31g(d).qchem.inp (generated)

043025186.b3lyp_6-31g(d).gjf (generated)

043025186.b3lyp_6-31g(d).firefly.inp (generated)

043025186.b3lyp_6-31g(d).smash.inp (generated)

043025186.b3lyp_6-31g(d).nwchem.inp (generated) 043025186.b3lyp_6-31g(d).log.xz 043025186.td-b3lyp_6-31g+(d).inp 043025186.td-b3lyp_6-31g+(d).log.xz

043025186.td-b3lyp_6-31+g(d).qchem.inp (generated)

043025186.td-b3lyp_6-31+g(d).gjf (generated)

043025186.td-b3lyp_6-31+g(d).firefly.inp (generated)

043025186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043025186.mol 043025186.PUBCHEM 043025186.mol (via Jmol)
043025369.b3lyp_6-31g(d).inp

043025369.b3lyp_6-31g(d).qchem.inp (generated)

043025369.b3lyp_6-31g(d).gjf (generated)

043025369.b3lyp_6-31g(d).firefly.inp (generated)

043025369.b3lyp_6-31g(d).smash.inp (generated)

043025369.b3lyp_6-31g(d).nwchem.inp (generated) 043025369.b3lyp_6-31g(d).log.xz 043025369.mol 043025369.PUBCHEM 043025369.mol (via Jmol)
043025673.b3lyp_6-31g(d).inp

043025673.b3lyp_6-31g(d).qchem.inp (generated)

043025673.b3lyp_6-31g(d).gjf (generated)

043025673.b3lyp_6-31g(d).firefly.inp (generated)

043025673.b3lyp_6-31g(d).smash.inp (generated)

043025673.b3lyp_6-31g(d).nwchem.inp (generated) 043025673.b3lyp_6-31g(d).log.xz 043025673.mol 043025673.PUBCHEM 043025673.mol (via Jmol)
043027945.b3lyp_6-31g(d).inp

043027945.b3lyp_6-31g(d).qchem.inp (generated)

043027945.b3lyp_6-31g(d).gjf (generated)

043027945.b3lyp_6-31g(d).firefly.inp (generated)

043027945.b3lyp_6-31g(d).smash.inp (generated)

043027945.b3lyp_6-31g(d).nwchem.inp (generated) 043027945.b3lyp_6-31g(d).log.xz 043027945.mol 043027945.PUBCHEM 043027945.mol (via Jmol)
043028097.b3lyp_6-31g(d).inp

043028097.b3lyp_6-31g(d).qchem.inp (generated)

043028097.b3lyp_6-31g(d).gjf (generated)

043028097.b3lyp_6-31g(d).firefly.inp (generated)

043028097.b3lyp_6-31g(d).smash.inp (generated)

043028097.b3lyp_6-31g(d).nwchem.inp (generated) 043028097.b3lyp_6-31g(d).log.xz 043028097.td-b3lyp_6-31g+(d).inp 043028097.td-b3lyp_6-31g+(d).log.xz

043028097.td-b3lyp_6-31+g(d).qchem.inp (generated)

043028097.td-b3lyp_6-31+g(d).gjf (generated)

043028097.td-b3lyp_6-31+g(d).firefly.inp (generated)

043028097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043028097.mol 043028097.PUBCHEM 043028097.mol (via Jmol)
043028767.b3lyp_6-31g(d).inp

043028767.b3lyp_6-31g(d).qchem.inp (generated)

043028767.b3lyp_6-31g(d).gjf (generated)

043028767.b3lyp_6-31g(d).firefly.inp (generated)

043028767.b3lyp_6-31g(d).smash.inp (generated)

043028767.b3lyp_6-31g(d).nwchem.inp (generated) 043028767.b3lyp_6-31g(d).log.xz 043028767.td-b3lyp_6-31g+(d).inp 043028767.td-b3lyp_6-31g+(d).log.xz

043028767.td-b3lyp_6-31+g(d).qchem.inp (generated)

043028767.td-b3lyp_6-31+g(d).gjf (generated)

043028767.td-b3lyp_6-31+g(d).firefly.inp (generated)

043028767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043028767.mol 043028767.PUBCHEM 043028767.mol (via Jmol)
043030175.b3lyp_6-31g(d).inp

043030175.b3lyp_6-31g(d).qchem.inp (generated)

043030175.b3lyp_6-31g(d).gjf (generated)

043030175.b3lyp_6-31g(d).firefly.inp (generated)

043030175.b3lyp_6-31g(d).smash.inp (generated)

043030175.b3lyp_6-31g(d).nwchem.inp (generated) 043030175.b3lyp_6-31g(d).log.xz 043030175.td-b3lyp_6-31g+(d).inp 043030175.td-b3lyp_6-31g+(d).log.xz

043030175.td-b3lyp_6-31+g(d).qchem.inp (generated)

043030175.td-b3lyp_6-31+g(d).gjf (generated)

043030175.td-b3lyp_6-31+g(d).firefly.inp (generated)

043030175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043030175.mol 043030175.PUBCHEM 043030175.mol (via Jmol)
043031266.b3lyp_6-31g(d).inp

043031266.b3lyp_6-31g(d).qchem.inp (generated)

043031266.b3lyp_6-31g(d).gjf (generated)

043031266.b3lyp_6-31g(d).firefly.inp (generated)

043031266.b3lyp_6-31g(d).smash.inp (generated)

043031266.b3lyp_6-31g(d).nwchem.inp (generated) 043031266.b3lyp_6-31g(d).log.xz 043031266.mol 043031266.PUBCHEM 043031266.mol (via Jmol)
043031277.b3lyp_6-31g(d).inp

043031277.b3lyp_6-31g(d).qchem.inp (generated)

043031277.b3lyp_6-31g(d).gjf (generated)

043031277.b3lyp_6-31g(d).firefly.inp (generated)

043031277.b3lyp_6-31g(d).smash.inp (generated)

043031277.b3lyp_6-31g(d).nwchem.inp (generated) 043031277.b3lyp_6-31g(d).log.xz 043031277.td-b3lyp_6-31g+(d).inp 043031277.td-b3lyp_6-31g+(d).log.xz

043031277.td-b3lyp_6-31+g(d).qchem.inp (generated)

043031277.td-b3lyp_6-31+g(d).gjf (generated)

043031277.td-b3lyp_6-31+g(d).firefly.inp (generated)

043031277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043031277.mol 043031277.PUBCHEM 043031277.mol (via Jmol)
043034814.b3lyp_6-31g(d).inp

043034814.b3lyp_6-31g(d).qchem.inp (generated)

043034814.b3lyp_6-31g(d).gjf (generated)

043034814.b3lyp_6-31g(d).firefly.inp (generated)

043034814.b3lyp_6-31g(d).smash.inp (generated)

043034814.b3lyp_6-31g(d).nwchem.inp (generated) 043034814.b3lyp_6-31g(d).log.xz 043034814.mol 043034814.PUBCHEM 043034814.mol (via Jmol)
043034826.b3lyp_6-31g(d).inp

043034826.b3lyp_6-31g(d).qchem.inp (generated)

043034826.b3lyp_6-31g(d).gjf (generated)

043034826.b3lyp_6-31g(d).firefly.inp (generated)

043034826.b3lyp_6-31g(d).smash.inp (generated)

043034826.b3lyp_6-31g(d).nwchem.inp (generated) 043034826.b3lyp_6-31g(d).log.xz 043034826.td-b3lyp_6-31g+(d).inp 043034826.td-b3lyp_6-31g+(d).log.xz

043034826.td-b3lyp_6-31+g(d).qchem.inp (generated)

043034826.td-b3lyp_6-31+g(d).gjf (generated)

043034826.td-b3lyp_6-31+g(d).firefly.inp (generated)

043034826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043034826.mol 043034826.PUBCHEM 043034826.mol (via Jmol)
043034894.b3lyp_6-31g(d).inp

043034894.b3lyp_6-31g(d).qchem.inp (generated)

043034894.b3lyp_6-31g(d).gjf (generated)

043034894.b3lyp_6-31g(d).firefly.inp (generated)

043034894.b3lyp_6-31g(d).smash.inp (generated)

043034894.b3lyp_6-31g(d).nwchem.inp (generated) 043034894.b3lyp_6-31g(d).log.xz 043034894.td-b3lyp_6-31g+(d).inp 043034894.td-b3lyp_6-31g+(d).log.xz

043034894.td-b3lyp_6-31+g(d).qchem.inp (generated)

043034894.td-b3lyp_6-31+g(d).gjf (generated)

043034894.td-b3lyp_6-31+g(d).firefly.inp (generated)

043034894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043034894.mol 043034894.PUBCHEM 043034894.mol (via Jmol)
043035047.b3lyp_6-31g(d).inp

043035047.b3lyp_6-31g(d).qchem.inp (generated)

043035047.b3lyp_6-31g(d).gjf (generated)

043035047.b3lyp_6-31g(d).firefly.inp (generated)

043035047.b3lyp_6-31g(d).smash.inp (generated)

043035047.b3lyp_6-31g(d).nwchem.inp (generated) 043035047.b3lyp_6-31g(d).log.xz 043035047.td-b3lyp_6-31g+(d).inp 043035047.td-b3lyp_6-31g+(d).log.xz

043035047.td-b3lyp_6-31+g(d).qchem.inp (generated)

043035047.td-b3lyp_6-31+g(d).gjf (generated)

043035047.td-b3lyp_6-31+g(d).firefly.inp (generated)

043035047.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043035047.mol 043035047.PUBCHEM 043035047.mol (via Jmol)
043035080.b3lyp_6-31g(d).inp

043035080.b3lyp_6-31g(d).qchem.inp (generated)

043035080.b3lyp_6-31g(d).gjf (generated)

043035080.b3lyp_6-31g(d).firefly.inp (generated)

043035080.b3lyp_6-31g(d).smash.inp (generated)

043035080.b3lyp_6-31g(d).nwchem.inp (generated) 043035080.b3lyp_6-31g(d).log.xz 043035080.td-b3lyp_6-31g+(d).inp 043035080.td-b3lyp_6-31g+(d).log.xz

043035080.td-b3lyp_6-31+g(d).qchem.inp (generated)

043035080.td-b3lyp_6-31+g(d).gjf (generated)

043035080.td-b3lyp_6-31+g(d).firefly.inp (generated)

043035080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043035080.mol 043035080.PUBCHEM 043035080.mol (via Jmol)
043035149.b3lyp_6-31g(d).inp

043035149.b3lyp_6-31g(d).qchem.inp (generated)

043035149.b3lyp_6-31g(d).gjf (generated)

043035149.b3lyp_6-31g(d).firefly.inp (generated)

043035149.b3lyp_6-31g(d).smash.inp (generated)

043035149.b3lyp_6-31g(d).nwchem.inp (generated) 043035149.b3lyp_6-31g(d).log.xz 043035149.td-b3lyp_6-31g+(d).inp 043035149.td-b3lyp_6-31g+(d).log.xz

043035149.td-b3lyp_6-31+g(d).qchem.inp (generated)

043035149.td-b3lyp_6-31+g(d).gjf (generated)

043035149.td-b3lyp_6-31+g(d).firefly.inp (generated)

043035149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043035149.mol 043035149.PUBCHEM 043035149.mol (via Jmol)
043035153.b3lyp_6-31g(d).inp

043035153.b3lyp_6-31g(d).qchem.inp (generated)

043035153.b3lyp_6-31g(d).gjf (generated)

043035153.b3lyp_6-31g(d).firefly.inp (generated)

043035153.b3lyp_6-31g(d).smash.inp (generated)

043035153.b3lyp_6-31g(d).nwchem.inp (generated) 043035153.b3lyp_6-31g(d).log.xz 043035153.mol 043035153.PUBCHEM 043035153.mol (via Jmol)
043035236.b3lyp_6-31g(d).inp

043035236.b3lyp_6-31g(d).qchem.inp (generated)

043035236.b3lyp_6-31g(d).gjf (generated)

043035236.b3lyp_6-31g(d).firefly.inp (generated)

043035236.b3lyp_6-31g(d).smash.inp (generated)

043035236.b3lyp_6-31g(d).nwchem.inp (generated) 043035236.b3lyp_6-31g(d).log.xz 043035236.td-b3lyp_6-31g+(d).inp 043035236.td-b3lyp_6-31g+(d).log.xz

043035236.td-b3lyp_6-31+g(d).qchem.inp (generated)

043035236.td-b3lyp_6-31+g(d).gjf (generated)

043035236.td-b3lyp_6-31+g(d).firefly.inp (generated)

043035236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043035236.mol 043035236.PUBCHEM 043035236.mol (via Jmol)
043035309.b3lyp_6-31g(d).inp

043035309.b3lyp_6-31g(d).qchem.inp (generated)

043035309.b3lyp_6-31g(d).gjf (generated)

043035309.b3lyp_6-31g(d).firefly.inp (generated)

043035309.b3lyp_6-31g(d).smash.inp (generated)

043035309.b3lyp_6-31g(d).nwchem.inp (generated) 043035309.b3lyp_6-31g(d).log.xz 043035309.td-b3lyp_6-31g+(d).inp 043035309.td-b3lyp_6-31g+(d).log.xz

043035309.td-b3lyp_6-31+g(d).qchem.inp (generated)

043035309.td-b3lyp_6-31+g(d).gjf (generated)

043035309.td-b3lyp_6-31+g(d).firefly.inp (generated)

043035309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043035309.mol 043035309.PUBCHEM 043035309.mol (via Jmol)
043036237.b3lyp_6-31g(d).inp

043036237.b3lyp_6-31g(d).qchem.inp (generated)

043036237.b3lyp_6-31g(d).gjf (generated)

043036237.b3lyp_6-31g(d).firefly.inp (generated)

043036237.b3lyp_6-31g(d).smash.inp (generated)

043036237.b3lyp_6-31g(d).nwchem.inp (generated) 043036237.b3lyp_6-31g(d).log.xz 043036237.td-b3lyp_6-31g+(d).inp 043036237.td-b3lyp_6-31g+(d).log.xz

043036237.td-b3lyp_6-31+g(d).qchem.inp (generated)

043036237.td-b3lyp_6-31+g(d).gjf (generated)

043036237.td-b3lyp_6-31+g(d).firefly.inp (generated)

043036237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043036237.mol 043036237.PUBCHEM 043036237.mol (via Jmol)
043036239.b3lyp_6-31g(d).inp

043036239.b3lyp_6-31g(d).qchem.inp (generated)

043036239.b3lyp_6-31g(d).gjf (generated)

043036239.b3lyp_6-31g(d).firefly.inp (generated)

043036239.b3lyp_6-31g(d).smash.inp (generated)

043036239.b3lyp_6-31g(d).nwchem.inp (generated) 043036239.b3lyp_6-31g(d).log.xz 043036239.td-b3lyp_6-31g+(d).inp 043036239.td-b3lyp_6-31g+(d).log.xz

043036239.td-b3lyp_6-31+g(d).qchem.inp (generated)

043036239.td-b3lyp_6-31+g(d).gjf (generated)

043036239.td-b3lyp_6-31+g(d).firefly.inp (generated)

043036239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043036239.mol 043036239.PUBCHEM 043036239.mol (via Jmol)
043036246.b3lyp_6-31g(d).inp

043036246.b3lyp_6-31g(d).qchem.inp (generated)

043036246.b3lyp_6-31g(d).gjf (generated)

043036246.b3lyp_6-31g(d).firefly.inp (generated)

043036246.b3lyp_6-31g(d).smash.inp (generated)

043036246.b3lyp_6-31g(d).nwchem.inp (generated) 043036246.b3lyp_6-31g(d).log.xz 043036246.td-b3lyp_6-31g+(d).inp 043036246.td-b3lyp_6-31g+(d).log.xz

043036246.td-b3lyp_6-31+g(d).qchem.inp (generated)

043036246.td-b3lyp_6-31+g(d).gjf (generated)

043036246.td-b3lyp_6-31+g(d).firefly.inp (generated)

043036246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043036246.mol 043036246.PUBCHEM 043036246.mol (via Jmol)
043036930.b3lyp_6-31g(d).inp

043036930.b3lyp_6-31g(d).qchem.inp (generated)

043036930.b3lyp_6-31g(d).gjf (generated)

043036930.b3lyp_6-31g(d).firefly.inp (generated)

043036930.b3lyp_6-31g(d).smash.inp (generated)

043036930.b3lyp_6-31g(d).nwchem.inp (generated) 043036930.b3lyp_6-31g(d).log.xz 043036930.mol 043036930.PUBCHEM 043036930.mol (via Jmol)
043036935.b3lyp_6-31g(d).inp

043036935.b3lyp_6-31g(d).qchem.inp (generated)

043036935.b3lyp_6-31g(d).gjf (generated)

043036935.b3lyp_6-31g(d).firefly.inp (generated)

043036935.b3lyp_6-31g(d).smash.inp (generated)

043036935.b3lyp_6-31g(d).nwchem.inp (generated) 043036935.b3lyp_6-31g(d).log.xz 043036935.mol 043036935.PUBCHEM 043036935.mol (via Jmol)
043037426.b3lyp_6-31g(d).inp

043037426.b3lyp_6-31g(d).qchem.inp (generated)

043037426.b3lyp_6-31g(d).gjf (generated)

043037426.b3lyp_6-31g(d).firefly.inp (generated)

043037426.b3lyp_6-31g(d).smash.inp (generated)

043037426.b3lyp_6-31g(d).nwchem.inp (generated) 043037426.b3lyp_6-31g(d).log.xz 043037426.td-b3lyp_6-31g+(d).inp 043037426.td-b3lyp_6-31g+(d).log.xz

043037426.td-b3lyp_6-31+g(d).qchem.inp (generated)

043037426.td-b3lyp_6-31+g(d).gjf (generated)

043037426.td-b3lyp_6-31+g(d).firefly.inp (generated)

043037426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043037426.mol 043037426.PUBCHEM 043037426.mol (via Jmol)
043037427.b3lyp_6-31g(d).inp

043037427.b3lyp_6-31g(d).qchem.inp (generated)

043037427.b3lyp_6-31g(d).gjf (generated)

043037427.b3lyp_6-31g(d).firefly.inp (generated)

043037427.b3lyp_6-31g(d).smash.inp (generated)

043037427.b3lyp_6-31g(d).nwchem.inp (generated) 043037427.b3lyp_6-31g(d).log.xz 043037427.td-b3lyp_6-31g+(d).inp 043037427.td-b3lyp_6-31g+(d).log.xz

043037427.td-b3lyp_6-31+g(d).qchem.inp (generated)

043037427.td-b3lyp_6-31+g(d).gjf (generated)

043037427.td-b3lyp_6-31+g(d).firefly.inp (generated)

043037427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043037427.mol 043037427.PUBCHEM 043037427.mol (via Jmol)
043037428.b3lyp_6-31g(d).inp

043037428.b3lyp_6-31g(d).qchem.inp (generated)

043037428.b3lyp_6-31g(d).gjf (generated)

043037428.b3lyp_6-31g(d).firefly.inp (generated)

043037428.b3lyp_6-31g(d).smash.inp (generated)

043037428.b3lyp_6-31g(d).nwchem.inp (generated) 043037428.b3lyp_6-31g(d).log.xz 043037428.td-b3lyp_6-31g+(d).inp 043037428.td-b3lyp_6-31g+(d).log.xz

043037428.td-b3lyp_6-31+g(d).qchem.inp (generated)

043037428.td-b3lyp_6-31+g(d).gjf (generated)

043037428.td-b3lyp_6-31+g(d).firefly.inp (generated)

043037428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043037428.mol 043037428.PUBCHEM 043037428.mol (via Jmol)
043038477.b3lyp_6-31g(d).inp

043038477.b3lyp_6-31g(d).qchem.inp (generated)

043038477.b3lyp_6-31g(d).gjf (generated)

043038477.b3lyp_6-31g(d).firefly.inp (generated)

043038477.b3lyp_6-31g(d).smash.inp (generated)

043038477.b3lyp_6-31g(d).nwchem.inp (generated) 043038477.b3lyp_6-31g(d).log.xz 043038477.mol 043038477.PUBCHEM 043038477.mol (via Jmol)
043038944.b3lyp_6-31g(d).inp

043038944.b3lyp_6-31g(d).qchem.inp (generated)

043038944.b3lyp_6-31g(d).gjf (generated)

043038944.b3lyp_6-31g(d).firefly.inp (generated)

043038944.b3lyp_6-31g(d).smash.inp (generated)

043038944.b3lyp_6-31g(d).nwchem.inp (generated) 043038944.b3lyp_6-31g(d).log.xz 043038944.td-b3lyp_6-31g+(d).inp 043038944.td-b3lyp_6-31g+(d).log.xz

043038944.td-b3lyp_6-31+g(d).qchem.inp (generated)

043038944.td-b3lyp_6-31+g(d).gjf (generated)

043038944.td-b3lyp_6-31+g(d).firefly.inp (generated)

043038944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043038944.mol 043038944.PUBCHEM 043038944.mol (via Jmol)
043039161.b3lyp_6-31g(d).inp

043039161.b3lyp_6-31g(d).qchem.inp (generated)

043039161.b3lyp_6-31g(d).gjf (generated)

043039161.b3lyp_6-31g(d).firefly.inp (generated)

043039161.b3lyp_6-31g(d).smash.inp (generated)

043039161.b3lyp_6-31g(d).nwchem.inp (generated) 043039161.b3lyp_6-31g(d).log.xz 043039161.mol 043039161.PUBCHEM 043039161.mol (via Jmol)
043039192.b3lyp_6-31g(d).inp

043039192.b3lyp_6-31g(d).qchem.inp (generated)

043039192.b3lyp_6-31g(d).gjf (generated)

043039192.b3lyp_6-31g(d).firefly.inp (generated)

043039192.b3lyp_6-31g(d).smash.inp (generated)

043039192.b3lyp_6-31g(d).nwchem.inp (generated) 043039192.b3lyp_6-31g(d).log.xz 043039192.td-b3lyp_6-31g+(d).inp 043039192.td-b3lyp_6-31g+(d).log.xz

043039192.td-b3lyp_6-31+g(d).qchem.inp (generated)

043039192.td-b3lyp_6-31+g(d).gjf (generated)

043039192.td-b3lyp_6-31+g(d).firefly.inp (generated)

043039192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043039192.mol 043039192.PUBCHEM 043039192.mol (via Jmol)
043039296.b3lyp_6-31g(d).inp

043039296.b3lyp_6-31g(d).qchem.inp (generated)

043039296.b3lyp_6-31g(d).gjf (generated)

043039296.b3lyp_6-31g(d).firefly.inp (generated)

043039296.b3lyp_6-31g(d).smash.inp (generated)

043039296.b3lyp_6-31g(d).nwchem.inp (generated) 043039296.b3lyp_6-31g(d).log.xz 043039296.td-b3lyp_6-31g+(d).inp 043039296.td-b3lyp_6-31g+(d).log.xz

043039296.td-b3lyp_6-31+g(d).qchem.inp (generated)

043039296.td-b3lyp_6-31+g(d).gjf (generated)

043039296.td-b3lyp_6-31+g(d).firefly.inp (generated)

043039296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043039296.mol 043039296.PUBCHEM 043039296.mol (via Jmol)
043040281.b3lyp_6-31g(d).inp

043040281.b3lyp_6-31g(d).qchem.inp (generated)

043040281.b3lyp_6-31g(d).gjf (generated)

043040281.b3lyp_6-31g(d).firefly.inp (generated)

043040281.b3lyp_6-31g(d).smash.inp (generated)

043040281.b3lyp_6-31g(d).nwchem.inp (generated) 043040281.b3lyp_6-31g(d).log.xz 043040281.mol 043040281.PUBCHEM 043040281.mol (via Jmol)
043040329.b3lyp_6-31g(d).inp

043040329.b3lyp_6-31g(d).qchem.inp (generated)

043040329.b3lyp_6-31g(d).gjf (generated)

043040329.b3lyp_6-31g(d).firefly.inp (generated)

043040329.b3lyp_6-31g(d).smash.inp (generated)

043040329.b3lyp_6-31g(d).nwchem.inp (generated) 043040329.b3lyp_6-31g(d).log.xz 043040329.td-b3lyp_6-31g+(d).inp 043040329.td-b3lyp_6-31g+(d).log.xz

043040329.td-b3lyp_6-31+g(d).qchem.inp (generated)

043040329.td-b3lyp_6-31+g(d).gjf (generated)

043040329.td-b3lyp_6-31+g(d).firefly.inp (generated)

043040329.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043040329.mol 043040329.PUBCHEM 043040329.mol (via Jmol)
043040334.b3lyp_6-31g(d).inp

043040334.b3lyp_6-31g(d).qchem.inp (generated)

043040334.b3lyp_6-31g(d).gjf (generated)

043040334.b3lyp_6-31g(d).firefly.inp (generated)

043040334.b3lyp_6-31g(d).smash.inp (generated)

043040334.b3lyp_6-31g(d).nwchem.inp (generated) 043040334.b3lyp_6-31g(d).log.xz 043040334.td-b3lyp_6-31g+(d).inp 043040334.td-b3lyp_6-31g+(d).log.xz

043040334.td-b3lyp_6-31+g(d).qchem.inp (generated)

043040334.td-b3lyp_6-31+g(d).gjf (generated)

043040334.td-b3lyp_6-31+g(d).firefly.inp (generated)

043040334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043040334.mol 043040334.PUBCHEM 043040334.mol (via Jmol)
043040337.b3lyp_6-31g(d).inp

043040337.b3lyp_6-31g(d).qchem.inp (generated)

043040337.b3lyp_6-31g(d).gjf (generated)

043040337.b3lyp_6-31g(d).firefly.inp (generated)

043040337.b3lyp_6-31g(d).smash.inp (generated)

043040337.b3lyp_6-31g(d).nwchem.inp (generated) 043040337.b3lyp_6-31g(d).log.xz 043040337.mol 043040337.PUBCHEM 043040337.mol (via Jmol)
043041154.b3lyp_6-31g(d).inp

043041154.b3lyp_6-31g(d).qchem.inp (generated)

043041154.b3lyp_6-31g(d).gjf (generated)

043041154.b3lyp_6-31g(d).firefly.inp (generated)

043041154.b3lyp_6-31g(d).smash.inp (generated)

043041154.b3lyp_6-31g(d).nwchem.inp (generated) 043041154.b3lyp_6-31g(d).log.xz 043041154.td-b3lyp_6-31g+(d).inp 043041154.td-b3lyp_6-31g+(d).log.xz

043041154.td-b3lyp_6-31+g(d).qchem.inp (generated)

043041154.td-b3lyp_6-31+g(d).gjf (generated)

043041154.td-b3lyp_6-31+g(d).firefly.inp (generated)

043041154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043041154.mol 043041154.PUBCHEM 043041154.mol (via Jmol)
043042113.b3lyp_6-31g(d).inp

043042113.b3lyp_6-31g(d).qchem.inp (generated)

043042113.b3lyp_6-31g(d).gjf (generated)

043042113.b3lyp_6-31g(d).firefly.inp (generated)

043042113.b3lyp_6-31g(d).smash.inp (generated)

043042113.b3lyp_6-31g(d).nwchem.inp (generated) 043042113.b3lyp_6-31g(d).log.xz 043042113.mol 043042113.PUBCHEM 043042113.mol (via Jmol)
043042116.b3lyp_6-31g(d).inp

043042116.b3lyp_6-31g(d).qchem.inp (generated)

043042116.b3lyp_6-31g(d).gjf (generated)

043042116.b3lyp_6-31g(d).firefly.inp (generated)

043042116.b3lyp_6-31g(d).smash.inp (generated)

043042116.b3lyp_6-31g(d).nwchem.inp (generated) 043042116.b3lyp_6-31g(d).log.xz 043042116.mol 043042116.PUBCHEM 043042116.mol (via Jmol)
043042434.b3lyp_6-31g(d).inp

043042434.b3lyp_6-31g(d).qchem.inp (generated)

043042434.b3lyp_6-31g(d).gjf (generated)

043042434.b3lyp_6-31g(d).firefly.inp (generated)

043042434.b3lyp_6-31g(d).smash.inp (generated)

043042434.b3lyp_6-31g(d).nwchem.inp (generated) 043042434.b3lyp_6-31g(d).log.xz 043042434.mol 043042434.PUBCHEM 043042434.mol (via Jmol)
043042482.b3lyp_6-31g(d).inp

043042482.b3lyp_6-31g(d).qchem.inp (generated)

043042482.b3lyp_6-31g(d).gjf (generated)

043042482.b3lyp_6-31g(d).firefly.inp (generated)

043042482.b3lyp_6-31g(d).smash.inp (generated)

043042482.b3lyp_6-31g(d).nwchem.inp (generated) 043042482.b3lyp_6-31g(d).log.xz 043042482.td-b3lyp_6-31g+(d).inp 043042482.td-b3lyp_6-31g+(d).log.xz

043042482.td-b3lyp_6-31+g(d).qchem.inp (generated)

043042482.td-b3lyp_6-31+g(d).gjf (generated)

043042482.td-b3lyp_6-31+g(d).firefly.inp (generated)

043042482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043042482.mol 043042482.PUBCHEM 043042482.mol (via Jmol)
043042518.b3lyp_6-31g(d).inp

043042518.b3lyp_6-31g(d).qchem.inp (generated)

043042518.b3lyp_6-31g(d).gjf (generated)

043042518.b3lyp_6-31g(d).firefly.inp (generated)

043042518.b3lyp_6-31g(d).smash.inp (generated)

043042518.b3lyp_6-31g(d).nwchem.inp (generated) 043042518.b3lyp_6-31g(d).log.xz 043042518.mol 043042518.PUBCHEM 043042518.mol (via Jmol)
043042895.b3lyp_6-31g(d).inp

043042895.b3lyp_6-31g(d).qchem.inp (generated)

043042895.b3lyp_6-31g(d).gjf (generated)

043042895.b3lyp_6-31g(d).firefly.inp (generated)

043042895.b3lyp_6-31g(d).smash.inp (generated)

043042895.b3lyp_6-31g(d).nwchem.inp (generated) 043042895.b3lyp_6-31g(d).log.xz 043042895.mol 043042895.PUBCHEM 043042895.mol (via Jmol)
043043656.b3lyp_6-31g(d).inp

043043656.b3lyp_6-31g(d).qchem.inp (generated)

043043656.b3lyp_6-31g(d).gjf (generated)

043043656.b3lyp_6-31g(d).firefly.inp (generated)

043043656.b3lyp_6-31g(d).smash.inp (generated)

043043656.b3lyp_6-31g(d).nwchem.inp (generated) 043043656.b3lyp_6-31g(d).log.xz 043043656.td-b3lyp_6-31g+(d).inp 043043656.td-b3lyp_6-31g+(d).log.xz

043043656.td-b3lyp_6-31+g(d).qchem.inp (generated)

043043656.td-b3lyp_6-31+g(d).gjf (generated)

043043656.td-b3lyp_6-31+g(d).firefly.inp (generated)

043043656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043043656.mol 043043656.PUBCHEM 043043656.mol (via Jmol)
043043765.b3lyp_6-31g(d).inp

043043765.b3lyp_6-31g(d).qchem.inp (generated)

043043765.b3lyp_6-31g(d).gjf (generated)

043043765.b3lyp_6-31g(d).firefly.inp (generated)

043043765.b3lyp_6-31g(d).smash.inp (generated)

043043765.b3lyp_6-31g(d).nwchem.inp (generated) 043043765.b3lyp_6-31g(d).log.xz 043043765.td-b3lyp_6-31g+(d).inp 043043765.td-b3lyp_6-31g+(d).log.xz

043043765.td-b3lyp_6-31+g(d).qchem.inp (generated)

043043765.td-b3lyp_6-31+g(d).gjf (generated)

043043765.td-b3lyp_6-31+g(d).firefly.inp (generated)

043043765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043043765.mol 043043765.PUBCHEM 043043765.mol (via Jmol)
043044657.b3lyp_6-31g(d).inp

043044657.b3lyp_6-31g(d).qchem.inp (generated)

043044657.b3lyp_6-31g(d).gjf (generated)

043044657.b3lyp_6-31g(d).firefly.inp (generated)

043044657.b3lyp_6-31g(d).smash.inp (generated)

043044657.b3lyp_6-31g(d).nwchem.inp (generated) 043044657.b3lyp_6-31g(d).log.xz 043044657.td-b3lyp_6-31g+(d).inp 043044657.td-b3lyp_6-31g+(d).log.xz

043044657.td-b3lyp_6-31+g(d).qchem.inp (generated)

043044657.td-b3lyp_6-31+g(d).gjf (generated)

043044657.td-b3lyp_6-31+g(d).firefly.inp (generated)

043044657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043044657.mol 043044657.PUBCHEM 043044657.mol (via Jmol)
043044659.b3lyp_6-31g(d).inp

043044659.b3lyp_6-31g(d).qchem.inp (generated)

043044659.b3lyp_6-31g(d).gjf (generated)

043044659.b3lyp_6-31g(d).firefly.inp (generated)

043044659.b3lyp_6-31g(d).smash.inp (generated)

043044659.b3lyp_6-31g(d).nwchem.inp (generated) 043044659.b3lyp_6-31g(d).log.xz 043044659.mol 043044659.PUBCHEM 043044659.mol (via Jmol)
043044716.b3lyp_6-31g(d).inp

043044716.b3lyp_6-31g(d).qchem.inp (generated)

043044716.b3lyp_6-31g(d).gjf (generated)

043044716.b3lyp_6-31g(d).firefly.inp (generated)

043044716.b3lyp_6-31g(d).smash.inp (generated)

043044716.b3lyp_6-31g(d).nwchem.inp (generated) 043044716.b3lyp_6-31g(d).log.xz 043044716.mol 043044716.PUBCHEM 043044716.mol (via Jmol)
043044773.b3lyp_6-31g(d).inp

043044773.b3lyp_6-31g(d).qchem.inp (generated)

043044773.b3lyp_6-31g(d).gjf (generated)

043044773.b3lyp_6-31g(d).firefly.inp (generated)

043044773.b3lyp_6-31g(d).smash.inp (generated)

043044773.b3lyp_6-31g(d).nwchem.inp (generated) 043044773.b3lyp_6-31g(d).log.xz 043044773.td-b3lyp_6-31g+(d).inp 043044773.td-b3lyp_6-31g+(d).log.xz

043044773.td-b3lyp_6-31+g(d).qchem.inp (generated)

043044773.td-b3lyp_6-31+g(d).gjf (generated)

043044773.td-b3lyp_6-31+g(d).firefly.inp (generated)

043044773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043044773.mol 043044773.PUBCHEM 043044773.mol (via Jmol)
043044798.b3lyp_6-31g(d).inp

043044798.b3lyp_6-31g(d).qchem.inp (generated)

043044798.b3lyp_6-31g(d).gjf (generated)

043044798.b3lyp_6-31g(d).firefly.inp (generated)

043044798.b3lyp_6-31g(d).smash.inp (generated)

043044798.b3lyp_6-31g(d).nwchem.inp (generated) 043044798.b3lyp_6-31g(d).log.xz 043044798.mol 043044798.PUBCHEM 043044798.mol (via Jmol)
043044802.b3lyp_6-31g(d).inp

043044802.b3lyp_6-31g(d).qchem.inp (generated)

043044802.b3lyp_6-31g(d).gjf (generated)

043044802.b3lyp_6-31g(d).firefly.inp (generated)

043044802.b3lyp_6-31g(d).smash.inp (generated)

043044802.b3lyp_6-31g(d).nwchem.inp (generated) 043044802.b3lyp_6-31g(d).log.xz 043044802.td-b3lyp_6-31g+(d).inp 043044802.td-b3lyp_6-31g+(d).log.xz

043044802.td-b3lyp_6-31+g(d).qchem.inp (generated)

043044802.td-b3lyp_6-31+g(d).gjf (generated)

043044802.td-b3lyp_6-31+g(d).firefly.inp (generated)

043044802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043044802.mol 043044802.PUBCHEM 043044802.mol (via Jmol)
043044813.b3lyp_6-31g(d).inp

043044813.b3lyp_6-31g(d).qchem.inp (generated)

043044813.b3lyp_6-31g(d).gjf (generated)

043044813.b3lyp_6-31g(d).firefly.inp (generated)

043044813.b3lyp_6-31g(d).smash.inp (generated)

043044813.b3lyp_6-31g(d).nwchem.inp (generated) 043044813.b3lyp_6-31g(d).log.xz 043044813.td-b3lyp_6-31g+(d).inp 043044813.td-b3lyp_6-31g+(d).log.xz

043044813.td-b3lyp_6-31+g(d).qchem.inp (generated)

043044813.td-b3lyp_6-31+g(d).gjf (generated)

043044813.td-b3lyp_6-31+g(d).firefly.inp (generated)

043044813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043044813.mol 043044813.PUBCHEM 043044813.mol (via Jmol)
043045395.b3lyp_6-31g(d).inp

043045395.b3lyp_6-31g(d).qchem.inp (generated)

043045395.b3lyp_6-31g(d).gjf (generated)

043045395.b3lyp_6-31g(d).firefly.inp (generated)

043045395.b3lyp_6-31g(d).smash.inp (generated)

043045395.b3lyp_6-31g(d).nwchem.inp (generated) 043045395.b3lyp_6-31g(d).log.xz 043045395.td-b3lyp_6-31g+(d).inp 043045395.td-b3lyp_6-31g+(d).log.xz

043045395.td-b3lyp_6-31+g(d).qchem.inp (generated)

043045395.td-b3lyp_6-31+g(d).gjf (generated)

043045395.td-b3lyp_6-31+g(d).firefly.inp (generated)

043045395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043045395.mol 043045395.PUBCHEM 043045395.mol (via Jmol)
043045500.b3lyp_6-31g(d).inp

043045500.b3lyp_6-31g(d).qchem.inp (generated)

043045500.b3lyp_6-31g(d).gjf (generated)

043045500.b3lyp_6-31g(d).firefly.inp (generated)

043045500.b3lyp_6-31g(d).smash.inp (generated)

043045500.b3lyp_6-31g(d).nwchem.inp (generated) 043045500.b3lyp_6-31g(d).log.xz 043045500.mol 043045500.PUBCHEM 043045500.mol (via Jmol)
043045591.b3lyp_6-31g(d).inp

043045591.b3lyp_6-31g(d).qchem.inp (generated)

043045591.b3lyp_6-31g(d).gjf (generated)

043045591.b3lyp_6-31g(d).firefly.inp (generated)

043045591.b3lyp_6-31g(d).smash.inp (generated)

043045591.b3lyp_6-31g(d).nwchem.inp (generated) 043045591.b3lyp_6-31g(d).log.xz 043045591.mol 043045591.PUBCHEM 043045591.mol (via Jmol)
043045592.b3lyp_6-31g(d).inp

043045592.b3lyp_6-31g(d).qchem.inp (generated)

043045592.b3lyp_6-31g(d).gjf (generated)

043045592.b3lyp_6-31g(d).firefly.inp (generated)

043045592.b3lyp_6-31g(d).smash.inp (generated)

043045592.b3lyp_6-31g(d).nwchem.inp (generated) 043045592.b3lyp_6-31g(d).log.xz 043045592.mol 043045592.PUBCHEM 043045592.mol (via Jmol)
043045912.b3lyp_6-31g(d).inp

043045912.b3lyp_6-31g(d).qchem.inp (generated)

043045912.b3lyp_6-31g(d).gjf (generated)

043045912.b3lyp_6-31g(d).firefly.inp (generated)

043045912.b3lyp_6-31g(d).smash.inp (generated)

043045912.b3lyp_6-31g(d).nwchem.inp (generated) 043045912.b3lyp_6-31g(d).log.xz 043045912.mol 043045912.PUBCHEM 043045912.mol (via Jmol)
043045955.b3lyp_6-31g(d).inp

043045955.b3lyp_6-31g(d).qchem.inp (generated)

043045955.b3lyp_6-31g(d).gjf (generated)

043045955.b3lyp_6-31g(d).firefly.inp (generated)

043045955.b3lyp_6-31g(d).smash.inp (generated)

043045955.b3lyp_6-31g(d).nwchem.inp (generated) 043045955.b3lyp_6-31g(d).log.xz 043045955.td-b3lyp_6-31g+(d).inp 043045955.td-b3lyp_6-31g+(d).log.xz

043045955.td-b3lyp_6-31+g(d).qchem.inp (generated)

043045955.td-b3lyp_6-31+g(d).gjf (generated)

043045955.td-b3lyp_6-31+g(d).firefly.inp (generated)

043045955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043045955.mol 043045955.PUBCHEM 043045955.mol (via Jmol)
043046539.b3lyp_6-31g(d).inp

043046539.b3lyp_6-31g(d).qchem.inp (generated)

043046539.b3lyp_6-31g(d).gjf (generated)

043046539.b3lyp_6-31g(d).firefly.inp (generated)

043046539.b3lyp_6-31g(d).smash.inp (generated)

043046539.b3lyp_6-31g(d).nwchem.inp (generated) 043046539.b3lyp_6-31g(d).log.xz 043046539.td-b3lyp_6-31g+(d).inp 043046539.td-b3lyp_6-31g+(d).log.xz

043046539.td-b3lyp_6-31+g(d).qchem.inp (generated)

043046539.td-b3lyp_6-31+g(d).gjf (generated)

043046539.td-b3lyp_6-31+g(d).firefly.inp (generated)

043046539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043046539.mol 043046539.PUBCHEM 043046539.mol (via Jmol)
043046540.b3lyp_6-31g(d).inp

043046540.b3lyp_6-31g(d).qchem.inp (generated)

043046540.b3lyp_6-31g(d).gjf (generated)

043046540.b3lyp_6-31g(d).firefly.inp (generated)

043046540.b3lyp_6-31g(d).smash.inp (generated)

043046540.b3lyp_6-31g(d).nwchem.inp (generated) 043046540.b3lyp_6-31g(d).log.xz 043046540.mol 043046540.PUBCHEM 043046540.mol (via Jmol)
043046878.b3lyp_6-31g(d).inp

043046878.b3lyp_6-31g(d).qchem.inp (generated)

043046878.b3lyp_6-31g(d).gjf (generated)

043046878.b3lyp_6-31g(d).firefly.inp (generated)

043046878.b3lyp_6-31g(d).smash.inp (generated)

043046878.b3lyp_6-31g(d).nwchem.inp (generated) 043046878.b3lyp_6-31g(d).log.xz 043046878.td-b3lyp_6-31g+(d).inp 043046878.td-b3lyp_6-31g+(d).log.xz

043046878.td-b3lyp_6-31+g(d).qchem.inp (generated)

043046878.td-b3lyp_6-31+g(d).gjf (generated)

043046878.td-b3lyp_6-31+g(d).firefly.inp (generated)

043046878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043046878.mol 043046878.PUBCHEM 043046878.mol (via Jmol)
043047430.b3lyp_6-31g(d).inp

043047430.b3lyp_6-31g(d).qchem.inp (generated)

043047430.b3lyp_6-31g(d).gjf (generated)

043047430.b3lyp_6-31g(d).firefly.inp (generated)

043047430.b3lyp_6-31g(d).smash.inp (generated)

043047430.b3lyp_6-31g(d).nwchem.inp (generated) 043047430.b3lyp_6-31g(d).log.xz 043047430.td-b3lyp_6-31g+(d).inp 043047430.td-b3lyp_6-31g+(d).log.xz

043047430.td-b3lyp_6-31+g(d).qchem.inp (generated)

043047430.td-b3lyp_6-31+g(d).gjf (generated)

043047430.td-b3lyp_6-31+g(d).firefly.inp (generated)

043047430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043047430.mol 043047430.PUBCHEM 043047430.mol (via Jmol)
043047812.b3lyp_6-31g(d).inp

043047812.b3lyp_6-31g(d).qchem.inp (generated)

043047812.b3lyp_6-31g(d).gjf (generated)

043047812.b3lyp_6-31g(d).firefly.inp (generated)

043047812.b3lyp_6-31g(d).smash.inp (generated)

043047812.b3lyp_6-31g(d).nwchem.inp (generated) 043047812.b3lyp_6-31g(d).log.xz 043047812.td-b3lyp_6-31g+(d).inp 043047812.td-b3lyp_6-31g+(d).log.xz

043047812.td-b3lyp_6-31+g(d).qchem.inp (generated)

043047812.td-b3lyp_6-31+g(d).gjf (generated)

043047812.td-b3lyp_6-31+g(d).firefly.inp (generated)

043047812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043047812.mol 043047812.PUBCHEM 043047812.mol (via Jmol)
043047864.b3lyp_6-31g(d).inp

043047864.b3lyp_6-31g(d).qchem.inp (generated)

043047864.b3lyp_6-31g(d).gjf (generated)

043047864.b3lyp_6-31g(d).firefly.inp (generated)

043047864.b3lyp_6-31g(d).smash.inp (generated)

043047864.b3lyp_6-31g(d).nwchem.inp (generated) 043047864.b3lyp_6-31g(d).log.xz 043047864.td-b3lyp_6-31g+(d).inp 043047864.td-b3lyp_6-31g+(d).log.xz

043047864.td-b3lyp_6-31+g(d).qchem.inp (generated)

043047864.td-b3lyp_6-31+g(d).gjf (generated)

043047864.td-b3lyp_6-31+g(d).firefly.inp (generated)

043047864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043047864.mol 043047864.PUBCHEM 043047864.mol (via Jmol)
043047936.b3lyp_6-31g(d).inp

043047936.b3lyp_6-31g(d).qchem.inp (generated)

043047936.b3lyp_6-31g(d).gjf (generated)

043047936.b3lyp_6-31g(d).firefly.inp (generated)

043047936.b3lyp_6-31g(d).smash.inp (generated)

043047936.b3lyp_6-31g(d).nwchem.inp (generated) 043047936.b3lyp_6-31g(d).log.xz 043047936.td-b3lyp_6-31g+(d).inp 043047936.td-b3lyp_6-31g+(d).log.xz

043047936.td-b3lyp_6-31+g(d).qchem.inp (generated)

043047936.td-b3lyp_6-31+g(d).gjf (generated)

043047936.td-b3lyp_6-31+g(d).firefly.inp (generated)

043047936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043047936.mol 043047936.PUBCHEM 043047936.mol (via Jmol)
043048033.b3lyp_6-31g(d).inp

043048033.b3lyp_6-31g(d).qchem.inp (generated)

043048033.b3lyp_6-31g(d).gjf (generated)

043048033.b3lyp_6-31g(d).firefly.inp (generated)

043048033.b3lyp_6-31g(d).smash.inp (generated)

043048033.b3lyp_6-31g(d).nwchem.inp (generated) 043048033.b3lyp_6-31g(d).log.xz 043048033.mol 043048033.PUBCHEM 043048033.mol (via Jmol)
043048034.b3lyp_6-31g(d).inp

043048034.b3lyp_6-31g(d).qchem.inp (generated)

043048034.b3lyp_6-31g(d).gjf (generated)

043048034.b3lyp_6-31g(d).firefly.inp (generated)

043048034.b3lyp_6-31g(d).smash.inp (generated)

043048034.b3lyp_6-31g(d).nwchem.inp (generated) 043048034.b3lyp_6-31g(d).log.xz 043048034.mol 043048034.PUBCHEM 043048034.mol (via Jmol)
043048038.b3lyp_6-31g(d).inp

043048038.b3lyp_6-31g(d).qchem.inp (generated)

043048038.b3lyp_6-31g(d).gjf (generated)

043048038.b3lyp_6-31g(d).firefly.inp (generated)

043048038.b3lyp_6-31g(d).smash.inp (generated)

043048038.b3lyp_6-31g(d).nwchem.inp (generated) 043048038.b3lyp_6-31g(d).log.xz 043048038.td-b3lyp_6-31g+(d).inp 043048038.td-b3lyp_6-31g+(d).log.xz

043048038.td-b3lyp_6-31+g(d).qchem.inp (generated)

043048038.td-b3lyp_6-31+g(d).gjf (generated)

043048038.td-b3lyp_6-31+g(d).firefly.inp (generated)

043048038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043048038.mol 043048038.PUBCHEM 043048038.mol (via Jmol)
043048893.b3lyp_6-31g(d).inp

043048893.b3lyp_6-31g(d).qchem.inp (generated)

043048893.b3lyp_6-31g(d).gjf (generated)

043048893.b3lyp_6-31g(d).firefly.inp (generated)

043048893.b3lyp_6-31g(d).smash.inp (generated)

043048893.b3lyp_6-31g(d).nwchem.inp (generated) 043048893.b3lyp_6-31g(d).log.xz 043048893.td-b3lyp_6-31g+(d).inp 043048893.td-b3lyp_6-31g+(d).log.xz

043048893.td-b3lyp_6-31+g(d).qchem.inp (generated)

043048893.td-b3lyp_6-31+g(d).gjf (generated)

043048893.td-b3lyp_6-31+g(d).firefly.inp (generated)

043048893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043048893.mol 043048893.PUBCHEM 043048893.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com