Index of

Last updated : Thu Jun 22 02:29:55 JST 2017
Total : 865 (758) in this page
012050021.b3lyp_6-31g(d).inp

012050021.b3lyp_6-31g(d).qchem.inp (generated)

012050021.b3lyp_6-31g(d).gjf (generated)

012050021.b3lyp_6-31g(d).firefly.inp (generated)

012050021.b3lyp_6-31g(d).smash.inp (generated)

012050021.b3lyp_6-31g(d).nwchem.inp (generated) 012050021.b3lyp_6-31g(d).log.xz 012050021.td-b3lyp_6-31g+(d).inp 012050021.td-b3lyp_6-31g+(d).log.xz

012050021.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050021.td-b3lyp_6-31+g(d).gjf (generated)

012050021.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050021.mol 012050021.PUBCHEM 012050021.mol (via Jmol)
012050023.b3lyp_6-31g(d).inp

012050023.b3lyp_6-31g(d).qchem.inp (generated)

012050023.b3lyp_6-31g(d).gjf (generated)

012050023.b3lyp_6-31g(d).firefly.inp (generated)

012050023.b3lyp_6-31g(d).smash.inp (generated)

012050023.b3lyp_6-31g(d).nwchem.inp (generated) 012050023.b3lyp_6-31g(d).log.xz 012050023.td-b3lyp_6-31g+(d).inp 012050023.td-b3lyp_6-31g+(d).log.xz

012050023.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050023.td-b3lyp_6-31+g(d).gjf (generated)

012050023.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050023.mol 012050023.PUBCHEM 012050023.mol (via Jmol)
012050024.b3lyp_6-31g(d).inp

012050024.b3lyp_6-31g(d).qchem.inp (generated)

012050024.b3lyp_6-31g(d).gjf (generated)

012050024.b3lyp_6-31g(d).firefly.inp (generated)

012050024.b3lyp_6-31g(d).smash.inp (generated)

012050024.b3lyp_6-31g(d).nwchem.inp (generated) 012050024.b3lyp_6-31g(d).log.xz 012050024.td-b3lyp_6-31g+(d).inp 012050024.td-b3lyp_6-31g+(d).log.xz

012050024.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050024.td-b3lyp_6-31+g(d).gjf (generated)

012050024.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050024.mol 012050024.PUBCHEM 012050024.mol (via Jmol)
012050028.b3lyp_6-31g(d).inp

012050028.b3lyp_6-31g(d).qchem.inp (generated)

012050028.b3lyp_6-31g(d).gjf (generated)

012050028.b3lyp_6-31g(d).firefly.inp (generated)

012050028.b3lyp_6-31g(d).smash.inp (generated)

012050028.b3lyp_6-31g(d).nwchem.inp (generated) 012050028.b3lyp_6-31g(d).log.xz 012050028.td-b3lyp_6-31g+(d).inp 012050028.td-b3lyp_6-31g+(d).log.xz

012050028.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050028.td-b3lyp_6-31+g(d).gjf (generated)

012050028.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050028.mol 012050028.PUBCHEM 012050028.mol (via Jmol)
012050031.b3lyp_6-31g(d).inp

012050031.b3lyp_6-31g(d).qchem.inp (generated)

012050031.b3lyp_6-31g(d).gjf (generated)

012050031.b3lyp_6-31g(d).firefly.inp (generated)

012050031.b3lyp_6-31g(d).smash.inp (generated)

012050031.b3lyp_6-31g(d).nwchem.inp (generated) 012050031.b3lyp_6-31g(d).log.xz 012050031.td-b3lyp_6-31g+(d).inp 012050031.td-b3lyp_6-31g+(d).log.xz

012050031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050031.td-b3lyp_6-31+g(d).gjf (generated)

012050031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050031.mol 012050031.PUBCHEM 012050031.mol (via Jmol)
012050038.b3lyp_6-31g(d).inp

012050038.b3lyp_6-31g(d).qchem.inp (generated)

012050038.b3lyp_6-31g(d).gjf (generated)

012050038.b3lyp_6-31g(d).firefly.inp (generated)

012050038.b3lyp_6-31g(d).smash.inp (generated)

012050038.b3lyp_6-31g(d).nwchem.inp (generated) 012050038.b3lyp_6-31g(d).log.xz 012050038.td-b3lyp_6-31g+(d).inp 012050038.td-b3lyp_6-31g+(d).log.xz

012050038.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050038.td-b3lyp_6-31+g(d).gjf (generated)

012050038.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050038.mol 012050038.PUBCHEM 012050038.mol (via Jmol)
012050042.b3lyp_6-31g(d).inp

012050042.b3lyp_6-31g(d).qchem.inp (generated)

012050042.b3lyp_6-31g(d).gjf (generated)

012050042.b3lyp_6-31g(d).firefly.inp (generated)

012050042.b3lyp_6-31g(d).smash.inp (generated)

012050042.b3lyp_6-31g(d).nwchem.inp (generated) 012050042.b3lyp_6-31g(d).log.xz 012050042.td-b3lyp_6-31g+(d).inp 012050042.td-b3lyp_6-31g+(d).log.xz

012050042.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050042.td-b3lyp_6-31+g(d).gjf (generated)

012050042.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050042.mol 012050042.PUBCHEM 012050042.mol (via Jmol)
012050049.b3lyp_6-31g(d).inp

012050049.b3lyp_6-31g(d).qchem.inp (generated)

012050049.b3lyp_6-31g(d).gjf (generated)

012050049.b3lyp_6-31g(d).firefly.inp (generated)

012050049.b3lyp_6-31g(d).smash.inp (generated)

012050049.b3lyp_6-31g(d).nwchem.inp (generated) 012050049.b3lyp_6-31g(d).log.xz 012050049.td-b3lyp_6-31g+(d).inp 012050049.td-b3lyp_6-31g+(d).log.xz

012050049.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050049.td-b3lyp_6-31+g(d).gjf (generated)

012050049.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050049.mol 012050049.PUBCHEM 012050049.mol (via Jmol)
012050150.b3lyp_6-31g(d).inp

012050150.b3lyp_6-31g(d).qchem.inp (generated)

012050150.b3lyp_6-31g(d).gjf (generated)

012050150.b3lyp_6-31g(d).firefly.inp (generated)

012050150.b3lyp_6-31g(d).smash.inp (generated)

012050150.b3lyp_6-31g(d).nwchem.inp (generated) 012050150.b3lyp_6-31g(d).log.xz 012050150.td-b3lyp_6-31g+(d).inp 012050150.td-b3lyp_6-31g+(d).log.xz

012050150.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050150.td-b3lyp_6-31+g(d).gjf (generated)

012050150.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050150.mol 012050150.PUBCHEM 012050150.mol (via Jmol)
012050185.b3lyp_6-31g(d).inp

012050185.b3lyp_6-31g(d).qchem.inp (generated)

012050185.b3lyp_6-31g(d).gjf (generated)

012050185.b3lyp_6-31g(d).firefly.inp (generated)

012050185.b3lyp_6-31g(d).smash.inp (generated)

012050185.b3lyp_6-31g(d).nwchem.inp (generated) 012050185.b3lyp_6-31g(d).log.xz 012050185.td-b3lyp_6-31g+(d).inp 012050185.td-b3lyp_6-31g+(d).log.xz

012050185.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050185.td-b3lyp_6-31+g(d).gjf (generated)

012050185.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050185.mol 012050185.PUBCHEM 012050185.mol (via Jmol)
012050204.b3lyp_6-31g(d).inp

012050204.b3lyp_6-31g(d).qchem.inp (generated)

012050204.b3lyp_6-31g(d).gjf (generated)

012050204.b3lyp_6-31g(d).firefly.inp (generated)

012050204.b3lyp_6-31g(d).smash.inp (generated)

012050204.b3lyp_6-31g(d).nwchem.inp (generated) 012050204.b3lyp_6-31g(d).log.xz 012050204.td-b3lyp_6-31g+(d).inp 012050204.td-b3lyp_6-31g+(d).log.xz

012050204.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050204.td-b3lyp_6-31+g(d).gjf (generated)

012050204.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050204.mol 012050204.PUBCHEM 012050204.mol (via Jmol)
012050271.b3lyp_6-31g(d).inp

012050271.b3lyp_6-31g(d).qchem.inp (generated)

012050271.b3lyp_6-31g(d).gjf (generated)

012050271.b3lyp_6-31g(d).firefly.inp (generated)

012050271.b3lyp_6-31g(d).smash.inp (generated)

012050271.b3lyp_6-31g(d).nwchem.inp (generated) 012050271.b3lyp_6-31g(d).log.xz 012050271.td-b3lyp_6-31g+(d).inp 012050271.td-b3lyp_6-31g+(d).log.xz

012050271.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050271.td-b3lyp_6-31+g(d).gjf (generated)

012050271.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050271.mol 012050271.PUBCHEM 012050271.mol (via Jmol)
012050278.b3lyp_6-31g(d).inp

012050278.b3lyp_6-31g(d).qchem.inp (generated)

012050278.b3lyp_6-31g(d).gjf (generated)

012050278.b3lyp_6-31g(d).firefly.inp (generated)

012050278.b3lyp_6-31g(d).smash.inp (generated)

012050278.b3lyp_6-31g(d).nwchem.inp (generated) 012050278.b3lyp_6-31g(d).log.xz 012050278.td-b3lyp_6-31g+(d).inp 012050278.td-b3lyp_6-31g+(d).log.xz

012050278.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050278.td-b3lyp_6-31+g(d).gjf (generated)

012050278.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050278.mol 012050278.PUBCHEM 012050278.mol (via Jmol)
012050346.b3lyp_6-31g(d).inp

012050346.b3lyp_6-31g(d).qchem.inp (generated)

012050346.b3lyp_6-31g(d).gjf (generated)

012050346.b3lyp_6-31g(d).firefly.inp (generated)

012050346.b3lyp_6-31g(d).smash.inp (generated)

012050346.b3lyp_6-31g(d).nwchem.inp (generated) 012050346.b3lyp_6-31g(d).log.xz 012050346.td-b3lyp_6-31g+(d).inp 012050346.td-b3lyp_6-31g+(d).log.xz

012050346.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050346.td-b3lyp_6-31+g(d).gjf (generated)

012050346.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050346.mol 012050346.PUBCHEM 012050346.mol (via Jmol)
012050426.b3lyp_6-31g(d).inp

012050426.b3lyp_6-31g(d).qchem.inp (generated)

012050426.b3lyp_6-31g(d).gjf (generated)

012050426.b3lyp_6-31g(d).firefly.inp (generated)

012050426.b3lyp_6-31g(d).smash.inp (generated)

012050426.b3lyp_6-31g(d).nwchem.inp (generated) 012050426.b3lyp_6-31g(d).log.xz 012050426.td-b3lyp_6-31g+(d).inp 012050426.td-b3lyp_6-31g+(d).log.xz

012050426.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050426.td-b3lyp_6-31+g(d).gjf (generated)

012050426.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050426.mol 012050426.PUBCHEM 012050426.mol (via Jmol)
012050459.b3lyp_6-31g(d).inp

012050459.b3lyp_6-31g(d).qchem.inp (generated)

012050459.b3lyp_6-31g(d).gjf (generated)

012050459.b3lyp_6-31g(d).firefly.inp (generated)

012050459.b3lyp_6-31g(d).smash.inp (generated)

012050459.b3lyp_6-31g(d).nwchem.inp (generated) 012050459.b3lyp_6-31g(d).log.xz 012050459.mol 012050459.PUBCHEM 012050459.mol (via Jmol)
012050467.b3lyp_6-31g(d).inp

012050467.b3lyp_6-31g(d).qchem.inp (generated)

012050467.b3lyp_6-31g(d).gjf (generated)

012050467.b3lyp_6-31g(d).firefly.inp (generated)

012050467.b3lyp_6-31g(d).smash.inp (generated)

012050467.b3lyp_6-31g(d).nwchem.inp (generated) 012050467.b3lyp_6-31g(d).log.xz 012050467.td-b3lyp_6-31g+(d).inp 012050467.td-b3lyp_6-31g+(d).log.xz

012050467.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050467.td-b3lyp_6-31+g(d).gjf (generated)

012050467.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050467.mol 012050467.PUBCHEM 012050467.mol (via Jmol)
012050508.b3lyp_6-31g(d).inp

012050508.b3lyp_6-31g(d).qchem.inp (generated)

012050508.b3lyp_6-31g(d).gjf (generated)

012050508.b3lyp_6-31g(d).firefly.inp (generated)

012050508.b3lyp_6-31g(d).smash.inp (generated)

012050508.b3lyp_6-31g(d).nwchem.inp (generated) 012050508.b3lyp_6-31g(d).log.xz 012050508.td-b3lyp_6-31g+(d).inp 012050508.td-b3lyp_6-31g+(d).log.xz

012050508.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050508.td-b3lyp_6-31+g(d).gjf (generated)

012050508.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050508.mol 012050508.PUBCHEM 012050508.mol (via Jmol)
012050548.b3lyp_6-31g(d).inp

012050548.b3lyp_6-31g(d).qchem.inp (generated)

012050548.b3lyp_6-31g(d).gjf (generated)

012050548.b3lyp_6-31g(d).firefly.inp (generated)

012050548.b3lyp_6-31g(d).smash.inp (generated)

012050548.b3lyp_6-31g(d).nwchem.inp (generated) 012050548.b3lyp_6-31g(d).log.xz 012050548.mol 012050548.PUBCHEM 012050548.mol (via Jmol)
012050549.b3lyp_6-31g(d).inp

012050549.b3lyp_6-31g(d).qchem.inp (generated)

012050549.b3lyp_6-31g(d).gjf (generated)

012050549.b3lyp_6-31g(d).firefly.inp (generated)

012050549.b3lyp_6-31g(d).smash.inp (generated)

012050549.b3lyp_6-31g(d).nwchem.inp (generated) 012050549.b3lyp_6-31g(d).log.xz 012050549.td-b3lyp_6-31g+(d).inp 012050549.td-b3lyp_6-31g+(d).log.xz

012050549.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050549.td-b3lyp_6-31+g(d).gjf (generated)

012050549.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050549.mol 012050549.PUBCHEM 012050549.mol (via Jmol)
012050590.b3lyp_6-31g(d).inp

012050590.b3lyp_6-31g(d).qchem.inp (generated)

012050590.b3lyp_6-31g(d).gjf (generated)

012050590.b3lyp_6-31g(d).firefly.inp (generated)

012050590.b3lyp_6-31g(d).smash.inp (generated)

012050590.b3lyp_6-31g(d).nwchem.inp (generated) 012050590.b3lyp_6-31g(d).log.xz 012050590.mol 012050590.PUBCHEM 012050590.mol (via Jmol)
012050620.b3lyp_6-31g(d).inp

012050620.b3lyp_6-31g(d).qchem.inp (generated)

012050620.b3lyp_6-31g(d).gjf (generated)

012050620.b3lyp_6-31g(d).firefly.inp (generated)

012050620.b3lyp_6-31g(d).smash.inp (generated)

012050620.b3lyp_6-31g(d).nwchem.inp (generated) 012050620.b3lyp_6-31g(d).log.xz 012050620.td-b3lyp_6-31g+(d).inp 012050620.td-b3lyp_6-31g+(d).log.xz

012050620.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050620.td-b3lyp_6-31+g(d).gjf (generated)

012050620.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050620.mol 012050620.PUBCHEM 012050620.mol (via Jmol)
012050659.b3lyp_6-31g(d).inp

012050659.b3lyp_6-31g(d).qchem.inp (generated)

012050659.b3lyp_6-31g(d).gjf (generated)

012050659.b3lyp_6-31g(d).firefly.inp (generated)

012050659.b3lyp_6-31g(d).smash.inp (generated)

012050659.b3lyp_6-31g(d).nwchem.inp (generated) 012050659.b3lyp_6-31g(d).log.xz 012050659.td-b3lyp_6-31g+(d).inp 012050659.td-b3lyp_6-31g+(d).log.xz

012050659.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050659.td-b3lyp_6-31+g(d).gjf (generated)

012050659.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050659.mol 012050659.PUBCHEM 012050659.mol (via Jmol)
012050660.b3lyp_6-31g(d).inp

012050660.b3lyp_6-31g(d).qchem.inp (generated)

012050660.b3lyp_6-31g(d).gjf (generated)

012050660.b3lyp_6-31g(d).firefly.inp (generated)

012050660.b3lyp_6-31g(d).smash.inp (generated)

012050660.b3lyp_6-31g(d).nwchem.inp (generated) 012050660.b3lyp_6-31g(d).log.xz 012050660.td-b3lyp_6-31g+(d).inp 012050660.td-b3lyp_6-31g+(d).log.xz

012050660.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050660.td-b3lyp_6-31+g(d).gjf (generated)

012050660.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050660.mol 012050660.PUBCHEM 012050660.mol (via Jmol)
012050727.b3lyp_6-31g(d).inp

012050727.b3lyp_6-31g(d).qchem.inp (generated)

012050727.b3lyp_6-31g(d).gjf (generated)

012050727.b3lyp_6-31g(d).firefly.inp (generated)

012050727.b3lyp_6-31g(d).smash.inp (generated)

012050727.b3lyp_6-31g(d).nwchem.inp (generated) 012050727.b3lyp_6-31g(d).log.xz 012050727.td-b3lyp_6-31g+(d).inp 012050727.td-b3lyp_6-31g+(d).log.xz

012050727.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050727.td-b3lyp_6-31+g(d).gjf (generated)

012050727.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050727.mol 012050727.PUBCHEM 012050727.mol (via Jmol)
012050728.b3lyp_6-31g(d).inp

012050728.b3lyp_6-31g(d).qchem.inp (generated)

012050728.b3lyp_6-31g(d).gjf (generated)

012050728.b3lyp_6-31g(d).firefly.inp (generated)

012050728.b3lyp_6-31g(d).smash.inp (generated)

012050728.b3lyp_6-31g(d).nwchem.inp (generated) 012050728.b3lyp_6-31g(d).log.xz 012050728.td-b3lyp_6-31g+(d).inp 012050728.td-b3lyp_6-31g+(d).log.xz

012050728.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050728.td-b3lyp_6-31+g(d).gjf (generated)

012050728.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050728.mol 012050728.PUBCHEM 012050728.mol (via Jmol)
012050740.b3lyp_6-31g(d).inp

012050740.b3lyp_6-31g(d).qchem.inp (generated)

012050740.b3lyp_6-31g(d).gjf (generated)

012050740.b3lyp_6-31g(d).firefly.inp (generated)

012050740.b3lyp_6-31g(d).smash.inp (generated)

012050740.b3lyp_6-31g(d).nwchem.inp (generated) 012050740.b3lyp_6-31g(d).log.xz 012050740.td-b3lyp_6-31g+(d).inp 012050740.td-b3lyp_6-31g+(d).log.xz

012050740.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050740.td-b3lyp_6-31+g(d).gjf (generated)

012050740.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050740.mol 012050740.PUBCHEM 012050740.mol (via Jmol)
012050747.b3lyp_6-31g(d).inp

012050747.b3lyp_6-31g(d).qchem.inp (generated)

012050747.b3lyp_6-31g(d).gjf (generated)

012050747.b3lyp_6-31g(d).firefly.inp (generated)

012050747.b3lyp_6-31g(d).smash.inp (generated)

012050747.b3lyp_6-31g(d).nwchem.inp (generated) 012050747.b3lyp_6-31g(d).log.xz 012050747.mol 012050747.PUBCHEM 012050747.mol (via Jmol)
012050952.b3lyp_6-31g(d).inp

012050952.b3lyp_6-31g(d).qchem.inp (generated)

012050952.b3lyp_6-31g(d).gjf (generated)

012050952.b3lyp_6-31g(d).firefly.inp (generated)

012050952.b3lyp_6-31g(d).smash.inp (generated)

012050952.b3lyp_6-31g(d).nwchem.inp (generated) 012050952.b3lyp_6-31g(d).log.xz 012050952.td-b3lyp_6-31g+(d).inp 012050952.td-b3lyp_6-31g+(d).log.xz

012050952.td-b3lyp_6-31+g(d).qchem.inp (generated)

012050952.td-b3lyp_6-31+g(d).gjf (generated)

012050952.td-b3lyp_6-31+g(d).firefly.inp (generated)

012050952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012050952.mol 012050952.PUBCHEM 012050952.mol (via Jmol)
012051006.b3lyp_6-31g(d).inp

012051006.b3lyp_6-31g(d).qchem.inp (generated)

012051006.b3lyp_6-31g(d).gjf (generated)

012051006.b3lyp_6-31g(d).firefly.inp (generated)

012051006.b3lyp_6-31g(d).smash.inp (generated)

012051006.b3lyp_6-31g(d).nwchem.inp (generated) 012051006.b3lyp_6-31g(d).log.xz 012051006.td-b3lyp_6-31g+(d).inp 012051006.td-b3lyp_6-31g+(d).log.xz

012051006.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051006.td-b3lyp_6-31+g(d).gjf (generated)

012051006.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051006.mol 012051006.PUBCHEM 012051006.mol (via Jmol)
012051007.b3lyp_6-31g(d).inp

012051007.b3lyp_6-31g(d).qchem.inp (generated)

012051007.b3lyp_6-31g(d).gjf (generated)

012051007.b3lyp_6-31g(d).firefly.inp (generated)

012051007.b3lyp_6-31g(d).smash.inp (generated)

012051007.b3lyp_6-31g(d).nwchem.inp (generated) 012051007.b3lyp_6-31g(d).log.xz 012051007.td-b3lyp_6-31g+(d).inp 012051007.td-b3lyp_6-31g+(d).log.xz

012051007.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051007.td-b3lyp_6-31+g(d).gjf (generated)

012051007.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051007.mol 012051007.PUBCHEM 012051007.mol (via Jmol)
012051040.b3lyp_6-31g(d).inp

012051040.b3lyp_6-31g(d).qchem.inp (generated)

012051040.b3lyp_6-31g(d).gjf (generated)

012051040.b3lyp_6-31g(d).firefly.inp (generated)

012051040.b3lyp_6-31g(d).smash.inp (generated)

012051040.b3lyp_6-31g(d).nwchem.inp (generated) 012051040.b3lyp_6-31g(d).log.xz 012051040.td-b3lyp_6-31g+(d).inp 012051040.td-b3lyp_6-31g+(d).log.xz

012051040.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051040.td-b3lyp_6-31+g(d).gjf (generated)

012051040.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051040.mol 012051040.PUBCHEM 012051040.mol (via Jmol)
012051088.b3lyp_6-31g(d).inp

012051088.b3lyp_6-31g(d).qchem.inp (generated)

012051088.b3lyp_6-31g(d).gjf (generated)

012051088.b3lyp_6-31g(d).firefly.inp (generated)

012051088.b3lyp_6-31g(d).smash.inp (generated)

012051088.b3lyp_6-31g(d).nwchem.inp (generated) 012051088.b3lyp_6-31g(d).log.xz 012051088.td-b3lyp_6-31g+(d).inp 012051088.td-b3lyp_6-31g+(d).log.xz

012051088.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051088.td-b3lyp_6-31+g(d).gjf (generated)

012051088.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051088.mol 012051088.PUBCHEM 012051088.mol (via Jmol)
012051132.b3lyp_6-31g(d).inp

012051132.b3lyp_6-31g(d).qchem.inp (generated)

012051132.b3lyp_6-31g(d).gjf (generated)

012051132.b3lyp_6-31g(d).firefly.inp (generated)

012051132.b3lyp_6-31g(d).smash.inp (generated)

012051132.b3lyp_6-31g(d).nwchem.inp (generated) 012051132.b3lyp_6-31g(d).log.xz 012051132.td-b3lyp_6-31g+(d).inp 012051132.td-b3lyp_6-31g+(d).log.xz

012051132.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051132.td-b3lyp_6-31+g(d).gjf (generated)

012051132.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051132.mol 012051132.PUBCHEM 012051132.mol (via Jmol)
012051143.b3lyp_6-31g(d).inp

012051143.b3lyp_6-31g(d).qchem.inp (generated)

012051143.b3lyp_6-31g(d).gjf (generated)

012051143.b3lyp_6-31g(d).firefly.inp (generated)

012051143.b3lyp_6-31g(d).smash.inp (generated)

012051143.b3lyp_6-31g(d).nwchem.inp (generated) 012051143.b3lyp_6-31g(d).log.xz 012051143.td-b3lyp_6-31g+(d).inp 012051143.td-b3lyp_6-31g+(d).log.xz

012051143.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051143.td-b3lyp_6-31+g(d).gjf (generated)

012051143.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051143.mol 012051143.PUBCHEM 012051143.mol (via Jmol)
012051202.b3lyp_6-31g(d).inp

012051202.b3lyp_6-31g(d).qchem.inp (generated)

012051202.b3lyp_6-31g(d).gjf (generated)

012051202.b3lyp_6-31g(d).firefly.inp (generated)

012051202.b3lyp_6-31g(d).smash.inp (generated)

012051202.b3lyp_6-31g(d).nwchem.inp (generated) 012051202.b3lyp_6-31g(d).log.xz 012051202.td-b3lyp_6-31g+(d).inp 012051202.td-b3lyp_6-31g+(d).log.xz

012051202.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051202.td-b3lyp_6-31+g(d).gjf (generated)

012051202.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051202.mol 012051202.PUBCHEM 012051202.mol (via Jmol)
012051203.b3lyp_6-31g(d).inp

012051203.b3lyp_6-31g(d).qchem.inp (generated)

012051203.b3lyp_6-31g(d).gjf (generated)

012051203.b3lyp_6-31g(d).firefly.inp (generated)

012051203.b3lyp_6-31g(d).smash.inp (generated)

012051203.b3lyp_6-31g(d).nwchem.inp (generated) 012051203.b3lyp_6-31g(d).log.xz 012051203.td-b3lyp_6-31g+(d).inp 012051203.td-b3lyp_6-31g+(d).log.xz

012051203.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051203.td-b3lyp_6-31+g(d).gjf (generated)

012051203.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051203.mol 012051203.PUBCHEM 012051203.mol (via Jmol)
012051205.b3lyp_6-31g(d).inp

012051205.b3lyp_6-31g(d).qchem.inp (generated)

012051205.b3lyp_6-31g(d).gjf (generated)

012051205.b3lyp_6-31g(d).firefly.inp (generated)

012051205.b3lyp_6-31g(d).smash.inp (generated)

012051205.b3lyp_6-31g(d).nwchem.inp (generated) 012051205.b3lyp_6-31g(d).log.xz 012051205.mol 012051205.PUBCHEM 012051205.mol (via Jmol)
012051206.b3lyp_6-31g(d).inp

012051206.b3lyp_6-31g(d).qchem.inp (generated)

012051206.b3lyp_6-31g(d).gjf (generated)

012051206.b3lyp_6-31g(d).firefly.inp (generated)

012051206.b3lyp_6-31g(d).smash.inp (generated)

012051206.b3lyp_6-31g(d).nwchem.inp (generated) 012051206.b3lyp_6-31g(d).log.xz 012051206.td-b3lyp_6-31g+(d).inp 012051206.td-b3lyp_6-31g+(d).log.xz

012051206.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051206.td-b3lyp_6-31+g(d).gjf (generated)

012051206.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051206.mol 012051206.PUBCHEM 012051206.mol (via Jmol)
012051207.b3lyp_6-31g(d).inp

012051207.b3lyp_6-31g(d).qchem.inp (generated)

012051207.b3lyp_6-31g(d).gjf (generated)

012051207.b3lyp_6-31g(d).firefly.inp (generated)

012051207.b3lyp_6-31g(d).smash.inp (generated)

012051207.b3lyp_6-31g(d).nwchem.inp (generated) 012051207.b3lyp_6-31g(d).log.xz 012051207.td-b3lyp_6-31g+(d).inp 012051207.td-b3lyp_6-31g+(d).log.xz

012051207.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051207.td-b3lyp_6-31+g(d).gjf (generated)

012051207.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051207.mol 012051207.PUBCHEM 012051207.mol (via Jmol)
012051226.b3lyp_6-31g(d).inp

012051226.b3lyp_6-31g(d).qchem.inp (generated)

012051226.b3lyp_6-31g(d).gjf (generated)

012051226.b3lyp_6-31g(d).firefly.inp (generated)

012051226.b3lyp_6-31g(d).smash.inp (generated)

012051226.b3lyp_6-31g(d).nwchem.inp (generated) 012051226.b3lyp_6-31g(d).log.xz 012051226.td-b3lyp_6-31g+(d).inp 012051226.td-b3lyp_6-31g+(d).log.xz

012051226.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051226.td-b3lyp_6-31+g(d).gjf (generated)

012051226.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051226.mol 012051226.PUBCHEM 012051226.mol (via Jmol)
012051227.b3lyp_6-31g(d).inp

012051227.b3lyp_6-31g(d).qchem.inp (generated)

012051227.b3lyp_6-31g(d).gjf (generated)

012051227.b3lyp_6-31g(d).firefly.inp (generated)

012051227.b3lyp_6-31g(d).smash.inp (generated)

012051227.b3lyp_6-31g(d).nwchem.inp (generated) 012051227.b3lyp_6-31g(d).log.xz 012051227.td-b3lyp_6-31g+(d).inp 012051227.td-b3lyp_6-31g+(d).log.xz

012051227.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051227.td-b3lyp_6-31+g(d).gjf (generated)

012051227.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051227.mol 012051227.PUBCHEM 012051227.mol (via Jmol)
012051228.b3lyp_6-31g(d).inp

012051228.b3lyp_6-31g(d).qchem.inp (generated)

012051228.b3lyp_6-31g(d).gjf (generated)

012051228.b3lyp_6-31g(d).firefly.inp (generated)

012051228.b3lyp_6-31g(d).smash.inp (generated)

012051228.b3lyp_6-31g(d).nwchem.inp (generated) 012051228.b3lyp_6-31g(d).log.xz 012051228.td-b3lyp_6-31g+(d).inp 012051228.td-b3lyp_6-31g+(d).log.xz

012051228.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051228.td-b3lyp_6-31+g(d).gjf (generated)

012051228.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051228.mol 012051228.PUBCHEM 012051228.mol (via Jmol)
012051229.b3lyp_6-31g(d).inp

012051229.b3lyp_6-31g(d).qchem.inp (generated)

012051229.b3lyp_6-31g(d).gjf (generated)

012051229.b3lyp_6-31g(d).firefly.inp (generated)

012051229.b3lyp_6-31g(d).smash.inp (generated)

012051229.b3lyp_6-31g(d).nwchem.inp (generated) 012051229.b3lyp_6-31g(d).log.xz 012051229.td-b3lyp_6-31g+(d).inp 012051229.td-b3lyp_6-31g+(d).log.xz

012051229.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051229.td-b3lyp_6-31+g(d).gjf (generated)

012051229.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051229.mol 012051229.PUBCHEM 012051229.mol (via Jmol)
012051347.b3lyp_6-31g(d).inp

012051347.b3lyp_6-31g(d).qchem.inp (generated)

012051347.b3lyp_6-31g(d).gjf (generated)

012051347.b3lyp_6-31g(d).firefly.inp (generated)

012051347.b3lyp_6-31g(d).smash.inp (generated)

012051347.b3lyp_6-31g(d).nwchem.inp (generated) 012051347.b3lyp_6-31g(d).log.xz 012051347.td-b3lyp_6-31g+(d).inp 012051347.td-b3lyp_6-31g+(d).log.xz

012051347.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051347.td-b3lyp_6-31+g(d).gjf (generated)

012051347.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051347.mol 012051347.PUBCHEM 012051347.mol (via Jmol)
012051370.b3lyp_6-31g(d).inp

012051370.b3lyp_6-31g(d).qchem.inp (generated)

012051370.b3lyp_6-31g(d).gjf (generated)

012051370.b3lyp_6-31g(d).firefly.inp (generated)

012051370.b3lyp_6-31g(d).smash.inp (generated)

012051370.b3lyp_6-31g(d).nwchem.inp (generated) 012051370.b3lyp_6-31g(d).log.xz 012051370.td-b3lyp_6-31g+(d).inp 012051370.td-b3lyp_6-31g+(d).log.xz

012051370.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051370.td-b3lyp_6-31+g(d).gjf (generated)

012051370.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051370.mol 012051370.PUBCHEM 012051370.mol (via Jmol)
012051371.b3lyp_6-31g(d).inp

012051371.b3lyp_6-31g(d).qchem.inp (generated)

012051371.b3lyp_6-31g(d).gjf (generated)

012051371.b3lyp_6-31g(d).firefly.inp (generated)

012051371.b3lyp_6-31g(d).smash.inp (generated)

012051371.b3lyp_6-31g(d).nwchem.inp (generated) 012051371.b3lyp_6-31g(d).log.xz 012051371.td-b3lyp_6-31g+(d).inp 012051371.td-b3lyp_6-31g+(d).log.xz

012051371.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051371.td-b3lyp_6-31+g(d).gjf (generated)

012051371.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051371.mol 012051371.PUBCHEM 012051371.mol (via Jmol)
012051396.b3lyp_6-31g(d).inp

012051396.b3lyp_6-31g(d).qchem.inp (generated)

012051396.b3lyp_6-31g(d).gjf (generated)

012051396.b3lyp_6-31g(d).firefly.inp (generated)

012051396.b3lyp_6-31g(d).smash.inp (generated)

012051396.b3lyp_6-31g(d).nwchem.inp (generated) 012051396.b3lyp_6-31g(d).log.xz 012051396.td-b3lyp_6-31g+(d).inp 012051396.td-b3lyp_6-31g+(d).log.xz

012051396.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051396.td-b3lyp_6-31+g(d).gjf (generated)

012051396.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051396.mol 012051396.PUBCHEM 012051396.mol (via Jmol)
012051397.b3lyp_6-31g(d).inp

012051397.b3lyp_6-31g(d).qchem.inp (generated)

012051397.b3lyp_6-31g(d).gjf (generated)

012051397.b3lyp_6-31g(d).firefly.inp (generated)

012051397.b3lyp_6-31g(d).smash.inp (generated)

012051397.b3lyp_6-31g(d).nwchem.inp (generated) 012051397.b3lyp_6-31g(d).log.xz 012051397.td-b3lyp_6-31g+(d).inp 012051397.td-b3lyp_6-31g+(d).log.xz

012051397.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051397.td-b3lyp_6-31+g(d).gjf (generated)

012051397.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051397.mol 012051397.PUBCHEM 012051397.mol (via Jmol)
012051398.b3lyp_6-31g(d).inp

012051398.b3lyp_6-31g(d).qchem.inp (generated)

012051398.b3lyp_6-31g(d).gjf (generated)

012051398.b3lyp_6-31g(d).firefly.inp (generated)

012051398.b3lyp_6-31g(d).smash.inp (generated)

012051398.b3lyp_6-31g(d).nwchem.inp (generated) 012051398.b3lyp_6-31g(d).log.xz 012051398.mol 012051398.PUBCHEM 012051398.mol (via Jmol)
012051428.b3lyp_6-31g(d).inp

012051428.b3lyp_6-31g(d).qchem.inp (generated)

012051428.b3lyp_6-31g(d).gjf (generated)

012051428.b3lyp_6-31g(d).firefly.inp (generated)

012051428.b3lyp_6-31g(d).smash.inp (generated)

012051428.b3lyp_6-31g(d).nwchem.inp (generated) 012051428.b3lyp_6-31g(d).log.xz 012051428.td-b3lyp_6-31g+(d).inp 012051428.td-b3lyp_6-31g+(d).log.xz

012051428.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051428.td-b3lyp_6-31+g(d).gjf (generated)

012051428.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051428.mol 012051428.PUBCHEM 012051428.mol (via Jmol)
012051452.b3lyp_6-31g(d).inp

012051452.b3lyp_6-31g(d).qchem.inp (generated)

012051452.b3lyp_6-31g(d).gjf (generated)

012051452.b3lyp_6-31g(d).firefly.inp (generated)

012051452.b3lyp_6-31g(d).smash.inp (generated)

012051452.b3lyp_6-31g(d).nwchem.inp (generated) 012051452.b3lyp_6-31g(d).log.xz 012051452.td-b3lyp_6-31g+(d).inp 012051452.td-b3lyp_6-31g+(d).log.xz

012051452.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051452.td-b3lyp_6-31+g(d).gjf (generated)

012051452.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051452.mol 012051452.PUBCHEM 012051452.mol (via Jmol)
012051465.b3lyp_6-31g(d).inp

012051465.b3lyp_6-31g(d).qchem.inp (generated)

012051465.b3lyp_6-31g(d).gjf (generated)

012051465.b3lyp_6-31g(d).firefly.inp (generated)

012051465.b3lyp_6-31g(d).smash.inp (generated)

012051465.b3lyp_6-31g(d).nwchem.inp (generated) 012051465.b3lyp_6-31g(d).log.xz 012051465.td-b3lyp_6-31g+(d).inp 012051465.td-b3lyp_6-31g+(d).log.xz

012051465.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051465.td-b3lyp_6-31+g(d).gjf (generated)

012051465.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051465.mol 012051465.PUBCHEM 012051465.mol (via Jmol)
012051497.b3lyp_6-31g(d).inp

012051497.b3lyp_6-31g(d).qchem.inp (generated)

012051497.b3lyp_6-31g(d).gjf (generated)

012051497.b3lyp_6-31g(d).firefly.inp (generated)

012051497.b3lyp_6-31g(d).smash.inp (generated)

012051497.b3lyp_6-31g(d).nwchem.inp (generated) 012051497.b3lyp_6-31g(d).log.xz 012051497.td-b3lyp_6-31g+(d).inp 012051497.td-b3lyp_6-31g+(d).log.xz

012051497.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051497.td-b3lyp_6-31+g(d).gjf (generated)

012051497.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051497.mol 012051497.PUBCHEM 012051497.mol (via Jmol)
012051504.b3lyp_6-31g(d).inp

012051504.b3lyp_6-31g(d).qchem.inp (generated)

012051504.b3lyp_6-31g(d).gjf (generated)

012051504.b3lyp_6-31g(d).firefly.inp (generated)

012051504.b3lyp_6-31g(d).smash.inp (generated)

012051504.b3lyp_6-31g(d).nwchem.inp (generated) 012051504.b3lyp_6-31g(d).log.xz 012051504.td-b3lyp_6-31g+(d).inp 012051504.td-b3lyp_6-31g+(d).log.xz

012051504.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051504.td-b3lyp_6-31+g(d).gjf (generated)

012051504.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051504.mol 012051504.PUBCHEM 012051504.mol (via Jmol)
012051505.b3lyp_6-31g(d).inp

012051505.b3lyp_6-31g(d).qchem.inp (generated)

012051505.b3lyp_6-31g(d).gjf (generated)

012051505.b3lyp_6-31g(d).firefly.inp (generated)

012051505.b3lyp_6-31g(d).smash.inp (generated)

012051505.b3lyp_6-31g(d).nwchem.inp (generated) 012051505.b3lyp_6-31g(d).log.xz 012051505.td-b3lyp_6-31g+(d).inp 012051505.td-b3lyp_6-31g+(d).log.xz

012051505.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051505.td-b3lyp_6-31+g(d).gjf (generated)

012051505.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051505.mol 012051505.PUBCHEM 012051505.mol (via Jmol)
012051511.b3lyp_6-31g(d).inp

012051511.b3lyp_6-31g(d).qchem.inp (generated)

012051511.b3lyp_6-31g(d).gjf (generated)

012051511.b3lyp_6-31g(d).firefly.inp (generated)

012051511.b3lyp_6-31g(d).smash.inp (generated)

012051511.b3lyp_6-31g(d).nwchem.inp (generated) 012051511.b3lyp_6-31g(d).log.xz 012051511.td-b3lyp_6-31g+(d).inp 012051511.td-b3lyp_6-31g+(d).log.xz

012051511.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051511.td-b3lyp_6-31+g(d).gjf (generated)

012051511.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051511.mol 012051511.PUBCHEM 012051511.mol (via Jmol)
012051520.b3lyp_6-31g(d).inp

012051520.b3lyp_6-31g(d).qchem.inp (generated)

012051520.b3lyp_6-31g(d).gjf (generated)

012051520.b3lyp_6-31g(d).firefly.inp (generated)

012051520.b3lyp_6-31g(d).smash.inp (generated)

012051520.b3lyp_6-31g(d).nwchem.inp (generated) 012051520.b3lyp_6-31g(d).log.xz 012051520.td-b3lyp_6-31g+(d).inp 012051520.td-b3lyp_6-31g+(d).log.xz

012051520.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051520.td-b3lyp_6-31+g(d).gjf (generated)

012051520.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051520.mol 012051520.PUBCHEM 012051520.mol (via Jmol)
012051521.b3lyp_6-31g(d).inp

012051521.b3lyp_6-31g(d).qchem.inp (generated)

012051521.b3lyp_6-31g(d).gjf (generated)

012051521.b3lyp_6-31g(d).firefly.inp (generated)

012051521.b3lyp_6-31g(d).smash.inp (generated)

012051521.b3lyp_6-31g(d).nwchem.inp (generated) 012051521.b3lyp_6-31g(d).log.xz 012051521.td-b3lyp_6-31g+(d).inp 012051521.td-b3lyp_6-31g+(d).log.xz

012051521.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051521.td-b3lyp_6-31+g(d).gjf (generated)

012051521.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051521.mol 012051521.PUBCHEM 012051521.mol (via Jmol)
012051523.b3lyp_6-31g(d).inp

012051523.b3lyp_6-31g(d).qchem.inp (generated)

012051523.b3lyp_6-31g(d).gjf (generated)

012051523.b3lyp_6-31g(d).firefly.inp (generated)

012051523.b3lyp_6-31g(d).smash.inp (generated)

012051523.b3lyp_6-31g(d).nwchem.inp (generated) 012051523.b3lyp_6-31g(d).log.xz 012051523.td-b3lyp_6-31g+(d).inp 012051523.td-b3lyp_6-31g+(d).log.xz

012051523.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051523.td-b3lyp_6-31+g(d).gjf (generated)

012051523.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051523.mol 012051523.PUBCHEM 012051523.mol (via Jmol)
012051524.b3lyp_6-31g(d).inp

012051524.b3lyp_6-31g(d).qchem.inp (generated)

012051524.b3lyp_6-31g(d).gjf (generated)

012051524.b3lyp_6-31g(d).firefly.inp (generated)

012051524.b3lyp_6-31g(d).smash.inp (generated)

012051524.b3lyp_6-31g(d).nwchem.inp (generated) 012051524.b3lyp_6-31g(d).log.xz 012051524.td-b3lyp_6-31g+(d).inp 012051524.td-b3lyp_6-31g+(d).log.xz

012051524.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051524.td-b3lyp_6-31+g(d).gjf (generated)

012051524.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051524.mol 012051524.PUBCHEM 012051524.mol (via Jmol)
012051525.b3lyp_6-31g(d).inp

012051525.b3lyp_6-31g(d).qchem.inp (generated)

012051525.b3lyp_6-31g(d).gjf (generated)

012051525.b3lyp_6-31g(d).firefly.inp (generated)

012051525.b3lyp_6-31g(d).smash.inp (generated)

012051525.b3lyp_6-31g(d).nwchem.inp (generated) 012051525.b3lyp_6-31g(d).log.xz 012051525.td-b3lyp_6-31g+(d).inp 012051525.td-b3lyp_6-31g+(d).log.xz

012051525.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051525.td-b3lyp_6-31+g(d).gjf (generated)

012051525.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051525.mol 012051525.PUBCHEM 012051525.mol (via Jmol)
012051571.b3lyp_6-31g(d).inp

012051571.b3lyp_6-31g(d).qchem.inp (generated)

012051571.b3lyp_6-31g(d).gjf (generated)

012051571.b3lyp_6-31g(d).firefly.inp (generated)

012051571.b3lyp_6-31g(d).smash.inp (generated)

012051571.b3lyp_6-31g(d).nwchem.inp (generated) 012051571.b3lyp_6-31g(d).log.xz 012051571.td-b3lyp_6-31g+(d).inp 012051571.td-b3lyp_6-31g+(d).log.xz

012051571.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051571.td-b3lyp_6-31+g(d).gjf (generated)

012051571.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051571.mol 012051571.PUBCHEM 012051571.mol (via Jmol)
012051572.b3lyp_6-31g(d).inp

012051572.b3lyp_6-31g(d).qchem.inp (generated)

012051572.b3lyp_6-31g(d).gjf (generated)

012051572.b3lyp_6-31g(d).firefly.inp (generated)

012051572.b3lyp_6-31g(d).smash.inp (generated)

012051572.b3lyp_6-31g(d).nwchem.inp (generated) 012051572.b3lyp_6-31g(d).log.xz 012051572.td-b3lyp_6-31g+(d).inp 012051572.td-b3lyp_6-31g+(d).log.xz

012051572.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051572.td-b3lyp_6-31+g(d).gjf (generated)

012051572.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051572.mol 012051572.PUBCHEM 012051572.mol (via Jmol)
012051602.b3lyp_6-31g(d).inp

012051602.b3lyp_6-31g(d).qchem.inp (generated)

012051602.b3lyp_6-31g(d).gjf (generated)

012051602.b3lyp_6-31g(d).firefly.inp (generated)

012051602.b3lyp_6-31g(d).smash.inp (generated)

012051602.b3lyp_6-31g(d).nwchem.inp (generated) 012051602.b3lyp_6-31g(d).log.xz 012051602.td-b3lyp_6-31g+(d).inp 012051602.td-b3lyp_6-31g+(d).log.xz

012051602.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051602.td-b3lyp_6-31+g(d).gjf (generated)

012051602.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051602.mol 012051602.PUBCHEM 012051602.mol (via Jmol)
012051603.b3lyp_6-31g(d).inp

012051603.b3lyp_6-31g(d).qchem.inp (generated)

012051603.b3lyp_6-31g(d).gjf (generated)

012051603.b3lyp_6-31g(d).firefly.inp (generated)

012051603.b3lyp_6-31g(d).smash.inp (generated)

012051603.b3lyp_6-31g(d).nwchem.inp (generated) 012051603.b3lyp_6-31g(d).log.xz 012051603.mol 012051603.PUBCHEM 012051603.mol (via Jmol)
012051604.b3lyp_6-31g(d).inp

012051604.b3lyp_6-31g(d).qchem.inp (generated)

012051604.b3lyp_6-31g(d).gjf (generated)

012051604.b3lyp_6-31g(d).firefly.inp (generated)

012051604.b3lyp_6-31g(d).smash.inp (generated)

012051604.b3lyp_6-31g(d).nwchem.inp (generated) 012051604.b3lyp_6-31g(d).log.xz 012051604.td-b3lyp_6-31g+(d).inp 012051604.td-b3lyp_6-31g+(d).log.xz

012051604.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051604.td-b3lyp_6-31+g(d).gjf (generated)

012051604.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051604.mol 012051604.PUBCHEM 012051604.mol (via Jmol)
012051606.b3lyp_6-31g(d).inp

012051606.b3lyp_6-31g(d).qchem.inp (generated)

012051606.b3lyp_6-31g(d).gjf (generated)

012051606.b3lyp_6-31g(d).firefly.inp (generated)

012051606.b3lyp_6-31g(d).smash.inp (generated)

012051606.b3lyp_6-31g(d).nwchem.inp (generated) 012051606.b3lyp_6-31g(d).log.xz 012051606.td-b3lyp_6-31g+(d).inp 012051606.td-b3lyp_6-31g+(d).log.xz

012051606.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051606.td-b3lyp_6-31+g(d).gjf (generated)

012051606.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051606.mol 012051606.PUBCHEM 012051606.mol (via Jmol)
012051608.b3lyp_6-31g(d).inp

012051608.b3lyp_6-31g(d).qchem.inp (generated)

012051608.b3lyp_6-31g(d).gjf (generated)

012051608.b3lyp_6-31g(d).firefly.inp (generated)

012051608.b3lyp_6-31g(d).smash.inp (generated)

012051608.b3lyp_6-31g(d).nwchem.inp (generated) 012051608.b3lyp_6-31g(d).log.xz 012051608.td-b3lyp_6-31g+(d).inp 012051608.td-b3lyp_6-31g+(d).log.xz

012051608.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051608.td-b3lyp_6-31+g(d).gjf (generated)

012051608.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051608.mol 012051608.PUBCHEM 012051608.mol (via Jmol)
012051611.b3lyp_6-31g(d).inp

012051611.b3lyp_6-31g(d).qchem.inp (generated)

012051611.b3lyp_6-31g(d).gjf (generated)

012051611.b3lyp_6-31g(d).firefly.inp (generated)

012051611.b3lyp_6-31g(d).smash.inp (generated)

012051611.b3lyp_6-31g(d).nwchem.inp (generated) 012051611.b3lyp_6-31g(d).log.xz 012051611.td-b3lyp_6-31g+(d).inp 012051611.td-b3lyp_6-31g+(d).log.xz

012051611.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051611.td-b3lyp_6-31+g(d).gjf (generated)

012051611.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051611.mol 012051611.PUBCHEM 012051611.mol (via Jmol)
012051665.b3lyp_6-31g(d).inp

012051665.b3lyp_6-31g(d).qchem.inp (generated)

012051665.b3lyp_6-31g(d).gjf (generated)

012051665.b3lyp_6-31g(d).firefly.inp (generated)

012051665.b3lyp_6-31g(d).smash.inp (generated)

012051665.b3lyp_6-31g(d).nwchem.inp (generated) 012051665.b3lyp_6-31g(d).log.xz 012051665.td-b3lyp_6-31g+(d).inp 012051665.td-b3lyp_6-31g+(d).log.xz

012051665.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051665.td-b3lyp_6-31+g(d).gjf (generated)

012051665.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051665.mol 012051665.PUBCHEM 012051665.mol (via Jmol)
012051669.b3lyp_6-31g(d).inp

012051669.b3lyp_6-31g(d).qchem.inp (generated)

012051669.b3lyp_6-31g(d).gjf (generated)

012051669.b3lyp_6-31g(d).firefly.inp (generated)

012051669.b3lyp_6-31g(d).smash.inp (generated)

012051669.b3lyp_6-31g(d).nwchem.inp (generated) 012051669.b3lyp_6-31g(d).log.xz 012051669.td-b3lyp_6-31g+(d).inp 012051669.td-b3lyp_6-31g+(d).log.xz

012051669.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051669.td-b3lyp_6-31+g(d).gjf (generated)

012051669.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051669.mol 012051669.PUBCHEM 012051669.mol (via Jmol)
012051689.b3lyp_6-31g(d).inp

012051689.b3lyp_6-31g(d).qchem.inp (generated)

012051689.b3lyp_6-31g(d).gjf (generated)

012051689.b3lyp_6-31g(d).firefly.inp (generated)

012051689.b3lyp_6-31g(d).smash.inp (generated)

012051689.b3lyp_6-31g(d).nwchem.inp (generated) 012051689.b3lyp_6-31g(d).log.xz 012051689.td-b3lyp_6-31g+(d).inp 012051689.td-b3lyp_6-31g+(d).log.xz

012051689.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051689.td-b3lyp_6-31+g(d).gjf (generated)

012051689.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051689.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051689.mol 012051689.PUBCHEM 012051689.mol (via Jmol)
012051700.b3lyp_6-31g(d).inp

012051700.b3lyp_6-31g(d).qchem.inp (generated)

012051700.b3lyp_6-31g(d).gjf (generated)

012051700.b3lyp_6-31g(d).firefly.inp (generated)

012051700.b3lyp_6-31g(d).smash.inp (generated)

012051700.b3lyp_6-31g(d).nwchem.inp (generated) 012051700.b3lyp_6-31g(d).log.xz 012051700.mol 012051700.PUBCHEM 012051700.mol (via Jmol)
012051709.b3lyp_6-31g(d).inp

012051709.b3lyp_6-31g(d).qchem.inp (generated)

012051709.b3lyp_6-31g(d).gjf (generated)

012051709.b3lyp_6-31g(d).firefly.inp (generated)

012051709.b3lyp_6-31g(d).smash.inp (generated)

012051709.b3lyp_6-31g(d).nwchem.inp (generated) 012051709.b3lyp_6-31g(d).log.xz 012051709.mol 012051709.PUBCHEM 012051709.mol (via Jmol)
012051745.b3lyp_6-31g(d).inp

012051745.b3lyp_6-31g(d).qchem.inp (generated)

012051745.b3lyp_6-31g(d).gjf (generated)

012051745.b3lyp_6-31g(d).firefly.inp (generated)

012051745.b3lyp_6-31g(d).smash.inp (generated)

012051745.b3lyp_6-31g(d).nwchem.inp (generated) 012051745.b3lyp_6-31g(d).log.xz 012051745.mol 012051745.PUBCHEM 012051745.mol (via Jmol)
012051746.b3lyp_6-31g(d).inp

012051746.b3lyp_6-31g(d).qchem.inp (generated)

012051746.b3lyp_6-31g(d).gjf (generated)

012051746.b3lyp_6-31g(d).firefly.inp (generated)

012051746.b3lyp_6-31g(d).smash.inp (generated)

012051746.b3lyp_6-31g(d).nwchem.inp (generated) 012051746.b3lyp_6-31g(d).log.xz 012051746.td-b3lyp_6-31g+(d).inp 012051746.td-b3lyp_6-31g+(d).log.xz

012051746.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051746.td-b3lyp_6-31+g(d).gjf (generated)

012051746.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051746.mol 012051746.PUBCHEM 012051746.mol (via Jmol)
012051749.b3lyp_6-31g(d).inp

012051749.b3lyp_6-31g(d).qchem.inp (generated)

012051749.b3lyp_6-31g(d).gjf (generated)

012051749.b3lyp_6-31g(d).firefly.inp (generated)

012051749.b3lyp_6-31g(d).smash.inp (generated)

012051749.b3lyp_6-31g(d).nwchem.inp (generated) 012051749.b3lyp_6-31g(d).log.xz 012051749.td-b3lyp_6-31g+(d).inp 012051749.td-b3lyp_6-31g+(d).log.xz

012051749.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051749.td-b3lyp_6-31+g(d).gjf (generated)

012051749.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051749.mol 012051749.PUBCHEM 012051749.mol (via Jmol)
012051751.b3lyp_6-31g(d).inp

012051751.b3lyp_6-31g(d).qchem.inp (generated)

012051751.b3lyp_6-31g(d).gjf (generated)

012051751.b3lyp_6-31g(d).firefly.inp (generated)

012051751.b3lyp_6-31g(d).smash.inp (generated)

012051751.b3lyp_6-31g(d).nwchem.inp (generated) 012051751.b3lyp_6-31g(d).log.xz 012051751.mol 012051751.PUBCHEM 012051751.mol (via Jmol)
012051756.b3lyp_6-31g(d).inp

012051756.b3lyp_6-31g(d).qchem.inp (generated)

012051756.b3lyp_6-31g(d).gjf (generated)

012051756.b3lyp_6-31g(d).firefly.inp (generated)

012051756.b3lyp_6-31g(d).smash.inp (generated)

012051756.b3lyp_6-31g(d).nwchem.inp (generated) 012051756.b3lyp_6-31g(d).log.xz 012051756.td-b3lyp_6-31g+(d).inp 012051756.td-b3lyp_6-31g+(d).log.xz

012051756.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051756.td-b3lyp_6-31+g(d).gjf (generated)

012051756.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051756.mol 012051756.PUBCHEM 012051756.mol (via Jmol)
012051808.b3lyp_6-31g(d).inp

012051808.b3lyp_6-31g(d).qchem.inp (generated)

012051808.b3lyp_6-31g(d).gjf (generated)

012051808.b3lyp_6-31g(d).firefly.inp (generated)

012051808.b3lyp_6-31g(d).smash.inp (generated)

012051808.b3lyp_6-31g(d).nwchem.inp (generated) 012051808.b3lyp_6-31g(d).log.xz 012051808.td-b3lyp_6-31g+(d).inp 012051808.td-b3lyp_6-31g+(d).log.xz

012051808.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051808.td-b3lyp_6-31+g(d).gjf (generated)

012051808.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051808.mol 012051808.PUBCHEM 012051808.mol (via Jmol)
012051817.b3lyp_6-31g(d).inp

012051817.b3lyp_6-31g(d).qchem.inp (generated)

012051817.b3lyp_6-31g(d).gjf (generated)

012051817.b3lyp_6-31g(d).firefly.inp (generated)

012051817.b3lyp_6-31g(d).smash.inp (generated)

012051817.b3lyp_6-31g(d).nwchem.inp (generated) 012051817.b3lyp_6-31g(d).log.xz 012051817.td-b3lyp_6-31g+(d).inp 012051817.td-b3lyp_6-31g+(d).log.xz

012051817.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051817.td-b3lyp_6-31+g(d).gjf (generated)

012051817.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051817.mol 012051817.PUBCHEM 012051817.mol (via Jmol)
012051855.b3lyp_6-31g(d).inp

012051855.b3lyp_6-31g(d).qchem.inp (generated)

012051855.b3lyp_6-31g(d).gjf (generated)

012051855.b3lyp_6-31g(d).firefly.inp (generated)

012051855.b3lyp_6-31g(d).smash.inp (generated)

012051855.b3lyp_6-31g(d).nwchem.inp (generated) 012051855.b3lyp_6-31g(d).log.xz 012051855.td-b3lyp_6-31g+(d).inp 012051855.td-b3lyp_6-31g+(d).log.xz

012051855.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051855.td-b3lyp_6-31+g(d).gjf (generated)

012051855.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051855.mol 012051855.PUBCHEM 012051855.mol (via Jmol)
012051858.b3lyp_6-31g(d).inp

012051858.b3lyp_6-31g(d).qchem.inp (generated)

012051858.b3lyp_6-31g(d).gjf (generated)

012051858.b3lyp_6-31g(d).firefly.inp (generated)

012051858.b3lyp_6-31g(d).smash.inp (generated)

012051858.b3lyp_6-31g(d).nwchem.inp (generated) 012051858.b3lyp_6-31g(d).log.xz 012051858.td-b3lyp_6-31g+(d).inp 012051858.td-b3lyp_6-31g+(d).log.xz

012051858.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051858.td-b3lyp_6-31+g(d).gjf (generated)

012051858.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051858.mol 012051858.PUBCHEM 012051858.mol (via Jmol)
012051859.b3lyp_6-31g(d).inp

012051859.b3lyp_6-31g(d).qchem.inp (generated)

012051859.b3lyp_6-31g(d).gjf (generated)

012051859.b3lyp_6-31g(d).firefly.inp (generated)

012051859.b3lyp_6-31g(d).smash.inp (generated)

012051859.b3lyp_6-31g(d).nwchem.inp (generated) 012051859.b3lyp_6-31g(d).log.xz 012051859.td-b3lyp_6-31g+(d).inp 012051859.td-b3lyp_6-31g+(d).log.xz

012051859.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051859.td-b3lyp_6-31+g(d).gjf (generated)

012051859.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051859.mol 012051859.PUBCHEM 012051859.mol (via Jmol)
012051861.b3lyp_6-31g(d).inp

012051861.b3lyp_6-31g(d).qchem.inp (generated)

012051861.b3lyp_6-31g(d).gjf (generated)

012051861.b3lyp_6-31g(d).firefly.inp (generated)

012051861.b3lyp_6-31g(d).smash.inp (generated)

012051861.b3lyp_6-31g(d).nwchem.inp (generated) 012051861.b3lyp_6-31g(d).log.xz 012051861.td-b3lyp_6-31g+(d).inp 012051861.td-b3lyp_6-31g+(d).log.xz

012051861.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051861.td-b3lyp_6-31+g(d).gjf (generated)

012051861.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051861.mol 012051861.PUBCHEM 012051861.mol (via Jmol)
012051877.b3lyp_6-31g(d).inp

012051877.b3lyp_6-31g(d).qchem.inp (generated)

012051877.b3lyp_6-31g(d).gjf (generated)

012051877.b3lyp_6-31g(d).firefly.inp (generated)

012051877.b3lyp_6-31g(d).smash.inp (generated)

012051877.b3lyp_6-31g(d).nwchem.inp (generated) 012051877.b3lyp_6-31g(d).log.xz 012051877.td-b3lyp_6-31g+(d).inp 012051877.td-b3lyp_6-31g+(d).log.xz

012051877.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051877.td-b3lyp_6-31+g(d).gjf (generated)

012051877.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051877.mol 012051877.PUBCHEM 012051877.mol (via Jmol)
012051879.b3lyp_6-31g(d).inp

012051879.b3lyp_6-31g(d).qchem.inp (generated)

012051879.b3lyp_6-31g(d).gjf (generated)

012051879.b3lyp_6-31g(d).firefly.inp (generated)

012051879.b3lyp_6-31g(d).smash.inp (generated)

012051879.b3lyp_6-31g(d).nwchem.inp (generated) 012051879.b3lyp_6-31g(d).log.xz 012051879.td-b3lyp_6-31g+(d).inp 012051879.td-b3lyp_6-31g+(d).log.xz

012051879.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051879.td-b3lyp_6-31+g(d).gjf (generated)

012051879.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051879.mol 012051879.PUBCHEM 012051879.mol (via Jmol)
012051909.b3lyp_6-31g(d).inp

012051909.b3lyp_6-31g(d).qchem.inp (generated)

012051909.b3lyp_6-31g(d).gjf (generated)

012051909.b3lyp_6-31g(d).firefly.inp (generated)

012051909.b3lyp_6-31g(d).smash.inp (generated)

012051909.b3lyp_6-31g(d).nwchem.inp (generated) 012051909.b3lyp_6-31g(d).log.xz 012051909.td-b3lyp_6-31g+(d).inp 012051909.td-b3lyp_6-31g+(d).log.xz

012051909.td-b3lyp_6-31+g(d).qchem.inp (generated)

012051909.td-b3lyp_6-31+g(d).gjf (generated)

012051909.td-b3lyp_6-31+g(d).firefly.inp (generated)

012051909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012051909.mol 012051909.PUBCHEM 012051909.mol (via Jmol)
012052027.b3lyp_6-31g(d).inp

012052027.b3lyp_6-31g(d).qchem.inp (generated)

012052027.b3lyp_6-31g(d).gjf (generated)

012052027.b3lyp_6-31g(d).firefly.inp (generated)

012052027.b3lyp_6-31g(d).smash.inp (generated)

012052027.b3lyp_6-31g(d).nwchem.inp (generated) 012052027.b3lyp_6-31g(d).log.xz 012052027.td-b3lyp_6-31g+(d).inp 012052027.td-b3lyp_6-31g+(d).log.xz

012052027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052027.td-b3lyp_6-31+g(d).gjf (generated)

012052027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052027.mol 012052027.PUBCHEM 012052027.mol (via Jmol)
012052028.b3lyp_6-31g(d).inp

012052028.b3lyp_6-31g(d).qchem.inp (generated)

012052028.b3lyp_6-31g(d).gjf (generated)

012052028.b3lyp_6-31g(d).firefly.inp (generated)

012052028.b3lyp_6-31g(d).smash.inp (generated)

012052028.b3lyp_6-31g(d).nwchem.inp (generated) 012052028.b3lyp_6-31g(d).log.xz 012052028.td-b3lyp_6-31g+(d).inp 012052028.td-b3lyp_6-31g+(d).log.xz

012052028.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052028.td-b3lyp_6-31+g(d).gjf (generated)

012052028.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052028.mol 012052028.PUBCHEM 012052028.mol (via Jmol)
012052035.b3lyp_6-31g(d).inp

012052035.b3lyp_6-31g(d).qchem.inp (generated)

012052035.b3lyp_6-31g(d).gjf (generated)

012052035.b3lyp_6-31g(d).firefly.inp (generated)

012052035.b3lyp_6-31g(d).smash.inp (generated)

012052035.b3lyp_6-31g(d).nwchem.inp (generated) 012052035.b3lyp_6-31g(d).log.xz 012052035.td-b3lyp_6-31g+(d).inp 012052035.td-b3lyp_6-31g+(d).log.xz

012052035.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052035.td-b3lyp_6-31+g(d).gjf (generated)

012052035.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052035.mol 012052035.PUBCHEM 012052035.mol (via Jmol)
012052039.b3lyp_6-31g(d).inp

012052039.b3lyp_6-31g(d).qchem.inp (generated)

012052039.b3lyp_6-31g(d).gjf (generated)

012052039.b3lyp_6-31g(d).firefly.inp (generated)

012052039.b3lyp_6-31g(d).smash.inp (generated)

012052039.b3lyp_6-31g(d).nwchem.inp (generated) 012052039.b3lyp_6-31g(d).log.xz 012052039.td-b3lyp_6-31g+(d).inp 012052039.td-b3lyp_6-31g+(d).log.xz

012052039.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052039.td-b3lyp_6-31+g(d).gjf (generated)

012052039.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052039.mol 012052039.PUBCHEM 012052039.mol (via Jmol)
012052127.b3lyp_6-31g(d).inp

012052127.b3lyp_6-31g(d).qchem.inp (generated)

012052127.b3lyp_6-31g(d).gjf (generated)

012052127.b3lyp_6-31g(d).firefly.inp (generated)

012052127.b3lyp_6-31g(d).smash.inp (generated)

012052127.b3lyp_6-31g(d).nwchem.inp (generated) 012052127.b3lyp_6-31g(d).log.xz 012052127.td-b3lyp_6-31g+(d).inp 012052127.td-b3lyp_6-31g+(d).log.xz

012052127.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052127.td-b3lyp_6-31+g(d).gjf (generated)

012052127.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052127.mol 012052127.PUBCHEM 012052127.mol (via Jmol)
012052140.b3lyp_6-31g(d).inp

012052140.b3lyp_6-31g(d).qchem.inp (generated)

012052140.b3lyp_6-31g(d).gjf (generated)

012052140.b3lyp_6-31g(d).firefly.inp (generated)

012052140.b3lyp_6-31g(d).smash.inp (generated)

012052140.b3lyp_6-31g(d).nwchem.inp (generated) 012052140.b3lyp_6-31g(d).log.xz 012052140.td-b3lyp_6-31g+(d).inp 012052140.td-b3lyp_6-31g+(d).log.xz

012052140.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052140.td-b3lyp_6-31+g(d).gjf (generated)

012052140.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052140.mol 012052140.PUBCHEM 012052140.mol (via Jmol)
012052141.b3lyp_6-31g(d).inp

012052141.b3lyp_6-31g(d).qchem.inp (generated)

012052141.b3lyp_6-31g(d).gjf (generated)

012052141.b3lyp_6-31g(d).firefly.inp (generated)

012052141.b3lyp_6-31g(d).smash.inp (generated)

012052141.b3lyp_6-31g(d).nwchem.inp (generated) 012052141.b3lyp_6-31g(d).log.xz 012052141.td-b3lyp_6-31g+(d).inp 012052141.td-b3lyp_6-31g+(d).log.xz

012052141.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052141.td-b3lyp_6-31+g(d).gjf (generated)

012052141.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052141.mol 012052141.PUBCHEM 012052141.mol (via Jmol)
012052142.b3lyp_6-31g(d).inp

012052142.b3lyp_6-31g(d).qchem.inp (generated)

012052142.b3lyp_6-31g(d).gjf (generated)

012052142.b3lyp_6-31g(d).firefly.inp (generated)

012052142.b3lyp_6-31g(d).smash.inp (generated)

012052142.b3lyp_6-31g(d).nwchem.inp (generated) 012052142.b3lyp_6-31g(d).log.xz 012052142.td-b3lyp_6-31g+(d).inp 012052142.td-b3lyp_6-31g+(d).log.xz

012052142.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052142.td-b3lyp_6-31+g(d).gjf (generated)

012052142.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052142.mol 012052142.PUBCHEM 012052142.mol (via Jmol)
012052143.b3lyp_6-31g(d).inp

012052143.b3lyp_6-31g(d).qchem.inp (generated)

012052143.b3lyp_6-31g(d).gjf (generated)

012052143.b3lyp_6-31g(d).firefly.inp (generated)

012052143.b3lyp_6-31g(d).smash.inp (generated)

012052143.b3lyp_6-31g(d).nwchem.inp (generated) 012052143.b3lyp_6-31g(d).log.xz 012052143.td-b3lyp_6-31g+(d).inp 012052143.td-b3lyp_6-31g+(d).log.xz

012052143.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052143.td-b3lyp_6-31+g(d).gjf (generated)

012052143.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052143.mol 012052143.PUBCHEM 012052143.mol (via Jmol)
012052144.b3lyp_6-31g(d).inp

012052144.b3lyp_6-31g(d).qchem.inp (generated)

012052144.b3lyp_6-31g(d).gjf (generated)

012052144.b3lyp_6-31g(d).firefly.inp (generated)

012052144.b3lyp_6-31g(d).smash.inp (generated)

012052144.b3lyp_6-31g(d).nwchem.inp (generated) 012052144.b3lyp_6-31g(d).log.xz 012052144.td-b3lyp_6-31g+(d).inp 012052144.td-b3lyp_6-31g+(d).log.xz

012052144.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052144.td-b3lyp_6-31+g(d).gjf (generated)

012052144.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052144.mol 012052144.PUBCHEM 012052144.mol (via Jmol)
012052160.b3lyp_6-31g(d).inp

012052160.b3lyp_6-31g(d).qchem.inp (generated)

012052160.b3lyp_6-31g(d).gjf (generated)

012052160.b3lyp_6-31g(d).firefly.inp (generated)

012052160.b3lyp_6-31g(d).smash.inp (generated)

012052160.b3lyp_6-31g(d).nwchem.inp (generated) 012052160.b3lyp_6-31g(d).log.xz 012052160.td-b3lyp_6-31g+(d).inp 012052160.td-b3lyp_6-31g+(d).log.xz

012052160.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052160.td-b3lyp_6-31+g(d).gjf (generated)

012052160.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052160.mol 012052160.PUBCHEM 012052160.mol (via Jmol)
012052176.b3lyp_6-31g(d).inp

012052176.b3lyp_6-31g(d).qchem.inp (generated)

012052176.b3lyp_6-31g(d).gjf (generated)

012052176.b3lyp_6-31g(d).firefly.inp (generated)

012052176.b3lyp_6-31g(d).smash.inp (generated)

012052176.b3lyp_6-31g(d).nwchem.inp (generated) 012052176.b3lyp_6-31g(d).log.xz 012052176.td-b3lyp_6-31g+(d).inp 012052176.td-b3lyp_6-31g+(d).log.xz

012052176.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052176.td-b3lyp_6-31+g(d).gjf (generated)

012052176.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052176.mol 012052176.PUBCHEM 012052176.mol (via Jmol)
012052178.b3lyp_6-31g(d).inp

012052178.b3lyp_6-31g(d).qchem.inp (generated)

012052178.b3lyp_6-31g(d).gjf (generated)

012052178.b3lyp_6-31g(d).firefly.inp (generated)

012052178.b3lyp_6-31g(d).smash.inp (generated)

012052178.b3lyp_6-31g(d).nwchem.inp (generated) 012052178.b3lyp_6-31g(d).log.xz 012052178.td-b3lyp_6-31g+(d).inp 012052178.td-b3lyp_6-31g+(d).log.xz

012052178.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052178.td-b3lyp_6-31+g(d).gjf (generated)

012052178.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052178.mol 012052178.PUBCHEM 012052178.mol (via Jmol)
012052238.b3lyp_6-31g(d).inp

012052238.b3lyp_6-31g(d).qchem.inp (generated)

012052238.b3lyp_6-31g(d).gjf (generated)

012052238.b3lyp_6-31g(d).firefly.inp (generated)

012052238.b3lyp_6-31g(d).smash.inp (generated)

012052238.b3lyp_6-31g(d).nwchem.inp (generated) 012052238.b3lyp_6-31g(d).log.xz 012052238.mol 012052238.PUBCHEM 012052238.mol (via Jmol)
012052242.b3lyp_6-31g(d).inp

012052242.b3lyp_6-31g(d).qchem.inp (generated)

012052242.b3lyp_6-31g(d).gjf (generated)

012052242.b3lyp_6-31g(d).firefly.inp (generated)

012052242.b3lyp_6-31g(d).smash.inp (generated)

012052242.b3lyp_6-31g(d).nwchem.inp (generated) 012052242.b3lyp_6-31g(d).log.xz 012052242.mol 012052242.PUBCHEM 012052242.mol (via Jmol)
012052243.b3lyp_6-31g(d).inp

012052243.b3lyp_6-31g(d).qchem.inp (generated)

012052243.b3lyp_6-31g(d).gjf (generated)

012052243.b3lyp_6-31g(d).firefly.inp (generated)

012052243.b3lyp_6-31g(d).smash.inp (generated)

012052243.b3lyp_6-31g(d).nwchem.inp (generated) 012052243.b3lyp_6-31g(d).log.xz 012052243.td-b3lyp_6-31g+(d).inp 012052243.td-b3lyp_6-31g+(d).log.xz

012052243.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052243.td-b3lyp_6-31+g(d).gjf (generated)

012052243.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052243.mol 012052243.PUBCHEM 012052243.mol (via Jmol)
012052271.b3lyp_6-31g(d).inp

012052271.b3lyp_6-31g(d).qchem.inp (generated)

012052271.b3lyp_6-31g(d).gjf (generated)

012052271.b3lyp_6-31g(d).firefly.inp (generated)

012052271.b3lyp_6-31g(d).smash.inp (generated)

012052271.b3lyp_6-31g(d).nwchem.inp (generated) 012052271.b3lyp_6-31g(d).log.xz 012052271.td-b3lyp_6-31g+(d).inp 012052271.td-b3lyp_6-31g+(d).log.xz

012052271.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052271.td-b3lyp_6-31+g(d).gjf (generated)

012052271.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052271.mol 012052271.PUBCHEM 012052271.mol (via Jmol)
012052272.b3lyp_6-31g(d).inp

012052272.b3lyp_6-31g(d).qchem.inp (generated)

012052272.b3lyp_6-31g(d).gjf (generated)

012052272.b3lyp_6-31g(d).firefly.inp (generated)

012052272.b3lyp_6-31g(d).smash.inp (generated)

012052272.b3lyp_6-31g(d).nwchem.inp (generated) 012052272.b3lyp_6-31g(d).log.xz 012052272.td-b3lyp_6-31g+(d).inp 012052272.td-b3lyp_6-31g+(d).log.xz

012052272.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052272.td-b3lyp_6-31+g(d).gjf (generated)

012052272.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052272.mol 012052272.PUBCHEM 012052272.mol (via Jmol)
012052274.b3lyp_6-31g(d).inp

012052274.b3lyp_6-31g(d).qchem.inp (generated)

012052274.b3lyp_6-31g(d).gjf (generated)

012052274.b3lyp_6-31g(d).firefly.inp (generated)

012052274.b3lyp_6-31g(d).smash.inp (generated)

012052274.b3lyp_6-31g(d).nwchem.inp (generated) 012052274.b3lyp_6-31g(d).log.xz 012052274.td-b3lyp_6-31g+(d).inp 012052274.td-b3lyp_6-31g+(d).log.xz

012052274.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052274.td-b3lyp_6-31+g(d).gjf (generated)

012052274.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052274.mol 012052274.PUBCHEM 012052274.mol (via Jmol)
012052275.b3lyp_6-31g(d).inp

012052275.b3lyp_6-31g(d).qchem.inp (generated)

012052275.b3lyp_6-31g(d).gjf (generated)

012052275.b3lyp_6-31g(d).firefly.inp (generated)

012052275.b3lyp_6-31g(d).smash.inp (generated)

012052275.b3lyp_6-31g(d).nwchem.inp (generated) 012052275.b3lyp_6-31g(d).log.xz 012052275.td-b3lyp_6-31g+(d).inp 012052275.td-b3lyp_6-31g+(d).log.xz

012052275.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052275.td-b3lyp_6-31+g(d).gjf (generated)

012052275.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052275.mol 012052275.PUBCHEM 012052275.mol (via Jmol)
012052279.b3lyp_6-31g(d).inp

012052279.b3lyp_6-31g(d).qchem.inp (generated)

012052279.b3lyp_6-31g(d).gjf (generated)

012052279.b3lyp_6-31g(d).firefly.inp (generated)

012052279.b3lyp_6-31g(d).smash.inp (generated)

012052279.b3lyp_6-31g(d).nwchem.inp (generated) 012052279.b3lyp_6-31g(d).log.xz 012052279.td-b3lyp_6-31g+(d).inp 012052279.td-b3lyp_6-31g+(d).log.xz

012052279.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052279.td-b3lyp_6-31+g(d).gjf (generated)

012052279.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052279.mol 012052279.PUBCHEM 012052279.mol (via Jmol)
012052373.b3lyp_6-31g(d).inp

012052373.b3lyp_6-31g(d).qchem.inp (generated)

012052373.b3lyp_6-31g(d).gjf (generated)

012052373.b3lyp_6-31g(d).firefly.inp (generated)

012052373.b3lyp_6-31g(d).smash.inp (generated)

012052373.b3lyp_6-31g(d).nwchem.inp (generated) 012052373.b3lyp_6-31g(d).log.xz 012052373.td-b3lyp_6-31g+(d).inp 012052373.td-b3lyp_6-31g+(d).log.xz

012052373.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052373.td-b3lyp_6-31+g(d).gjf (generated)

012052373.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052373.mol 012052373.PUBCHEM 012052373.mol (via Jmol)
012052374.b3lyp_6-31g(d).inp

012052374.b3lyp_6-31g(d).qchem.inp (generated)

012052374.b3lyp_6-31g(d).gjf (generated)

012052374.b3lyp_6-31g(d).firefly.inp (generated)

012052374.b3lyp_6-31g(d).smash.inp (generated)

012052374.b3lyp_6-31g(d).nwchem.inp (generated) 012052374.b3lyp_6-31g(d).log.xz 012052374.td-b3lyp_6-31g+(d).inp 012052374.td-b3lyp_6-31g+(d).log.xz

012052374.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052374.td-b3lyp_6-31+g(d).gjf (generated)

012052374.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052374.mol 012052374.PUBCHEM 012052374.mol (via Jmol)
012052398.b3lyp_6-31g(d).inp

012052398.b3lyp_6-31g(d).qchem.inp (generated)

012052398.b3lyp_6-31g(d).gjf (generated)

012052398.b3lyp_6-31g(d).firefly.inp (generated)

012052398.b3lyp_6-31g(d).smash.inp (generated)

012052398.b3lyp_6-31g(d).nwchem.inp (generated) 012052398.b3lyp_6-31g(d).log.xz 012052398.td-b3lyp_6-31g+(d).inp 012052398.td-b3lyp_6-31g+(d).log.xz

012052398.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052398.td-b3lyp_6-31+g(d).gjf (generated)

012052398.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052398.mol 012052398.PUBCHEM 012052398.mol (via Jmol)
012052430.b3lyp_6-31g(d).inp

012052430.b3lyp_6-31g(d).qchem.inp (generated)

012052430.b3lyp_6-31g(d).gjf (generated)

012052430.b3lyp_6-31g(d).firefly.inp (generated)

012052430.b3lyp_6-31g(d).smash.inp (generated)

012052430.b3lyp_6-31g(d).nwchem.inp (generated) 012052430.b3lyp_6-31g(d).log.xz 012052430.mol 012052430.PUBCHEM 012052430.mol (via Jmol)
012052442.b3lyp_6-31g(d).inp

012052442.b3lyp_6-31g(d).qchem.inp (generated)

012052442.b3lyp_6-31g(d).gjf (generated)

012052442.b3lyp_6-31g(d).firefly.inp (generated)

012052442.b3lyp_6-31g(d).smash.inp (generated)

012052442.b3lyp_6-31g(d).nwchem.inp (generated) 012052442.b3lyp_6-31g(d).log.xz 012052442.td-b3lyp_6-31g+(d).inp 012052442.td-b3lyp_6-31g+(d).log.xz

012052442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052442.td-b3lyp_6-31+g(d).gjf (generated)

012052442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052442.mol 012052442.PUBCHEM 012052442.mol (via Jmol)
012052443.b3lyp_6-31g(d).inp

012052443.b3lyp_6-31g(d).qchem.inp (generated)

012052443.b3lyp_6-31g(d).gjf (generated)

012052443.b3lyp_6-31g(d).firefly.inp (generated)

012052443.b3lyp_6-31g(d).smash.inp (generated)

012052443.b3lyp_6-31g(d).nwchem.inp (generated) 012052443.b3lyp_6-31g(d).log.xz 012052443.td-b3lyp_6-31g+(d).inp 012052443.td-b3lyp_6-31g+(d).log.xz

012052443.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052443.td-b3lyp_6-31+g(d).gjf (generated)

012052443.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052443.mol 012052443.PUBCHEM 012052443.mol (via Jmol)
012052451.b3lyp_6-31g(d).inp

012052451.b3lyp_6-31g(d).qchem.inp (generated)

012052451.b3lyp_6-31g(d).gjf (generated)

012052451.b3lyp_6-31g(d).firefly.inp (generated)

012052451.b3lyp_6-31g(d).smash.inp (generated)

012052451.b3lyp_6-31g(d).nwchem.inp (generated) 012052451.b3lyp_6-31g(d).log.xz 012052451.td-b3lyp_6-31g+(d).inp 012052451.td-b3lyp_6-31g+(d).log.xz

012052451.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052451.td-b3lyp_6-31+g(d).gjf (generated)

012052451.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052451.mol 012052451.PUBCHEM 012052451.mol (via Jmol)
012052454.b3lyp_6-31g(d).inp

012052454.b3lyp_6-31g(d).qchem.inp (generated)

012052454.b3lyp_6-31g(d).gjf (generated)

012052454.b3lyp_6-31g(d).firefly.inp (generated)

012052454.b3lyp_6-31g(d).smash.inp (generated)

012052454.b3lyp_6-31g(d).nwchem.inp (generated) 012052454.b3lyp_6-31g(d).log.xz 012052454.td-b3lyp_6-31g+(d).inp 012052454.td-b3lyp_6-31g+(d).log.xz

012052454.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052454.td-b3lyp_6-31+g(d).gjf (generated)

012052454.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052454.mol 012052454.PUBCHEM 012052454.mol (via Jmol)
012052548.b3lyp_6-31g(d).inp

012052548.b3lyp_6-31g(d).qchem.inp (generated)

012052548.b3lyp_6-31g(d).gjf (generated)

012052548.b3lyp_6-31g(d).firefly.inp (generated)

012052548.b3lyp_6-31g(d).smash.inp (generated)

012052548.b3lyp_6-31g(d).nwchem.inp (generated) 012052548.b3lyp_6-31g(d).log.xz 012052548.td-b3lyp_6-31g+(d).inp 012052548.td-b3lyp_6-31g+(d).log.xz

012052548.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052548.td-b3lyp_6-31+g(d).gjf (generated)

012052548.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052548.mol 012052548.PUBCHEM 012052548.mol (via Jmol)
012052553.b3lyp_6-31g(d).inp

012052553.b3lyp_6-31g(d).qchem.inp (generated)

012052553.b3lyp_6-31g(d).gjf (generated)

012052553.b3lyp_6-31g(d).firefly.inp (generated)

012052553.b3lyp_6-31g(d).smash.inp (generated)

012052553.b3lyp_6-31g(d).nwchem.inp (generated) 012052553.b3lyp_6-31g(d).log.xz 012052553.td-b3lyp_6-31g+(d).inp 012052553.td-b3lyp_6-31g+(d).log.xz

012052553.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052553.td-b3lyp_6-31+g(d).gjf (generated)

012052553.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052553.mol 012052553.PUBCHEM 012052553.mol (via Jmol)
012052554.b3lyp_6-31g(d).inp

012052554.b3lyp_6-31g(d).qchem.inp (generated)

012052554.b3lyp_6-31g(d).gjf (generated)

012052554.b3lyp_6-31g(d).firefly.inp (generated)

012052554.b3lyp_6-31g(d).smash.inp (generated)

012052554.b3lyp_6-31g(d).nwchem.inp (generated) 012052554.b3lyp_6-31g(d).log.xz 012052554.td-b3lyp_6-31g+(d).inp 012052554.td-b3lyp_6-31g+(d).log.xz

012052554.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052554.td-b3lyp_6-31+g(d).gjf (generated)

012052554.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052554.mol 012052554.PUBCHEM 012052554.mol (via Jmol)
012052557.b3lyp_6-31g(d).inp

012052557.b3lyp_6-31g(d).qchem.inp (generated)

012052557.b3lyp_6-31g(d).gjf (generated)

012052557.b3lyp_6-31g(d).firefly.inp (generated)

012052557.b3lyp_6-31g(d).smash.inp (generated)

012052557.b3lyp_6-31g(d).nwchem.inp (generated) 012052557.b3lyp_6-31g(d).log.xz 012052557.mol 012052557.PUBCHEM 012052557.mol (via Jmol)
012052584.b3lyp_6-31g(d).inp

012052584.b3lyp_6-31g(d).qchem.inp (generated)

012052584.b3lyp_6-31g(d).gjf (generated)

012052584.b3lyp_6-31g(d).firefly.inp (generated)

012052584.b3lyp_6-31g(d).smash.inp (generated)

012052584.b3lyp_6-31g(d).nwchem.inp (generated) 012052584.b3lyp_6-31g(d).log.xz 012052584.td-b3lyp_6-31g+(d).inp 012052584.td-b3lyp_6-31g+(d).log.xz

012052584.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052584.td-b3lyp_6-31+g(d).gjf (generated)

012052584.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052584.mol 012052584.PUBCHEM 012052584.mol (via Jmol)
012052630.b3lyp_6-31g(d).inp

012052630.b3lyp_6-31g(d).qchem.inp (generated)

012052630.b3lyp_6-31g(d).gjf (generated)

012052630.b3lyp_6-31g(d).firefly.inp (generated)

012052630.b3lyp_6-31g(d).smash.inp (generated)

012052630.b3lyp_6-31g(d).nwchem.inp (generated) 012052630.b3lyp_6-31g(d).log.xz 012052630.mol 012052630.PUBCHEM 012052630.mol (via Jmol)
012052711.b3lyp_6-31g(d).inp

012052711.b3lyp_6-31g(d).qchem.inp (generated)

012052711.b3lyp_6-31g(d).gjf (generated)

012052711.b3lyp_6-31g(d).firefly.inp (generated)

012052711.b3lyp_6-31g(d).smash.inp (generated)

012052711.b3lyp_6-31g(d).nwchem.inp (generated) 012052711.b3lyp_6-31g(d).log.xz 012052711.td-b3lyp_6-31g+(d).inp 012052711.td-b3lyp_6-31g+(d).log.xz

012052711.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052711.td-b3lyp_6-31+g(d).gjf (generated)

012052711.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052711.mol 012052711.PUBCHEM 012052711.mol (via Jmol)
012052714.b3lyp_6-31g(d).inp

012052714.b3lyp_6-31g(d).qchem.inp (generated)

012052714.b3lyp_6-31g(d).gjf (generated)

012052714.b3lyp_6-31g(d).firefly.inp (generated)

012052714.b3lyp_6-31g(d).smash.inp (generated)

012052714.b3lyp_6-31g(d).nwchem.inp (generated) 012052714.b3lyp_6-31g(d).log.xz 012052714.td-b3lyp_6-31g+(d).inp 012052714.td-b3lyp_6-31g+(d).log.xz

012052714.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052714.td-b3lyp_6-31+g(d).gjf (generated)

012052714.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052714.mol 012052714.PUBCHEM 012052714.mol (via Jmol)
012052720.b3lyp_6-31g(d).inp

012052720.b3lyp_6-31g(d).qchem.inp (generated)

012052720.b3lyp_6-31g(d).gjf (generated)

012052720.b3lyp_6-31g(d).firefly.inp (generated)

012052720.b3lyp_6-31g(d).smash.inp (generated)

012052720.b3lyp_6-31g(d).nwchem.inp (generated) 012052720.b3lyp_6-31g(d).log.xz 012052720.td-b3lyp_6-31g+(d).inp 012052720.td-b3lyp_6-31g+(d).log.xz

012052720.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052720.td-b3lyp_6-31+g(d).gjf (generated)

012052720.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052720.mol 012052720.PUBCHEM 012052720.mol (via Jmol)
012052723.b3lyp_6-31g(d).inp

012052723.b3lyp_6-31g(d).qchem.inp (generated)

012052723.b3lyp_6-31g(d).gjf (generated)

012052723.b3lyp_6-31g(d).firefly.inp (generated)

012052723.b3lyp_6-31g(d).smash.inp (generated)

012052723.b3lyp_6-31g(d).nwchem.inp (generated) 012052723.b3lyp_6-31g(d).log.xz 012052723.td-b3lyp_6-31g+(d).inp 012052723.td-b3lyp_6-31g+(d).log.xz

012052723.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052723.td-b3lyp_6-31+g(d).gjf (generated)

012052723.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052723.mol 012052723.PUBCHEM 012052723.mol (via Jmol)
012052728.b3lyp_6-31g(d).inp

012052728.b3lyp_6-31g(d).qchem.inp (generated)

012052728.b3lyp_6-31g(d).gjf (generated)

012052728.b3lyp_6-31g(d).firefly.inp (generated)

012052728.b3lyp_6-31g(d).smash.inp (generated)

012052728.b3lyp_6-31g(d).nwchem.inp (generated) 012052728.b3lyp_6-31g(d).log.xz 012052728.td-b3lyp_6-31g+(d).inp 012052728.td-b3lyp_6-31g+(d).log.xz

012052728.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052728.td-b3lyp_6-31+g(d).gjf (generated)

012052728.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052728.mol 012052728.PUBCHEM 012052728.mol (via Jmol)
012052796.b3lyp_6-31g(d).inp

012052796.b3lyp_6-31g(d).qchem.inp (generated)

012052796.b3lyp_6-31g(d).gjf (generated)

012052796.b3lyp_6-31g(d).firefly.inp (generated)

012052796.b3lyp_6-31g(d).smash.inp (generated)

012052796.b3lyp_6-31g(d).nwchem.inp (generated) 012052796.b3lyp_6-31g(d).log.xz 012052796.td-b3lyp_6-31g+(d).inp 012052796.td-b3lyp_6-31g+(d).log.xz

012052796.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052796.td-b3lyp_6-31+g(d).gjf (generated)

012052796.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052796.mol 012052796.PUBCHEM 012052796.mol (via Jmol)
012052826.b3lyp_6-31g(d).inp

012052826.b3lyp_6-31g(d).qchem.inp (generated)

012052826.b3lyp_6-31g(d).gjf (generated)

012052826.b3lyp_6-31g(d).firefly.inp (generated)

012052826.b3lyp_6-31g(d).smash.inp (generated)

012052826.b3lyp_6-31g(d).nwchem.inp (generated) 012052826.b3lyp_6-31g(d).log.xz 012052826.td-b3lyp_6-31g+(d).inp 012052826.td-b3lyp_6-31g+(d).log.xz

012052826.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052826.td-b3lyp_6-31+g(d).gjf (generated)

012052826.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052826.mol 012052826.PUBCHEM 012052826.mol (via Jmol)
012052828.b3lyp_6-31g(d).inp

012052828.b3lyp_6-31g(d).qchem.inp (generated)

012052828.b3lyp_6-31g(d).gjf (generated)

012052828.b3lyp_6-31g(d).firefly.inp (generated)

012052828.b3lyp_6-31g(d).smash.inp (generated)

012052828.b3lyp_6-31g(d).nwchem.inp (generated) 012052828.b3lyp_6-31g(d).log.xz 012052828.td-b3lyp_6-31g+(d).inp 012052828.td-b3lyp_6-31g+(d).log.xz

012052828.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052828.td-b3lyp_6-31+g(d).gjf (generated)

012052828.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052828.mol 012052828.PUBCHEM 012052828.mol (via Jmol)
012052831.b3lyp_6-31g(d).inp

012052831.b3lyp_6-31g(d).qchem.inp (generated)

012052831.b3lyp_6-31g(d).gjf (generated)

012052831.b3lyp_6-31g(d).firefly.inp (generated)

012052831.b3lyp_6-31g(d).smash.inp (generated)

012052831.b3lyp_6-31g(d).nwchem.inp (generated) 012052831.b3lyp_6-31g(d).log.xz 012052831.td-b3lyp_6-31g+(d).inp 012052831.td-b3lyp_6-31g+(d).log.xz

012052831.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052831.td-b3lyp_6-31+g(d).gjf (generated)

012052831.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052831.mol 012052831.PUBCHEM 012052831.mol (via Jmol)
012052988.b3lyp_6-31g(d).inp

012052988.b3lyp_6-31g(d).qchem.inp (generated)

012052988.b3lyp_6-31g(d).gjf (generated)

012052988.b3lyp_6-31g(d).firefly.inp (generated)

012052988.b3lyp_6-31g(d).smash.inp (generated)

012052988.b3lyp_6-31g(d).nwchem.inp (generated) 012052988.b3lyp_6-31g(d).log.xz 012052988.td-b3lyp_6-31g+(d).inp 012052988.td-b3lyp_6-31g+(d).log.xz

012052988.td-b3lyp_6-31+g(d).qchem.inp (generated)

012052988.td-b3lyp_6-31+g(d).gjf (generated)

012052988.td-b3lyp_6-31+g(d).firefly.inp (generated)

012052988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012052988.mol 012052988.PUBCHEM 012052988.mol (via Jmol)
012053074.b3lyp_6-31g(d).inp

012053074.b3lyp_6-31g(d).qchem.inp (generated)

012053074.b3lyp_6-31g(d).gjf (generated)

012053074.b3lyp_6-31g(d).firefly.inp (generated)

012053074.b3lyp_6-31g(d).smash.inp (generated)

012053074.b3lyp_6-31g(d).nwchem.inp (generated) 012053074.b3lyp_6-31g(d).log.xz 012053074.td-b3lyp_6-31g+(d).inp 012053074.td-b3lyp_6-31g+(d).log.xz

012053074.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053074.td-b3lyp_6-31+g(d).gjf (generated)

012053074.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053074.mol 012053074.PUBCHEM 012053074.mol (via Jmol)
012053077.b3lyp_6-31g(d).inp

012053077.b3lyp_6-31g(d).qchem.inp (generated)

012053077.b3lyp_6-31g(d).gjf (generated)

012053077.b3lyp_6-31g(d).firefly.inp (generated)

012053077.b3lyp_6-31g(d).smash.inp (generated)

012053077.b3lyp_6-31g(d).nwchem.inp (generated) 012053077.b3lyp_6-31g(d).log.xz 012053077.td-b3lyp_6-31g+(d).inp 012053077.td-b3lyp_6-31g+(d).log.xz

012053077.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053077.td-b3lyp_6-31+g(d).gjf (generated)

012053077.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053077.mol 012053077.PUBCHEM 012053077.mol (via Jmol)
012053133.b3lyp_6-31g(d).inp

012053133.b3lyp_6-31g(d).qchem.inp (generated)

012053133.b3lyp_6-31g(d).gjf (generated)

012053133.b3lyp_6-31g(d).firefly.inp (generated)

012053133.b3lyp_6-31g(d).smash.inp (generated)

012053133.b3lyp_6-31g(d).nwchem.inp (generated) 012053133.b3lyp_6-31g(d).log.xz 012053133.mol 012053133.PUBCHEM 012053133.mol (via Jmol)
012053198.b3lyp_6-31g(d).inp

012053198.b3lyp_6-31g(d).qchem.inp (generated)

012053198.b3lyp_6-31g(d).gjf (generated)

012053198.b3lyp_6-31g(d).firefly.inp (generated)

012053198.b3lyp_6-31g(d).smash.inp (generated)

012053198.b3lyp_6-31g(d).nwchem.inp (generated) 012053198.b3lyp_6-31g(d).log.xz 012053198.td-b3lyp_6-31g+(d).inp 012053198.td-b3lyp_6-31g+(d).log.xz

012053198.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053198.td-b3lyp_6-31+g(d).gjf (generated)

012053198.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053198.mol 012053198.PUBCHEM 012053198.mol (via Jmol)
012053213.b3lyp_6-31g(d).inp

012053213.b3lyp_6-31g(d).qchem.inp (generated)

012053213.b3lyp_6-31g(d).gjf (generated)

012053213.b3lyp_6-31g(d).firefly.inp (generated)

012053213.b3lyp_6-31g(d).smash.inp (generated)

012053213.b3lyp_6-31g(d).nwchem.inp (generated) 012053213.b3lyp_6-31g(d).log.xz 012053213.td-b3lyp_6-31g+(d).inp 012053213.td-b3lyp_6-31g+(d).log.xz

012053213.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053213.td-b3lyp_6-31+g(d).gjf (generated)

012053213.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053213.mol 012053213.PUBCHEM 012053213.mol (via Jmol)
012053263.b3lyp_6-31g(d).inp

012053263.b3lyp_6-31g(d).qchem.inp (generated)

012053263.b3lyp_6-31g(d).gjf (generated)

012053263.b3lyp_6-31g(d).firefly.inp (generated)

012053263.b3lyp_6-31g(d).smash.inp (generated)

012053263.b3lyp_6-31g(d).nwchem.inp (generated) 012053263.b3lyp_6-31g(d).log.xz 012053263.td-b3lyp_6-31g+(d).inp 012053263.td-b3lyp_6-31g+(d).log.xz

012053263.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053263.td-b3lyp_6-31+g(d).gjf (generated)

012053263.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053263.mol 012053263.PUBCHEM 012053263.mol (via Jmol)
012053311.b3lyp_6-31g(d).inp

012053311.b3lyp_6-31g(d).qchem.inp (generated)

012053311.b3lyp_6-31g(d).gjf (generated)

012053311.b3lyp_6-31g(d).firefly.inp (generated)

012053311.b3lyp_6-31g(d).smash.inp (generated)

012053311.b3lyp_6-31g(d).nwchem.inp (generated) 012053311.b3lyp_6-31g(d).log.xz 012053311.td-b3lyp_6-31g+(d).inp 012053311.td-b3lyp_6-31g+(d).log.xz

012053311.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053311.td-b3lyp_6-31+g(d).gjf (generated)

012053311.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053311.mol 012053311.PUBCHEM 012053311.mol (via Jmol)
012053320.b3lyp_6-31g(d).inp

012053320.b3lyp_6-31g(d).qchem.inp (generated)

012053320.b3lyp_6-31g(d).gjf (generated)

012053320.b3lyp_6-31g(d).firefly.inp (generated)

012053320.b3lyp_6-31g(d).smash.inp (generated)

012053320.b3lyp_6-31g(d).nwchem.inp (generated) 012053320.b3lyp_6-31g(d).log.xz 012053320.td-b3lyp_6-31g+(d).inp 012053320.td-b3lyp_6-31g+(d).log.xz

012053320.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053320.td-b3lyp_6-31+g(d).gjf (generated)

012053320.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053320.mol 012053320.PUBCHEM 012053320.mol (via Jmol)
012053512.b3lyp_6-31g(d).inp

012053512.b3lyp_6-31g(d).qchem.inp (generated)

012053512.b3lyp_6-31g(d).gjf (generated)

012053512.b3lyp_6-31g(d).firefly.inp (generated)

012053512.b3lyp_6-31g(d).smash.inp (generated)

012053512.b3lyp_6-31g(d).nwchem.inp (generated) 012053512.b3lyp_6-31g(d).log.xz 012053512.td-b3lyp_6-31g+(d).inp 012053512.td-b3lyp_6-31g+(d).log.xz

012053512.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053512.td-b3lyp_6-31+g(d).gjf (generated)

012053512.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053512.mol 012053512.PUBCHEM 012053512.mol (via Jmol)
012053542.b3lyp_6-31g(d).inp

012053542.b3lyp_6-31g(d).qchem.inp (generated)

012053542.b3lyp_6-31g(d).gjf (generated)

012053542.b3lyp_6-31g(d).firefly.inp (generated)

012053542.b3lyp_6-31g(d).smash.inp (generated)

012053542.b3lyp_6-31g(d).nwchem.inp (generated) 012053542.b3lyp_6-31g(d).log.xz 012053542.td-b3lyp_6-31g+(d).inp 012053542.td-b3lyp_6-31g+(d).log.xz

012053542.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053542.td-b3lyp_6-31+g(d).gjf (generated)

012053542.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053542.mol 012053542.PUBCHEM 012053542.mol (via Jmol)
012053631.b3lyp_6-31g(d).inp

012053631.b3lyp_6-31g(d).qchem.inp (generated)

012053631.b3lyp_6-31g(d).gjf (generated)

012053631.b3lyp_6-31g(d).firefly.inp (generated)

012053631.b3lyp_6-31g(d).smash.inp (generated)

012053631.b3lyp_6-31g(d).nwchem.inp (generated) 012053631.b3lyp_6-31g(d).log.xz 012053631.td-b3lyp_6-31g+(d).inp 012053631.td-b3lyp_6-31g+(d).log.xz

012053631.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053631.td-b3lyp_6-31+g(d).gjf (generated)

012053631.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053631.mol 012053631.PUBCHEM 012053631.mol (via Jmol)
012053639.b3lyp_6-31g(d).inp

012053639.b3lyp_6-31g(d).qchem.inp (generated)

012053639.b3lyp_6-31g(d).gjf (generated)

012053639.b3lyp_6-31g(d).firefly.inp (generated)

012053639.b3lyp_6-31g(d).smash.inp (generated)

012053639.b3lyp_6-31g(d).nwchem.inp (generated) 012053639.b3lyp_6-31g(d).log.xz 012053639.td-b3lyp_6-31g+(d).inp 012053639.td-b3lyp_6-31g+(d).log.xz

012053639.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053639.td-b3lyp_6-31+g(d).gjf (generated)

012053639.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053639.mol 012053639.PUBCHEM 012053639.mol (via Jmol)
012053644.b3lyp_6-31g(d).inp

012053644.b3lyp_6-31g(d).qchem.inp (generated)

012053644.b3lyp_6-31g(d).gjf (generated)

012053644.b3lyp_6-31g(d).firefly.inp (generated)

012053644.b3lyp_6-31g(d).smash.inp (generated)

012053644.b3lyp_6-31g(d).nwchem.inp (generated) 012053644.b3lyp_6-31g(d).log.xz 012053644.td-b3lyp_6-31g+(d).inp 012053644.td-b3lyp_6-31g+(d).log.xz

012053644.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053644.td-b3lyp_6-31+g(d).gjf (generated)

012053644.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053644.mol 012053644.PUBCHEM 012053644.mol (via Jmol)
012053677.b3lyp_6-31g(d).inp

012053677.b3lyp_6-31g(d).qchem.inp (generated)

012053677.b3lyp_6-31g(d).gjf (generated)

012053677.b3lyp_6-31g(d).firefly.inp (generated)

012053677.b3lyp_6-31g(d).smash.inp (generated)

012053677.b3lyp_6-31g(d).nwchem.inp (generated) 012053677.b3lyp_6-31g(d).log.xz 012053677.td-b3lyp_6-31g+(d).inp 012053677.td-b3lyp_6-31g+(d).log.xz

012053677.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053677.td-b3lyp_6-31+g(d).gjf (generated)

012053677.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053677.mol 012053677.PUBCHEM 012053677.mol (via Jmol)
012053733.b3lyp_6-31g(d).inp

012053733.b3lyp_6-31g(d).qchem.inp (generated)

012053733.b3lyp_6-31g(d).gjf (generated)

012053733.b3lyp_6-31g(d).firefly.inp (generated)

012053733.b3lyp_6-31g(d).smash.inp (generated)

012053733.b3lyp_6-31g(d).nwchem.inp (generated) 012053733.b3lyp_6-31g(d).log.xz 012053733.td-b3lyp_6-31g+(d).inp 012053733.td-b3lyp_6-31g+(d).log.xz

012053733.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053733.td-b3lyp_6-31+g(d).gjf (generated)

012053733.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053733.mol 012053733.PUBCHEM 012053733.mol (via Jmol)
012053744.b3lyp_6-31g(d).inp

012053744.b3lyp_6-31g(d).qchem.inp (generated)

012053744.b3lyp_6-31g(d).gjf (generated)

012053744.b3lyp_6-31g(d).firefly.inp (generated)

012053744.b3lyp_6-31g(d).smash.inp (generated)

012053744.b3lyp_6-31g(d).nwchem.inp (generated) 012053744.b3lyp_6-31g(d).log.xz 012053744.td-b3lyp_6-31g+(d).inp 012053744.td-b3lyp_6-31g+(d).log.xz

012053744.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053744.td-b3lyp_6-31+g(d).gjf (generated)

012053744.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053744.mol 012053744.PUBCHEM 012053744.mol (via Jmol)
012053759.b3lyp_6-31g(d).inp

012053759.b3lyp_6-31g(d).qchem.inp (generated)

012053759.b3lyp_6-31g(d).gjf (generated)

012053759.b3lyp_6-31g(d).firefly.inp (generated)

012053759.b3lyp_6-31g(d).smash.inp (generated)

012053759.b3lyp_6-31g(d).nwchem.inp (generated) 012053759.b3lyp_6-31g(d).log.xz 012053759.td-b3lyp_6-31g+(d).inp 012053759.td-b3lyp_6-31g+(d).log.xz

012053759.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053759.td-b3lyp_6-31+g(d).gjf (generated)

012053759.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053759.mol 012053759.PUBCHEM 012053759.mol (via Jmol)
012053836.b3lyp_6-31g(d).inp

012053836.b3lyp_6-31g(d).qchem.inp (generated)

012053836.b3lyp_6-31g(d).gjf (generated)

012053836.b3lyp_6-31g(d).firefly.inp (generated)

012053836.b3lyp_6-31g(d).smash.inp (generated)

012053836.b3lyp_6-31g(d).nwchem.inp (generated) 012053836.b3lyp_6-31g(d).log.xz 012053836.td-b3lyp_6-31g+(d).inp 012053836.td-b3lyp_6-31g+(d).log.xz

012053836.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053836.td-b3lyp_6-31+g(d).gjf (generated)

012053836.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053836.mol 012053836.PUBCHEM 012053836.mol (via Jmol)
012053837.b3lyp_6-31g(d).inp

012053837.b3lyp_6-31g(d).qchem.inp (generated)

012053837.b3lyp_6-31g(d).gjf (generated)

012053837.b3lyp_6-31g(d).firefly.inp (generated)

012053837.b3lyp_6-31g(d).smash.inp (generated)

012053837.b3lyp_6-31g(d).nwchem.inp (generated) 012053837.b3lyp_6-31g(d).log.xz 012053837.td-b3lyp_6-31g+(d).inp 012053837.td-b3lyp_6-31g+(d).log.xz

012053837.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053837.td-b3lyp_6-31+g(d).gjf (generated)

012053837.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053837.mol 012053837.PUBCHEM 012053837.mol (via Jmol)
012053840.b3lyp_6-31g(d).inp

012053840.b3lyp_6-31g(d).qchem.inp (generated)

012053840.b3lyp_6-31g(d).gjf (generated)

012053840.b3lyp_6-31g(d).firefly.inp (generated)

012053840.b3lyp_6-31g(d).smash.inp (generated)

012053840.b3lyp_6-31g(d).nwchem.inp (generated) 012053840.b3lyp_6-31g(d).log.xz 012053840.td-b3lyp_6-31g+(d).inp 012053840.td-b3lyp_6-31g+(d).log.xz

012053840.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053840.td-b3lyp_6-31+g(d).gjf (generated)

012053840.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053840.mol 012053840.PUBCHEM 012053840.mol (via Jmol)
012053841.b3lyp_6-31g(d).inp

012053841.b3lyp_6-31g(d).qchem.inp (generated)

012053841.b3lyp_6-31g(d).gjf (generated)

012053841.b3lyp_6-31g(d).firefly.inp (generated)

012053841.b3lyp_6-31g(d).smash.inp (generated)

012053841.b3lyp_6-31g(d).nwchem.inp (generated) 012053841.b3lyp_6-31g(d).log.xz 012053841.td-b3lyp_6-31g+(d).inp 012053841.td-b3lyp_6-31g+(d).log.xz

012053841.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053841.td-b3lyp_6-31+g(d).gjf (generated)

012053841.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053841.mol 012053841.PUBCHEM 012053841.mol (via Jmol)
012053968.b3lyp_6-31g(d).inp

012053968.b3lyp_6-31g(d).qchem.inp (generated)

012053968.b3lyp_6-31g(d).gjf (generated)

012053968.b3lyp_6-31g(d).firefly.inp (generated)

012053968.b3lyp_6-31g(d).smash.inp (generated)

012053968.b3lyp_6-31g(d).nwchem.inp (generated) 012053968.b3lyp_6-31g(d).log.xz 012053968.td-b3lyp_6-31g+(d).inp 012053968.td-b3lyp_6-31g+(d).log.xz

012053968.td-b3lyp_6-31+g(d).qchem.inp (generated)

012053968.td-b3lyp_6-31+g(d).gjf (generated)

012053968.td-b3lyp_6-31+g(d).firefly.inp (generated)

012053968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012053968.mol 012053968.PUBCHEM 012053968.mol (via Jmol)
012053975.b3lyp_6-31g(d).inp

012053975.b3lyp_6-31g(d).qchem.inp (generated)

012053975.b3lyp_6-31g(d).gjf (generated)

012053975.b3lyp_6-31g(d).firefly.inp (generated)

012053975.b3lyp_6-31g(d).smash.inp (generated)

012053975.b3lyp_6-31g(d).nwchem.inp (generated) 012053975.b3lyp_6-31g(d).log.xz 012053975.mol 012053975.PUBCHEM 012053975.mol (via Jmol)
012054035.b3lyp_6-31g(d).inp

012054035.b3lyp_6-31g(d).qchem.inp (generated)

012054035.b3lyp_6-31g(d).gjf (generated)

012054035.b3lyp_6-31g(d).firefly.inp (generated)

012054035.b3lyp_6-31g(d).smash.inp (generated)

012054035.b3lyp_6-31g(d).nwchem.inp (generated) 012054035.b3lyp_6-31g(d).log.xz 012054035.td-b3lyp_6-31g+(d).inp 012054035.td-b3lyp_6-31g+(d).log.xz

012054035.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054035.td-b3lyp_6-31+g(d).gjf (generated)

012054035.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054035.mol 012054035.PUBCHEM 012054035.mol (via Jmol)
012054167.b3lyp_6-31g(d).inp

012054167.b3lyp_6-31g(d).qchem.inp (generated)

012054167.b3lyp_6-31g(d).gjf (generated)

012054167.b3lyp_6-31g(d).firefly.inp (generated)

012054167.b3lyp_6-31g(d).smash.inp (generated)

012054167.b3lyp_6-31g(d).nwchem.inp (generated) 012054167.b3lyp_6-31g(d).log.xz 012054167.mol 012054167.PUBCHEM 012054167.mol (via Jmol)
012054216.b3lyp_6-31g(d).inp

012054216.b3lyp_6-31g(d).qchem.inp (generated)

012054216.b3lyp_6-31g(d).gjf (generated)

012054216.b3lyp_6-31g(d).firefly.inp (generated)

012054216.b3lyp_6-31g(d).smash.inp (generated)

012054216.b3lyp_6-31g(d).nwchem.inp (generated) 012054216.b3lyp_6-31g(d).log.xz 012054216.td-b3lyp_6-31g+(d).inp 012054216.td-b3lyp_6-31g+(d).log.xz

012054216.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054216.td-b3lyp_6-31+g(d).gjf (generated)

012054216.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054216.mol 012054216.PUBCHEM 012054216.mol (via Jmol)
012054301.b3lyp_6-31g(d).inp

012054301.b3lyp_6-31g(d).qchem.inp (generated)

012054301.b3lyp_6-31g(d).gjf (generated)

012054301.b3lyp_6-31g(d).firefly.inp (generated)

012054301.b3lyp_6-31g(d).smash.inp (generated)

012054301.b3lyp_6-31g(d).nwchem.inp (generated) 012054301.b3lyp_6-31g(d).log.xz 012054301.td-b3lyp_6-31g+(d).inp 012054301.td-b3lyp_6-31g+(d).log.xz

012054301.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054301.td-b3lyp_6-31+g(d).gjf (generated)

012054301.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054301.mol 012054301.PUBCHEM 012054301.mol (via Jmol)
012054302.b3lyp_6-31g(d).inp

012054302.b3lyp_6-31g(d).qchem.inp (generated)

012054302.b3lyp_6-31g(d).gjf (generated)

012054302.b3lyp_6-31g(d).firefly.inp (generated)

012054302.b3lyp_6-31g(d).smash.inp (generated)

012054302.b3lyp_6-31g(d).nwchem.inp (generated) 012054302.b3lyp_6-31g(d).log.xz 012054302.td-b3lyp_6-31g+(d).inp 012054302.td-b3lyp_6-31g+(d).log.xz

012054302.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054302.td-b3lyp_6-31+g(d).gjf (generated)

012054302.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054302.mol 012054302.PUBCHEM 012054302.mol (via Jmol)
012054364.b3lyp_6-31g(d).inp

012054364.b3lyp_6-31g(d).qchem.inp (generated)

012054364.b3lyp_6-31g(d).gjf (generated)

012054364.b3lyp_6-31g(d).firefly.inp (generated)

012054364.b3lyp_6-31g(d).smash.inp (generated)

012054364.b3lyp_6-31g(d).nwchem.inp (generated) 012054364.b3lyp_6-31g(d).log.xz 012054364.td-b3lyp_6-31g+(d).inp 012054364.td-b3lyp_6-31g+(d).log.xz

012054364.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054364.td-b3lyp_6-31+g(d).gjf (generated)

012054364.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054364.mol 012054364.PUBCHEM 012054364.mol (via Jmol)
012054377.b3lyp_6-31g(d).inp

012054377.b3lyp_6-31g(d).qchem.inp (generated)

012054377.b3lyp_6-31g(d).gjf (generated)

012054377.b3lyp_6-31g(d).firefly.inp (generated)

012054377.b3lyp_6-31g(d).smash.inp (generated)

012054377.b3lyp_6-31g(d).nwchem.inp (generated) 012054377.b3lyp_6-31g(d).log.xz 012054377.mol 012054377.PUBCHEM 012054377.mol (via Jmol)
012054386.b3lyp_6-31g(d).inp

012054386.b3lyp_6-31g(d).qchem.inp (generated)

012054386.b3lyp_6-31g(d).gjf (generated)

012054386.b3lyp_6-31g(d).firefly.inp (generated)

012054386.b3lyp_6-31g(d).smash.inp (generated)

012054386.b3lyp_6-31g(d).nwchem.inp (generated) 012054386.b3lyp_6-31g(d).log.xz 012054386.td-b3lyp_6-31g+(d).inp 012054386.td-b3lyp_6-31g+(d).log.xz

012054386.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054386.td-b3lyp_6-31+g(d).gjf (generated)

012054386.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054386.mol 012054386.PUBCHEM 012054386.mol (via Jmol)
012054490.b3lyp_6-31g(d).inp

012054490.b3lyp_6-31g(d).qchem.inp (generated)

012054490.b3lyp_6-31g(d).gjf (generated)

012054490.b3lyp_6-31g(d).firefly.inp (generated)

012054490.b3lyp_6-31g(d).smash.inp (generated)

012054490.b3lyp_6-31g(d).nwchem.inp (generated) 012054490.b3lyp_6-31g(d).log.xz 012054490.td-b3lyp_6-31g+(d).inp 012054490.td-b3lyp_6-31g+(d).log.xz

012054490.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054490.td-b3lyp_6-31+g(d).gjf (generated)

012054490.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054490.mol 012054490.PUBCHEM 012054490.mol (via Jmol)
012054512.b3lyp_6-31g(d).inp

012054512.b3lyp_6-31g(d).qchem.inp (generated)

012054512.b3lyp_6-31g(d).gjf (generated)

012054512.b3lyp_6-31g(d).firefly.inp (generated)

012054512.b3lyp_6-31g(d).smash.inp (generated)

012054512.b3lyp_6-31g(d).nwchem.inp (generated) 012054512.b3lyp_6-31g(d).log.xz 012054512.mol 012054512.PUBCHEM 012054512.mol (via Jmol)
012054513.b3lyp_6-31g(d).inp

012054513.b3lyp_6-31g(d).qchem.inp (generated)

012054513.b3lyp_6-31g(d).gjf (generated)

012054513.b3lyp_6-31g(d).firefly.inp (generated)

012054513.b3lyp_6-31g(d).smash.inp (generated)

012054513.b3lyp_6-31g(d).nwchem.inp (generated) 012054513.b3lyp_6-31g(d).log.xz 012054513.mol 012054513.PUBCHEM 012054513.mol (via Jmol)
012054524.b3lyp_6-31g(d).inp

012054524.b3lyp_6-31g(d).qchem.inp (generated)

012054524.b3lyp_6-31g(d).gjf (generated)

012054524.b3lyp_6-31g(d).firefly.inp (generated)

012054524.b3lyp_6-31g(d).smash.inp (generated)

012054524.b3lyp_6-31g(d).nwchem.inp (generated) 012054524.b3lyp_6-31g(d).log.xz 012054524.td-b3lyp_6-31g+(d).inp 012054524.td-b3lyp_6-31g+(d).log.xz

012054524.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054524.td-b3lyp_6-31+g(d).gjf (generated)

012054524.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054524.mol 012054524.PUBCHEM 012054524.mol (via Jmol)
012054525.b3lyp_6-31g(d).inp

012054525.b3lyp_6-31g(d).qchem.inp (generated)

012054525.b3lyp_6-31g(d).gjf (generated)

012054525.b3lyp_6-31g(d).firefly.inp (generated)

012054525.b3lyp_6-31g(d).smash.inp (generated)

012054525.b3lyp_6-31g(d).nwchem.inp (generated) 012054525.b3lyp_6-31g(d).log.xz 012054525.td-b3lyp_6-31g+(d).inp 012054525.td-b3lyp_6-31g+(d).log.xz

012054525.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054525.td-b3lyp_6-31+g(d).gjf (generated)

012054525.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054525.mol 012054525.PUBCHEM 012054525.mol (via Jmol)
012054537.b3lyp_6-31g(d).inp

012054537.b3lyp_6-31g(d).qchem.inp (generated)

012054537.b3lyp_6-31g(d).gjf (generated)

012054537.b3lyp_6-31g(d).firefly.inp (generated)

012054537.b3lyp_6-31g(d).smash.inp (generated)

012054537.b3lyp_6-31g(d).nwchem.inp (generated) 012054537.b3lyp_6-31g(d).log.xz 012054537.td-b3lyp_6-31g+(d).inp 012054537.td-b3lyp_6-31g+(d).log.xz

012054537.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054537.td-b3lyp_6-31+g(d).gjf (generated)

012054537.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054537.mol 012054537.PUBCHEM 012054537.mol (via Jmol)
012054617.b3lyp_6-31g(d).inp

012054617.b3lyp_6-31g(d).qchem.inp (generated)

012054617.b3lyp_6-31g(d).gjf (generated)

012054617.b3lyp_6-31g(d).firefly.inp (generated)

012054617.b3lyp_6-31g(d).smash.inp (generated)

012054617.b3lyp_6-31g(d).nwchem.inp (generated) 012054617.b3lyp_6-31g(d).log.xz 012054617.td-b3lyp_6-31g+(d).inp 012054617.td-b3lyp_6-31g+(d).log.xz

012054617.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054617.td-b3lyp_6-31+g(d).gjf (generated)

012054617.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054617.mol 012054617.PUBCHEM 012054617.mol (via Jmol)
012054641.b3lyp_6-31g(d).inp

012054641.b3lyp_6-31g(d).qchem.inp (generated)

012054641.b3lyp_6-31g(d).gjf (generated)

012054641.b3lyp_6-31g(d).firefly.inp (generated)

012054641.b3lyp_6-31g(d).smash.inp (generated)

012054641.b3lyp_6-31g(d).nwchem.inp (generated) 012054641.b3lyp_6-31g(d).log.xz 012054641.td-b3lyp_6-31g+(d).inp 012054641.td-b3lyp_6-31g+(d).log.xz

012054641.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054641.td-b3lyp_6-31+g(d).gjf (generated)

012054641.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054641.mol 012054641.PUBCHEM 012054641.mol (via Jmol)
012054649.b3lyp_6-31g(d).inp

012054649.b3lyp_6-31g(d).qchem.inp (generated)

012054649.b3lyp_6-31g(d).gjf (generated)

012054649.b3lyp_6-31g(d).firefly.inp (generated)

012054649.b3lyp_6-31g(d).smash.inp (generated)

012054649.b3lyp_6-31g(d).nwchem.inp (generated) 012054649.b3lyp_6-31g(d).log.xz 012054649.mol 012054649.PUBCHEM 012054649.mol (via Jmol)
012054710.b3lyp_6-31g(d).inp

012054710.b3lyp_6-31g(d).qchem.inp (generated)

012054710.b3lyp_6-31g(d).gjf (generated)

012054710.b3lyp_6-31g(d).firefly.inp (generated)

012054710.b3lyp_6-31g(d).smash.inp (generated)

012054710.b3lyp_6-31g(d).nwchem.inp (generated) 012054710.b3lyp_6-31g(d).log.xz 012054710.td-b3lyp_6-31g+(d).inp 012054710.td-b3lyp_6-31g+(d).log.xz

012054710.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054710.td-b3lyp_6-31+g(d).gjf (generated)

012054710.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054710.mol 012054710.PUBCHEM 012054710.mol (via Jmol)
012054747.b3lyp_6-31g(d).inp

012054747.b3lyp_6-31g(d).qchem.inp (generated)

012054747.b3lyp_6-31g(d).gjf (generated)

012054747.b3lyp_6-31g(d).firefly.inp (generated)

012054747.b3lyp_6-31g(d).smash.inp (generated)

012054747.b3lyp_6-31g(d).nwchem.inp (generated) 012054747.b3lyp_6-31g(d).log.xz 012054747.td-b3lyp_6-31g+(d).inp 012054747.td-b3lyp_6-31g+(d).log.xz

012054747.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054747.td-b3lyp_6-31+g(d).gjf (generated)

012054747.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054747.mol 012054747.PUBCHEM 012054747.mol (via Jmol)
012054804.b3lyp_6-31g(d).inp

012054804.b3lyp_6-31g(d).qchem.inp (generated)

012054804.b3lyp_6-31g(d).gjf (generated)

012054804.b3lyp_6-31g(d).firefly.inp (generated)

012054804.b3lyp_6-31g(d).smash.inp (generated)

012054804.b3lyp_6-31g(d).nwchem.inp (generated) 012054804.b3lyp_6-31g(d).log.xz 012054804.td-b3lyp_6-31g+(d).inp 012054804.td-b3lyp_6-31g+(d).log.xz

012054804.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054804.td-b3lyp_6-31+g(d).gjf (generated)

012054804.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054804.mol 012054804.PUBCHEM 012054804.mol (via Jmol)
012054828.b3lyp_6-31g(d).inp

012054828.b3lyp_6-31g(d).qchem.inp (generated)

012054828.b3lyp_6-31g(d).gjf (generated)

012054828.b3lyp_6-31g(d).firefly.inp (generated)

012054828.b3lyp_6-31g(d).smash.inp (generated)

012054828.b3lyp_6-31g(d).nwchem.inp (generated) 012054828.b3lyp_6-31g(d).log.xz 012054828.td-b3lyp_6-31g+(d).inp 012054828.td-b3lyp_6-31g+(d).log.xz

012054828.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054828.td-b3lyp_6-31+g(d).gjf (generated)

012054828.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054828.mol 012054828.PUBCHEM 012054828.mol (via Jmol)
012054882.b3lyp_6-31g(d).inp

012054882.b3lyp_6-31g(d).qchem.inp (generated)

012054882.b3lyp_6-31g(d).gjf (generated)

012054882.b3lyp_6-31g(d).firefly.inp (generated)

012054882.b3lyp_6-31g(d).smash.inp (generated)

012054882.b3lyp_6-31g(d).nwchem.inp (generated) 012054882.b3lyp_6-31g(d).log.xz 012054882.td-b3lyp_6-31g+(d).inp 012054882.td-b3lyp_6-31g+(d).log.xz

012054882.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054882.td-b3lyp_6-31+g(d).gjf (generated)

012054882.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054882.mol 012054882.PUBCHEM 012054882.mol (via Jmol)
012054912.b3lyp_6-31g(d).inp

012054912.b3lyp_6-31g(d).qchem.inp (generated)

012054912.b3lyp_6-31g(d).gjf (generated)

012054912.b3lyp_6-31g(d).firefly.inp (generated)

012054912.b3lyp_6-31g(d).smash.inp (generated)

012054912.b3lyp_6-31g(d).nwchem.inp (generated) 012054912.b3lyp_6-31g(d).log.xz 012054912.td-b3lyp_6-31g+(d).inp 012054912.td-b3lyp_6-31g+(d).log.xz

012054912.td-b3lyp_6-31+g(d).qchem.inp (generated)

012054912.td-b3lyp_6-31+g(d).gjf (generated)

012054912.td-b3lyp_6-31+g(d).firefly.inp (generated)

012054912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012054912.mol 012054912.PUBCHEM 012054912.mol (via Jmol)
012055029.b3lyp_6-31g(d).inp

012055029.b3lyp_6-31g(d).qchem.inp (generated)

012055029.b3lyp_6-31g(d).gjf (generated)

012055029.b3lyp_6-31g(d).firefly.inp (generated)

012055029.b3lyp_6-31g(d).smash.inp (generated)

012055029.b3lyp_6-31g(d).nwchem.inp (generated) 012055029.b3lyp_6-31g(d).log.xz 012055029.mol 012055029.PUBCHEM 012055029.mol (via Jmol)
012055222.b3lyp_6-31g(d).inp

012055222.b3lyp_6-31g(d).qchem.inp (generated)

012055222.b3lyp_6-31g(d).gjf (generated)

012055222.b3lyp_6-31g(d).firefly.inp (generated)

012055222.b3lyp_6-31g(d).smash.inp (generated)

012055222.b3lyp_6-31g(d).nwchem.inp (generated) 012055222.b3lyp_6-31g(d).log.xz 012055222.td-b3lyp_6-31g+(d).inp 012055222.td-b3lyp_6-31g+(d).log.xz

012055222.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055222.td-b3lyp_6-31+g(d).gjf (generated)

012055222.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055222.mol 012055222.PUBCHEM 012055222.mol (via Jmol)
012055228.b3lyp_6-31g(d).inp

012055228.b3lyp_6-31g(d).qchem.inp (generated)

012055228.b3lyp_6-31g(d).gjf (generated)

012055228.b3lyp_6-31g(d).firefly.inp (generated)

012055228.b3lyp_6-31g(d).smash.inp (generated)

012055228.b3lyp_6-31g(d).nwchem.inp (generated) 012055228.b3lyp_6-31g(d).log.xz 012055228.td-b3lyp_6-31g+(d).inp 012055228.td-b3lyp_6-31g+(d).log.xz

012055228.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055228.td-b3lyp_6-31+g(d).gjf (generated)

012055228.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055228.mol 012055228.PUBCHEM 012055228.mol (via Jmol)
012055285.b3lyp_6-31g(d).inp

012055285.b3lyp_6-31g(d).qchem.inp (generated)

012055285.b3lyp_6-31g(d).gjf (generated)

012055285.b3lyp_6-31g(d).firefly.inp (generated)

012055285.b3lyp_6-31g(d).smash.inp (generated)

012055285.b3lyp_6-31g(d).nwchem.inp (generated) 012055285.b3lyp_6-31g(d).log.xz 012055285.td-b3lyp_6-31g+(d).inp 012055285.td-b3lyp_6-31g+(d).log.xz

012055285.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055285.td-b3lyp_6-31+g(d).gjf (generated)

012055285.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055285.mol 012055285.PUBCHEM 012055285.mol (via Jmol)
012055307.b3lyp_6-31g(d).inp

012055307.b3lyp_6-31g(d).qchem.inp (generated)

012055307.b3lyp_6-31g(d).gjf (generated)

012055307.b3lyp_6-31g(d).firefly.inp (generated)

012055307.b3lyp_6-31g(d).smash.inp (generated)

012055307.b3lyp_6-31g(d).nwchem.inp (generated) 012055307.b3lyp_6-31g(d).log.xz 012055307.mol 012055307.PUBCHEM 012055307.mol (via Jmol)
012055309.b3lyp_6-31g(d).inp

012055309.b3lyp_6-31g(d).qchem.inp (generated)

012055309.b3lyp_6-31g(d).gjf (generated)

012055309.b3lyp_6-31g(d).firefly.inp (generated)

012055309.b3lyp_6-31g(d).smash.inp (generated)

012055309.b3lyp_6-31g(d).nwchem.inp (generated) 012055309.b3lyp_6-31g(d).log.xz 012055309.mol 012055309.PUBCHEM 012055309.mol (via Jmol)
012055351.b3lyp_6-31g(d).inp

012055351.b3lyp_6-31g(d).qchem.inp (generated)

012055351.b3lyp_6-31g(d).gjf (generated)

012055351.b3lyp_6-31g(d).firefly.inp (generated)

012055351.b3lyp_6-31g(d).smash.inp (generated)

012055351.b3lyp_6-31g(d).nwchem.inp (generated) 012055351.b3lyp_6-31g(d).log.xz 012055351.td-b3lyp_6-31g+(d).inp 012055351.td-b3lyp_6-31g+(d).log.xz

012055351.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055351.td-b3lyp_6-31+g(d).gjf (generated)

012055351.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055351.mol 012055351.PUBCHEM 012055351.mol (via Jmol)
012055363.b3lyp_6-31g(d).inp

012055363.b3lyp_6-31g(d).qchem.inp (generated)

012055363.b3lyp_6-31g(d).gjf (generated)

012055363.b3lyp_6-31g(d).firefly.inp (generated)

012055363.b3lyp_6-31g(d).smash.inp (generated)

012055363.b3lyp_6-31g(d).nwchem.inp (generated) 012055363.b3lyp_6-31g(d).log.xz 012055363.td-b3lyp_6-31g+(d).inp 012055363.td-b3lyp_6-31g+(d).log.xz

012055363.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055363.td-b3lyp_6-31+g(d).gjf (generated)

012055363.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055363.mol 012055363.PUBCHEM 012055363.mol (via Jmol)
012055448.b3lyp_6-31g(d).inp

012055448.b3lyp_6-31g(d).qchem.inp (generated)

012055448.b3lyp_6-31g(d).gjf (generated)

012055448.b3lyp_6-31g(d).firefly.inp (generated)

012055448.b3lyp_6-31g(d).smash.inp (generated)

012055448.b3lyp_6-31g(d).nwchem.inp (generated) 012055448.b3lyp_6-31g(d).log.xz 012055448.td-b3lyp_6-31g+(d).inp 012055448.td-b3lyp_6-31g+(d).log.xz

012055448.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055448.td-b3lyp_6-31+g(d).gjf (generated)

012055448.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055448.mol 012055448.PUBCHEM 012055448.mol (via Jmol)
012055510.b3lyp_6-31g(d).inp

012055510.b3lyp_6-31g(d).qchem.inp (generated)

012055510.b3lyp_6-31g(d).gjf (generated)

012055510.b3lyp_6-31g(d).firefly.inp (generated)

012055510.b3lyp_6-31g(d).smash.inp (generated)

012055510.b3lyp_6-31g(d).nwchem.inp (generated) 012055510.b3lyp_6-31g(d).log.xz 012055510.td-b3lyp_6-31g+(d).inp 012055510.td-b3lyp_6-31g+(d).log.xz

012055510.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055510.td-b3lyp_6-31+g(d).gjf (generated)

012055510.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055510.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055510.mol 012055510.PUBCHEM 012055510.mol (via Jmol)
012055613.b3lyp_6-31g(d).inp

012055613.b3lyp_6-31g(d).qchem.inp (generated)

012055613.b3lyp_6-31g(d).gjf (generated)

012055613.b3lyp_6-31g(d).firefly.inp (generated)

012055613.b3lyp_6-31g(d).smash.inp (generated)

012055613.b3lyp_6-31g(d).nwchem.inp (generated) 012055613.b3lyp_6-31g(d).log.xz 012055613.td-b3lyp_6-31g+(d).inp 012055613.td-b3lyp_6-31g+(d).log.xz

012055613.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055613.td-b3lyp_6-31+g(d).gjf (generated)

012055613.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055613.mol 012055613.PUBCHEM 012055613.mol (via Jmol)
012055775.b3lyp_6-31g(d).inp

012055775.b3lyp_6-31g(d).qchem.inp (generated)

012055775.b3lyp_6-31g(d).gjf (generated)

012055775.b3lyp_6-31g(d).firefly.inp (generated)

012055775.b3lyp_6-31g(d).smash.inp (generated)

012055775.b3lyp_6-31g(d).nwchem.inp (generated) 012055775.b3lyp_6-31g(d).log.xz 012055775.td-b3lyp_6-31g+(d).inp 012055775.td-b3lyp_6-31g+(d).log.xz

012055775.td-b3lyp_6-31+g(d).qchem.inp (generated)

012055775.td-b3lyp_6-31+g(d).gjf (generated)

012055775.td-b3lyp_6-31+g(d).firefly.inp (generated)

012055775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012055775.mol 012055775.PUBCHEM 012055775.mol (via Jmol)
012056026.b3lyp_6-31g(d).inp

012056026.b3lyp_6-31g(d).qchem.inp (generated)

012056026.b3lyp_6-31g(d).gjf (generated)

012056026.b3lyp_6-31g(d).firefly.inp (generated)

012056026.b3lyp_6-31g(d).smash.inp (generated)

012056026.b3lyp_6-31g(d).nwchem.inp (generated) 012056026.b3lyp_6-31g(d).log.xz 012056026.td-b3lyp_6-31g+(d).inp 012056026.td-b3lyp_6-31g+(d).log.xz

012056026.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056026.td-b3lyp_6-31+g(d).gjf (generated)

012056026.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056026.mol 012056026.PUBCHEM 012056026.mol (via Jmol)
012056230.b3lyp_6-31g(d).inp

012056230.b3lyp_6-31g(d).qchem.inp (generated)

012056230.b3lyp_6-31g(d).gjf (generated)

012056230.b3lyp_6-31g(d).firefly.inp (generated)

012056230.b3lyp_6-31g(d).smash.inp (generated)

012056230.b3lyp_6-31g(d).nwchem.inp (generated) 012056230.b3lyp_6-31g(d).log.xz 012056230.td-b3lyp_6-31g+(d).inp 012056230.td-b3lyp_6-31g+(d).log.xz

012056230.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056230.td-b3lyp_6-31+g(d).gjf (generated)

012056230.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056230.mol 012056230.PUBCHEM 012056230.mol (via Jmol)
012056233.b3lyp_6-31g(d).inp

012056233.b3lyp_6-31g(d).qchem.inp (generated)

012056233.b3lyp_6-31g(d).gjf (generated)

012056233.b3lyp_6-31g(d).firefly.inp (generated)

012056233.b3lyp_6-31g(d).smash.inp (generated)

012056233.b3lyp_6-31g(d).nwchem.inp (generated) 012056233.b3lyp_6-31g(d).log.xz 012056233.td-b3lyp_6-31g+(d).inp 012056233.td-b3lyp_6-31g+(d).log.xz

012056233.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056233.td-b3lyp_6-31+g(d).gjf (generated)

012056233.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056233.mol 012056233.PUBCHEM 012056233.mol (via Jmol)
012056235.b3lyp_6-31g(d).inp

012056235.b3lyp_6-31g(d).qchem.inp (generated)

012056235.b3lyp_6-31g(d).gjf (generated)

012056235.b3lyp_6-31g(d).firefly.inp (generated)

012056235.b3lyp_6-31g(d).smash.inp (generated)

012056235.b3lyp_6-31g(d).nwchem.inp (generated) 012056235.b3lyp_6-31g(d).log.xz 012056235.td-b3lyp_6-31g+(d).inp 012056235.td-b3lyp_6-31g+(d).log.xz

012056235.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056235.td-b3lyp_6-31+g(d).gjf (generated)

012056235.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056235.mol 012056235.PUBCHEM 012056235.mol (via Jmol)
012056237.b3lyp_6-31g(d).inp

012056237.b3lyp_6-31g(d).qchem.inp (generated)

012056237.b3lyp_6-31g(d).gjf (generated)

012056237.b3lyp_6-31g(d).firefly.inp (generated)

012056237.b3lyp_6-31g(d).smash.inp (generated)

012056237.b3lyp_6-31g(d).nwchem.inp (generated) 012056237.b3lyp_6-31g(d).log.xz 012056237.td-b3lyp_6-31g+(d).inp 012056237.td-b3lyp_6-31g+(d).log.xz

012056237.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056237.td-b3lyp_6-31+g(d).gjf (generated)

012056237.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056237.mol 012056237.PUBCHEM 012056237.mol (via Jmol)
012056257.b3lyp_6-31g(d).inp

012056257.b3lyp_6-31g(d).qchem.inp (generated)

012056257.b3lyp_6-31g(d).gjf (generated)

012056257.b3lyp_6-31g(d).firefly.inp (generated)

012056257.b3lyp_6-31g(d).smash.inp (generated)

012056257.b3lyp_6-31g(d).nwchem.inp (generated) 012056257.b3lyp_6-31g(d).log.xz 012056257.td-b3lyp_6-31g+(d).inp 012056257.td-b3lyp_6-31g+(d).log.xz

012056257.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056257.td-b3lyp_6-31+g(d).gjf (generated)

012056257.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056257.mol 012056257.PUBCHEM 012056257.mol (via Jmol)
012056266.b3lyp_6-31g(d).inp

012056266.b3lyp_6-31g(d).qchem.inp (generated)

012056266.b3lyp_6-31g(d).gjf (generated)

012056266.b3lyp_6-31g(d).firefly.inp (generated)

012056266.b3lyp_6-31g(d).smash.inp (generated)

012056266.b3lyp_6-31g(d).nwchem.inp (generated) 012056266.b3lyp_6-31g(d).log.xz 012056266.td-b3lyp_6-31g+(d).inp 012056266.td-b3lyp_6-31g+(d).log.xz

012056266.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056266.td-b3lyp_6-31+g(d).gjf (generated)

012056266.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056266.mol 012056266.PUBCHEM 012056266.mol (via Jmol)
012056327.b3lyp_6-31g(d).inp

012056327.b3lyp_6-31g(d).qchem.inp (generated)

012056327.b3lyp_6-31g(d).gjf (generated)

012056327.b3lyp_6-31g(d).firefly.inp (generated)

012056327.b3lyp_6-31g(d).smash.inp (generated)

012056327.b3lyp_6-31g(d).nwchem.inp (generated) 012056327.b3lyp_6-31g(d).log.xz 012056327.td-b3lyp_6-31g+(d).inp 012056327.td-b3lyp_6-31g+(d).log.xz

012056327.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056327.td-b3lyp_6-31+g(d).gjf (generated)

012056327.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056327.mol 012056327.PUBCHEM 012056327.mol (via Jmol)
012056372.b3lyp_6-31g(d).inp

012056372.b3lyp_6-31g(d).qchem.inp (generated)

012056372.b3lyp_6-31g(d).gjf (generated)

012056372.b3lyp_6-31g(d).firefly.inp (generated)

012056372.b3lyp_6-31g(d).smash.inp (generated)

012056372.b3lyp_6-31g(d).nwchem.inp (generated) 012056372.b3lyp_6-31g(d).log.xz 012056372.td-b3lyp_6-31g+(d).inp 012056372.td-b3lyp_6-31g+(d).log.xz

012056372.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056372.td-b3lyp_6-31+g(d).gjf (generated)

012056372.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056372.mol 012056372.PUBCHEM 012056372.mol (via Jmol)
012056373.b3lyp_6-31g(d).inp

012056373.b3lyp_6-31g(d).qchem.inp (generated)

012056373.b3lyp_6-31g(d).gjf (generated)

012056373.b3lyp_6-31g(d).firefly.inp (generated)

012056373.b3lyp_6-31g(d).smash.inp (generated)

012056373.b3lyp_6-31g(d).nwchem.inp (generated) 012056373.b3lyp_6-31g(d).log.xz 012056373.td-b3lyp_6-31g+(d).inp 012056373.td-b3lyp_6-31g+(d).log.xz

012056373.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056373.td-b3lyp_6-31+g(d).gjf (generated)

012056373.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056373.mol 012056373.PUBCHEM 012056373.mol (via Jmol)
012056374.b3lyp_6-31g(d).inp

012056374.b3lyp_6-31g(d).qchem.inp (generated)

012056374.b3lyp_6-31g(d).gjf (generated)

012056374.b3lyp_6-31g(d).firefly.inp (generated)

012056374.b3lyp_6-31g(d).smash.inp (generated)

012056374.b3lyp_6-31g(d).nwchem.inp (generated) 012056374.b3lyp_6-31g(d).log.xz 012056374.td-b3lyp_6-31g+(d).inp 012056374.td-b3lyp_6-31g+(d).log.xz

012056374.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056374.td-b3lyp_6-31+g(d).gjf (generated)

012056374.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056374.mol 012056374.PUBCHEM 012056374.mol (via Jmol)
012056375.b3lyp_6-31g(d).inp

012056375.b3lyp_6-31g(d).qchem.inp (generated)

012056375.b3lyp_6-31g(d).gjf (generated)

012056375.b3lyp_6-31g(d).firefly.inp (generated)

012056375.b3lyp_6-31g(d).smash.inp (generated)

012056375.b3lyp_6-31g(d).nwchem.inp (generated) 012056375.b3lyp_6-31g(d).log.xz 012056375.td-b3lyp_6-31g+(d).inp 012056375.td-b3lyp_6-31g+(d).log.xz

012056375.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056375.td-b3lyp_6-31+g(d).gjf (generated)

012056375.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056375.mol 012056375.PUBCHEM 012056375.mol (via Jmol)
012056376.b3lyp_6-31g(d).inp

012056376.b3lyp_6-31g(d).qchem.inp (generated)

012056376.b3lyp_6-31g(d).gjf (generated)

012056376.b3lyp_6-31g(d).firefly.inp (generated)

012056376.b3lyp_6-31g(d).smash.inp (generated)

012056376.b3lyp_6-31g(d).nwchem.inp (generated) 012056376.b3lyp_6-31g(d).log.xz 012056376.td-b3lyp_6-31g+(d).inp 012056376.td-b3lyp_6-31g+(d).log.xz

012056376.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056376.td-b3lyp_6-31+g(d).gjf (generated)

012056376.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056376.mol 012056376.PUBCHEM 012056376.mol (via Jmol)
012056389.b3lyp_6-31g(d).inp

012056389.b3lyp_6-31g(d).qchem.inp (generated)

012056389.b3lyp_6-31g(d).gjf (generated)

012056389.b3lyp_6-31g(d).firefly.inp (generated)

012056389.b3lyp_6-31g(d).smash.inp (generated)

012056389.b3lyp_6-31g(d).nwchem.inp (generated) 012056389.b3lyp_6-31g(d).log.xz 012056389.td-b3lyp_6-31g+(d).inp 012056389.td-b3lyp_6-31g+(d).log.xz

012056389.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056389.td-b3lyp_6-31+g(d).gjf (generated)

012056389.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056389.mol 012056389.PUBCHEM 012056389.mol (via Jmol)
012056528.b3lyp_6-31g(d).inp

012056528.b3lyp_6-31g(d).qchem.inp (generated)

012056528.b3lyp_6-31g(d).gjf (generated)

012056528.b3lyp_6-31g(d).firefly.inp (generated)

012056528.b3lyp_6-31g(d).smash.inp (generated)

012056528.b3lyp_6-31g(d).nwchem.inp (generated) 012056528.b3lyp_6-31g(d).log.xz 012056528.td-b3lyp_6-31g+(d).inp 012056528.td-b3lyp_6-31g+(d).log.xz

012056528.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056528.td-b3lyp_6-31+g(d).gjf (generated)

012056528.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056528.mol 012056528.PUBCHEM 012056528.mol (via Jmol)
012056529.b3lyp_6-31g(d).inp

012056529.b3lyp_6-31g(d).qchem.inp (generated)

012056529.b3lyp_6-31g(d).gjf (generated)

012056529.b3lyp_6-31g(d).firefly.inp (generated)

012056529.b3lyp_6-31g(d).smash.inp (generated)

012056529.b3lyp_6-31g(d).nwchem.inp (generated) 012056529.b3lyp_6-31g(d).log.xz 012056529.td-b3lyp_6-31g+(d).inp 012056529.td-b3lyp_6-31g+(d).log.xz

012056529.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056529.td-b3lyp_6-31+g(d).gjf (generated)

012056529.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056529.mol 012056529.PUBCHEM 012056529.mol (via Jmol)
012056531.b3lyp_6-31g(d).inp

012056531.b3lyp_6-31g(d).qchem.inp (generated)

012056531.b3lyp_6-31g(d).gjf (generated)

012056531.b3lyp_6-31g(d).firefly.inp (generated)

012056531.b3lyp_6-31g(d).smash.inp (generated)

012056531.b3lyp_6-31g(d).nwchem.inp (generated) 012056531.b3lyp_6-31g(d).log.xz 012056531.td-b3lyp_6-31g+(d).inp 012056531.td-b3lyp_6-31g+(d).log.xz

012056531.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056531.td-b3lyp_6-31+g(d).gjf (generated)

012056531.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056531.mol 012056531.PUBCHEM 012056531.mol (via Jmol)
012056551.b3lyp_6-31g(d).inp

012056551.b3lyp_6-31g(d).qchem.inp (generated)

012056551.b3lyp_6-31g(d).gjf (generated)

012056551.b3lyp_6-31g(d).firefly.inp (generated)

012056551.b3lyp_6-31g(d).smash.inp (generated)

012056551.b3lyp_6-31g(d).nwchem.inp (generated) 012056551.b3lyp_6-31g(d).log.xz 012056551.td-b3lyp_6-31g+(d).inp 012056551.td-b3lyp_6-31g+(d).log.xz

012056551.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056551.td-b3lyp_6-31+g(d).gjf (generated)

012056551.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056551.mol 012056551.PUBCHEM 012056551.mol (via Jmol)
012056587.b3lyp_6-31g(d).inp

012056587.b3lyp_6-31g(d).qchem.inp (generated)

012056587.b3lyp_6-31g(d).gjf (generated)

012056587.b3lyp_6-31g(d).firefly.inp (generated)

012056587.b3lyp_6-31g(d).smash.inp (generated)

012056587.b3lyp_6-31g(d).nwchem.inp (generated) 012056587.b3lyp_6-31g(d).log.xz 012056587.td-b3lyp_6-31g+(d).inp 012056587.td-b3lyp_6-31g+(d).log.xz

012056587.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056587.td-b3lyp_6-31+g(d).gjf (generated)

012056587.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056587.mol 012056587.PUBCHEM 012056587.mol (via Jmol)
012056588.b3lyp_6-31g(d).inp

012056588.b3lyp_6-31g(d).qchem.inp (generated)

012056588.b3lyp_6-31g(d).gjf (generated)

012056588.b3lyp_6-31g(d).firefly.inp (generated)

012056588.b3lyp_6-31g(d).smash.inp (generated)

012056588.b3lyp_6-31g(d).nwchem.inp (generated) 012056588.b3lyp_6-31g(d).log.xz 012056588.td-b3lyp_6-31g+(d).inp 012056588.td-b3lyp_6-31g+(d).log.xz

012056588.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056588.td-b3lyp_6-31+g(d).gjf (generated)

012056588.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056588.mol 012056588.PUBCHEM 012056588.mol (via Jmol)
012056595.b3lyp_6-31g(d).inp

012056595.b3lyp_6-31g(d).qchem.inp (generated)

012056595.b3lyp_6-31g(d).gjf (generated)

012056595.b3lyp_6-31g(d).firefly.inp (generated)

012056595.b3lyp_6-31g(d).smash.inp (generated)

012056595.b3lyp_6-31g(d).nwchem.inp (generated) 012056595.b3lyp_6-31g(d).log.xz 012056595.td-b3lyp_6-31g+(d).inp 012056595.td-b3lyp_6-31g+(d).log.xz

012056595.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056595.td-b3lyp_6-31+g(d).gjf (generated)

012056595.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056595.mol 012056595.PUBCHEM 012056595.mol (via Jmol)
012056619.b3lyp_6-31g(d).inp

012056619.b3lyp_6-31g(d).qchem.inp (generated)

012056619.b3lyp_6-31g(d).gjf (generated)

012056619.b3lyp_6-31g(d).firefly.inp (generated)

012056619.b3lyp_6-31g(d).smash.inp (generated)

012056619.b3lyp_6-31g(d).nwchem.inp (generated) 012056619.b3lyp_6-31g(d).log.xz 012056619.td-b3lyp_6-31g+(d).inp 012056619.td-b3lyp_6-31g+(d).log.xz

012056619.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056619.td-b3lyp_6-31+g(d).gjf (generated)

012056619.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056619.mol 012056619.PUBCHEM 012056619.mol (via Jmol)
012056644.b3lyp_6-31g(d).inp

012056644.b3lyp_6-31g(d).qchem.inp (generated)

012056644.b3lyp_6-31g(d).gjf (generated)

012056644.b3lyp_6-31g(d).firefly.inp (generated)

012056644.b3lyp_6-31g(d).smash.inp (generated)

012056644.b3lyp_6-31g(d).nwchem.inp (generated) 012056644.b3lyp_6-31g(d).log.xz 012056644.td-b3lyp_6-31g+(d).inp 012056644.td-b3lyp_6-31g+(d).log.xz

012056644.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056644.td-b3lyp_6-31+g(d).gjf (generated)

012056644.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056644.mol 012056644.PUBCHEM 012056644.mol (via Jmol)
012056645.b3lyp_6-31g(d).inp

012056645.b3lyp_6-31g(d).qchem.inp (generated)

012056645.b3lyp_6-31g(d).gjf (generated)

012056645.b3lyp_6-31g(d).firefly.inp (generated)

012056645.b3lyp_6-31g(d).smash.inp (generated)

012056645.b3lyp_6-31g(d).nwchem.inp (generated) 012056645.b3lyp_6-31g(d).log.xz 012056645.td-b3lyp_6-31g+(d).inp 012056645.td-b3lyp_6-31g+(d).log.xz

012056645.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056645.td-b3lyp_6-31+g(d).gjf (generated)

012056645.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056645.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056645.mol 012056645.PUBCHEM 012056645.mol (via Jmol)
012056674.b3lyp_6-31g(d).inp

012056674.b3lyp_6-31g(d).qchem.inp (generated)

012056674.b3lyp_6-31g(d).gjf (generated)

012056674.b3lyp_6-31g(d).firefly.inp (generated)

012056674.b3lyp_6-31g(d).smash.inp (generated)

012056674.b3lyp_6-31g(d).nwchem.inp (generated) 012056674.b3lyp_6-31g(d).log.xz 012056674.mol 012056674.PUBCHEM 012056674.mol (via Jmol)
012056677.b3lyp_6-31g(d).inp

012056677.b3lyp_6-31g(d).qchem.inp (generated)

012056677.b3lyp_6-31g(d).gjf (generated)

012056677.b3lyp_6-31g(d).firefly.inp (generated)

012056677.b3lyp_6-31g(d).smash.inp (generated)

012056677.b3lyp_6-31g(d).nwchem.inp (generated) 012056677.b3lyp_6-31g(d).log.xz 012056677.td-b3lyp_6-31g+(d).inp 012056677.td-b3lyp_6-31g+(d).log.xz

012056677.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056677.td-b3lyp_6-31+g(d).gjf (generated)

012056677.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056677.mol 012056677.PUBCHEM 012056677.mol (via Jmol)
012056680.b3lyp_6-31g(d).inp

012056680.b3lyp_6-31g(d).qchem.inp (generated)

012056680.b3lyp_6-31g(d).gjf (generated)

012056680.b3lyp_6-31g(d).firefly.inp (generated)

012056680.b3lyp_6-31g(d).smash.inp (generated)

012056680.b3lyp_6-31g(d).nwchem.inp (generated) 012056680.b3lyp_6-31g(d).log.xz 012056680.td-b3lyp_6-31g+(d).inp 012056680.td-b3lyp_6-31g+(d).log.xz

012056680.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056680.td-b3lyp_6-31+g(d).gjf (generated)

012056680.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056680.mol 012056680.PUBCHEM 012056680.mol (via Jmol)
012056713.b3lyp_6-31g(d).inp

012056713.b3lyp_6-31g(d).qchem.inp (generated)

012056713.b3lyp_6-31g(d).gjf (generated)

012056713.b3lyp_6-31g(d).firefly.inp (generated)

012056713.b3lyp_6-31g(d).smash.inp (generated)

012056713.b3lyp_6-31g(d).nwchem.inp (generated) 012056713.b3lyp_6-31g(d).log.xz 012056713.td-b3lyp_6-31g+(d).inp 012056713.td-b3lyp_6-31g+(d).log.xz

012056713.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056713.td-b3lyp_6-31+g(d).gjf (generated)

012056713.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056713.mol 012056713.PUBCHEM 012056713.mol (via Jmol)
012056717.b3lyp_6-31g(d).inp

012056717.b3lyp_6-31g(d).qchem.inp (generated)

012056717.b3lyp_6-31g(d).gjf (generated)

012056717.b3lyp_6-31g(d).firefly.inp (generated)

012056717.b3lyp_6-31g(d).smash.inp (generated)

012056717.b3lyp_6-31g(d).nwchem.inp (generated) 012056717.b3lyp_6-31g(d).log.xz 012056717.td-b3lyp_6-31g+(d).inp 012056717.td-b3lyp_6-31g+(d).log.xz

012056717.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056717.td-b3lyp_6-31+g(d).gjf (generated)

012056717.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056717.mol 012056717.PUBCHEM 012056717.mol (via Jmol)
012056721.b3lyp_6-31g(d).inp

012056721.b3lyp_6-31g(d).qchem.inp (generated)

012056721.b3lyp_6-31g(d).gjf (generated)

012056721.b3lyp_6-31g(d).firefly.inp (generated)

012056721.b3lyp_6-31g(d).smash.inp (generated)

012056721.b3lyp_6-31g(d).nwchem.inp (generated) 012056721.b3lyp_6-31g(d).log.xz 012056721.td-b3lyp_6-31g+(d).inp 012056721.td-b3lyp_6-31g+(d).log.xz

012056721.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056721.td-b3lyp_6-31+g(d).gjf (generated)

012056721.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056721.mol 012056721.PUBCHEM 012056721.mol (via Jmol)
012056728.b3lyp_6-31g(d).inp

012056728.b3lyp_6-31g(d).qchem.inp (generated)

012056728.b3lyp_6-31g(d).gjf (generated)

012056728.b3lyp_6-31g(d).firefly.inp (generated)

012056728.b3lyp_6-31g(d).smash.inp (generated)

012056728.b3lyp_6-31g(d).nwchem.inp (generated) 012056728.b3lyp_6-31g(d).log.xz 012056728.td-b3lyp_6-31g+(d).inp 012056728.td-b3lyp_6-31g+(d).log.xz

012056728.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056728.td-b3lyp_6-31+g(d).gjf (generated)

012056728.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056728.mol 012056728.PUBCHEM 012056728.mol (via Jmol)
012056733.b3lyp_6-31g(d).inp

012056733.b3lyp_6-31g(d).qchem.inp (generated)

012056733.b3lyp_6-31g(d).gjf (generated)

012056733.b3lyp_6-31g(d).firefly.inp (generated)

012056733.b3lyp_6-31g(d).smash.inp (generated)

012056733.b3lyp_6-31g(d).nwchem.inp (generated) 012056733.b3lyp_6-31g(d).log.xz 012056733.td-b3lyp_6-31g+(d).inp 012056733.td-b3lyp_6-31g+(d).log.xz

012056733.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056733.td-b3lyp_6-31+g(d).gjf (generated)

012056733.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056733.mol 012056733.PUBCHEM 012056733.mol (via Jmol)
012056746.b3lyp_6-31g(d).inp

012056746.b3lyp_6-31g(d).qchem.inp (generated)

012056746.b3lyp_6-31g(d).gjf (generated)

012056746.b3lyp_6-31g(d).firefly.inp (generated)

012056746.b3lyp_6-31g(d).smash.inp (generated)

012056746.b3lyp_6-31g(d).nwchem.inp (generated) 012056746.b3lyp_6-31g(d).log.xz 012056746.td-b3lyp_6-31g+(d).inp 012056746.td-b3lyp_6-31g+(d).log.xz

012056746.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056746.td-b3lyp_6-31+g(d).gjf (generated)

012056746.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056746.mol 012056746.PUBCHEM 012056746.mol (via Jmol)
012056750.b3lyp_6-31g(d).inp

012056750.b3lyp_6-31g(d).qchem.inp (generated)

012056750.b3lyp_6-31g(d).gjf (generated)

012056750.b3lyp_6-31g(d).firefly.inp (generated)

012056750.b3lyp_6-31g(d).smash.inp (generated)

012056750.b3lyp_6-31g(d).nwchem.inp (generated) 012056750.b3lyp_6-31g(d).log.xz 012056750.td-b3lyp_6-31g+(d).inp 012056750.td-b3lyp_6-31g+(d).log.xz

012056750.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056750.td-b3lyp_6-31+g(d).gjf (generated)

012056750.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056750.mol 012056750.PUBCHEM 012056750.mol (via Jmol)
012056771.b3lyp_6-31g(d).inp

012056771.b3lyp_6-31g(d).qchem.inp (generated)

012056771.b3lyp_6-31g(d).gjf (generated)

012056771.b3lyp_6-31g(d).firefly.inp (generated)

012056771.b3lyp_6-31g(d).smash.inp (generated)

012056771.b3lyp_6-31g(d).nwchem.inp (generated) 012056771.b3lyp_6-31g(d).log.xz 012056771.td-b3lyp_6-31g+(d).inp 012056771.td-b3lyp_6-31g+(d).log.xz

012056771.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056771.td-b3lyp_6-31+g(d).gjf (generated)

012056771.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056771.mol 012056771.PUBCHEM 012056771.mol (via Jmol)
012056779.b3lyp_6-31g(d).inp

012056779.b3lyp_6-31g(d).qchem.inp (generated)

012056779.b3lyp_6-31g(d).gjf (generated)

012056779.b3lyp_6-31g(d).firefly.inp (generated)

012056779.b3lyp_6-31g(d).smash.inp (generated)

012056779.b3lyp_6-31g(d).nwchem.inp (generated) 012056779.b3lyp_6-31g(d).log.xz 012056779.td-b3lyp_6-31g+(d).inp 012056779.td-b3lyp_6-31g+(d).log.xz

012056779.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056779.td-b3lyp_6-31+g(d).gjf (generated)

012056779.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056779.mol 012056779.PUBCHEM 012056779.mol (via Jmol)
012056780.b3lyp_6-31g(d).inp

012056780.b3lyp_6-31g(d).qchem.inp (generated)

012056780.b3lyp_6-31g(d).gjf (generated)

012056780.b3lyp_6-31g(d).firefly.inp (generated)

012056780.b3lyp_6-31g(d).smash.inp (generated)

012056780.b3lyp_6-31g(d).nwchem.inp (generated) 012056780.b3lyp_6-31g(d).log.xz 012056780.td-b3lyp_6-31g+(d).inp 012056780.td-b3lyp_6-31g+(d).log.xz

012056780.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056780.td-b3lyp_6-31+g(d).gjf (generated)

012056780.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056780.mol 012056780.PUBCHEM 012056780.mol (via Jmol)
012056782.b3lyp_6-31g(d).inp

012056782.b3lyp_6-31g(d).qchem.inp (generated)

012056782.b3lyp_6-31g(d).gjf (generated)

012056782.b3lyp_6-31g(d).firefly.inp (generated)

012056782.b3lyp_6-31g(d).smash.inp (generated)

012056782.b3lyp_6-31g(d).nwchem.inp (generated) 012056782.b3lyp_6-31g(d).log.xz 012056782.td-b3lyp_6-31g+(d).inp 012056782.td-b3lyp_6-31g+(d).log.xz

012056782.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056782.td-b3lyp_6-31+g(d).gjf (generated)

012056782.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056782.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056782.mol 012056782.PUBCHEM 012056782.mol (via Jmol)
012056784.b3lyp_6-31g(d).inp

012056784.b3lyp_6-31g(d).qchem.inp (generated)

012056784.b3lyp_6-31g(d).gjf (generated)

012056784.b3lyp_6-31g(d).firefly.inp (generated)

012056784.b3lyp_6-31g(d).smash.inp (generated)

012056784.b3lyp_6-31g(d).nwchem.inp (generated) 012056784.b3lyp_6-31g(d).log.xz 012056784.td-b3lyp_6-31g+(d).inp 012056784.td-b3lyp_6-31g+(d).log.xz

012056784.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056784.td-b3lyp_6-31+g(d).gjf (generated)

012056784.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056784.mol 012056784.PUBCHEM 012056784.mol (via Jmol)
012056806.b3lyp_6-31g(d).inp

012056806.b3lyp_6-31g(d).qchem.inp (generated)

012056806.b3lyp_6-31g(d).gjf (generated)

012056806.b3lyp_6-31g(d).firefly.inp (generated)

012056806.b3lyp_6-31g(d).smash.inp (generated)

012056806.b3lyp_6-31g(d).nwchem.inp (generated) 012056806.b3lyp_6-31g(d).log.xz 012056806.td-b3lyp_6-31g+(d).inp 012056806.td-b3lyp_6-31g+(d).log.xz

012056806.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056806.td-b3lyp_6-31+g(d).gjf (generated)

012056806.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056806.mol 012056806.PUBCHEM 012056806.mol (via Jmol)
012056831.b3lyp_6-31g(d).inp

012056831.b3lyp_6-31g(d).qchem.inp (generated)

012056831.b3lyp_6-31g(d).gjf (generated)

012056831.b3lyp_6-31g(d).firefly.inp (generated)

012056831.b3lyp_6-31g(d).smash.inp (generated)

012056831.b3lyp_6-31g(d).nwchem.inp (generated) 012056831.b3lyp_6-31g(d).log.xz 012056831.td-b3lyp_6-31g+(d).inp 012056831.td-b3lyp_6-31g+(d).log.xz

012056831.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056831.td-b3lyp_6-31+g(d).gjf (generated)

012056831.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056831.mol 012056831.PUBCHEM 012056831.mol (via Jmol)
012056832.b3lyp_6-31g(d).inp

012056832.b3lyp_6-31g(d).qchem.inp (generated)

012056832.b3lyp_6-31g(d).gjf (generated)

012056832.b3lyp_6-31g(d).firefly.inp (generated)

012056832.b3lyp_6-31g(d).smash.inp (generated)

012056832.b3lyp_6-31g(d).nwchem.inp (generated) 012056832.b3lyp_6-31g(d).log.xz 012056832.td-b3lyp_6-31g+(d).inp 012056832.td-b3lyp_6-31g+(d).log.xz

012056832.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056832.td-b3lyp_6-31+g(d).gjf (generated)

012056832.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056832.mol 012056832.PUBCHEM 012056832.mol (via Jmol)
012056834.b3lyp_6-31g(d).inp

012056834.b3lyp_6-31g(d).qchem.inp (generated)

012056834.b3lyp_6-31g(d).gjf (generated)

012056834.b3lyp_6-31g(d).firefly.inp (generated)

012056834.b3lyp_6-31g(d).smash.inp (generated)

012056834.b3lyp_6-31g(d).nwchem.inp (generated) 012056834.b3lyp_6-31g(d).log.xz 012056834.td-b3lyp_6-31g+(d).inp 012056834.td-b3lyp_6-31g+(d).log.xz

012056834.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056834.td-b3lyp_6-31+g(d).gjf (generated)

012056834.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056834.mol 012056834.PUBCHEM 012056834.mol (via Jmol)
012056836.b3lyp_6-31g(d).inp

012056836.b3lyp_6-31g(d).qchem.inp (generated)

012056836.b3lyp_6-31g(d).gjf (generated)

012056836.b3lyp_6-31g(d).firefly.inp (generated)

012056836.b3lyp_6-31g(d).smash.inp (generated)

012056836.b3lyp_6-31g(d).nwchem.inp (generated) 012056836.b3lyp_6-31g(d).log.xz 012056836.td-b3lyp_6-31g+(d).inp 012056836.td-b3lyp_6-31g+(d).log.xz

012056836.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056836.td-b3lyp_6-31+g(d).gjf (generated)

012056836.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056836.mol 012056836.PUBCHEM 012056836.mol (via Jmol)
012056838.b3lyp_6-31g(d).inp

012056838.b3lyp_6-31g(d).qchem.inp (generated)

012056838.b3lyp_6-31g(d).gjf (generated)

012056838.b3lyp_6-31g(d).firefly.inp (generated)

012056838.b3lyp_6-31g(d).smash.inp (generated)

012056838.b3lyp_6-31g(d).nwchem.inp (generated) 012056838.b3lyp_6-31g(d).log.xz 012056838.td-b3lyp_6-31g+(d).inp 012056838.td-b3lyp_6-31g+(d).log.xz

012056838.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056838.td-b3lyp_6-31+g(d).gjf (generated)

012056838.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056838.mol 012056838.PUBCHEM 012056838.mol (via Jmol)
012056845.b3lyp_6-31g(d).inp

012056845.b3lyp_6-31g(d).qchem.inp (generated)

012056845.b3lyp_6-31g(d).gjf (generated)

012056845.b3lyp_6-31g(d).firefly.inp (generated)

012056845.b3lyp_6-31g(d).smash.inp (generated)

012056845.b3lyp_6-31g(d).nwchem.inp (generated) 012056845.b3lyp_6-31g(d).log.xz 012056845.td-b3lyp_6-31g+(d).inp 012056845.td-b3lyp_6-31g+(d).log.xz

012056845.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056845.td-b3lyp_6-31+g(d).gjf (generated)

012056845.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056845.mol 012056845.PUBCHEM 012056845.mol (via Jmol)
012056868.b3lyp_6-31g(d).inp

012056868.b3lyp_6-31g(d).qchem.inp (generated)

012056868.b3lyp_6-31g(d).gjf (generated)

012056868.b3lyp_6-31g(d).firefly.inp (generated)

012056868.b3lyp_6-31g(d).smash.inp (generated)

012056868.b3lyp_6-31g(d).nwchem.inp (generated) 012056868.b3lyp_6-31g(d).log.xz 012056868.td-b3lyp_6-31g+(d).inp 012056868.td-b3lyp_6-31g+(d).log.xz

012056868.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056868.td-b3lyp_6-31+g(d).gjf (generated)

012056868.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056868.mol 012056868.PUBCHEM 012056868.mol (via Jmol)
012056873.b3lyp_6-31g(d).inp

012056873.b3lyp_6-31g(d).qchem.inp (generated)

012056873.b3lyp_6-31g(d).gjf (generated)

012056873.b3lyp_6-31g(d).firefly.inp (generated)

012056873.b3lyp_6-31g(d).smash.inp (generated)

012056873.b3lyp_6-31g(d).nwchem.inp (generated) 012056873.b3lyp_6-31g(d).log.xz 012056873.td-b3lyp_6-31g+(d).inp 012056873.td-b3lyp_6-31g+(d).log.xz

012056873.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056873.td-b3lyp_6-31+g(d).gjf (generated)

012056873.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056873.mol 012056873.PUBCHEM 012056873.mol (via Jmol)
012056901.b3lyp_6-31g(d).inp

012056901.b3lyp_6-31g(d).qchem.inp (generated)

012056901.b3lyp_6-31g(d).gjf (generated)

012056901.b3lyp_6-31g(d).firefly.inp (generated)

012056901.b3lyp_6-31g(d).smash.inp (generated)

012056901.b3lyp_6-31g(d).nwchem.inp (generated) 012056901.b3lyp_6-31g(d).log.xz 012056901.mol 012056901.PUBCHEM 012056901.mol (via Jmol)
012056902.b3lyp_6-31g(d).inp

012056902.b3lyp_6-31g(d).qchem.inp (generated)

012056902.b3lyp_6-31g(d).gjf (generated)

012056902.b3lyp_6-31g(d).firefly.inp (generated)

012056902.b3lyp_6-31g(d).smash.inp (generated)

012056902.b3lyp_6-31g(d).nwchem.inp (generated) 012056902.b3lyp_6-31g(d).log.xz 012056902.td-b3lyp_6-31g+(d).inp 012056902.td-b3lyp_6-31g+(d).log.xz

012056902.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056902.td-b3lyp_6-31+g(d).gjf (generated)

012056902.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056902.mol 012056902.PUBCHEM 012056902.mol (via Jmol)
012056903.b3lyp_6-31g(d).inp

012056903.b3lyp_6-31g(d).qchem.inp (generated)

012056903.b3lyp_6-31g(d).gjf (generated)

012056903.b3lyp_6-31g(d).firefly.inp (generated)

012056903.b3lyp_6-31g(d).smash.inp (generated)

012056903.b3lyp_6-31g(d).nwchem.inp (generated) 012056903.b3lyp_6-31g(d).log.xz 012056903.td-b3lyp_6-31g+(d).inp 012056903.td-b3lyp_6-31g+(d).log.xz

012056903.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056903.td-b3lyp_6-31+g(d).gjf (generated)

012056903.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056903.mol 012056903.PUBCHEM 012056903.mol (via Jmol)
012056904.b3lyp_6-31g(d).inp

012056904.b3lyp_6-31g(d).qchem.inp (generated)

012056904.b3lyp_6-31g(d).gjf (generated)

012056904.b3lyp_6-31g(d).firefly.inp (generated)

012056904.b3lyp_6-31g(d).smash.inp (generated)

012056904.b3lyp_6-31g(d).nwchem.inp (generated) 012056904.b3lyp_6-31g(d).log.xz 012056904.td-b3lyp_6-31g+(d).inp 012056904.td-b3lyp_6-31g+(d).log.xz

012056904.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056904.td-b3lyp_6-31+g(d).gjf (generated)

012056904.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056904.mol 012056904.PUBCHEM 012056904.mol (via Jmol)
012056905.b3lyp_6-31g(d).inp

012056905.b3lyp_6-31g(d).qchem.inp (generated)

012056905.b3lyp_6-31g(d).gjf (generated)

012056905.b3lyp_6-31g(d).firefly.inp (generated)

012056905.b3lyp_6-31g(d).smash.inp (generated)

012056905.b3lyp_6-31g(d).nwchem.inp (generated) 012056905.b3lyp_6-31g(d).log.xz 012056905.td-b3lyp_6-31g+(d).inp 012056905.td-b3lyp_6-31g+(d).log.xz

012056905.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056905.td-b3lyp_6-31+g(d).gjf (generated)

012056905.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056905.mol 012056905.PUBCHEM 012056905.mol (via Jmol)
012056926.b3lyp_6-31g(d).inp

012056926.b3lyp_6-31g(d).qchem.inp (generated)

012056926.b3lyp_6-31g(d).gjf (generated)

012056926.b3lyp_6-31g(d).firefly.inp (generated)

012056926.b3lyp_6-31g(d).smash.inp (generated)

012056926.b3lyp_6-31g(d).nwchem.inp (generated) 012056926.b3lyp_6-31g(d).log.xz 012056926.td-b3lyp_6-31g+(d).inp 012056926.td-b3lyp_6-31g+(d).log.xz

012056926.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056926.td-b3lyp_6-31+g(d).gjf (generated)

012056926.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056926.mol 012056926.PUBCHEM 012056926.mol (via Jmol)
012056927.b3lyp_6-31g(d).inp

012056927.b3lyp_6-31g(d).qchem.inp (generated)

012056927.b3lyp_6-31g(d).gjf (generated)

012056927.b3lyp_6-31g(d).firefly.inp (generated)

012056927.b3lyp_6-31g(d).smash.inp (generated)

012056927.b3lyp_6-31g(d).nwchem.inp (generated) 012056927.b3lyp_6-31g(d).log.xz 012056927.mol 012056927.PUBCHEM 012056927.mol (via Jmol)
012056941.b3lyp_6-31g(d).inp

012056941.b3lyp_6-31g(d).qchem.inp (generated)

012056941.b3lyp_6-31g(d).gjf (generated)

012056941.b3lyp_6-31g(d).firefly.inp (generated)

012056941.b3lyp_6-31g(d).smash.inp (generated)

012056941.b3lyp_6-31g(d).nwchem.inp (generated) 012056941.b3lyp_6-31g(d).log.xz 012056941.td-b3lyp_6-31g+(d).inp 012056941.td-b3lyp_6-31g+(d).log.xz

012056941.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056941.td-b3lyp_6-31+g(d).gjf (generated)

012056941.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056941.mol 012056941.PUBCHEM 012056941.mol (via Jmol)
012056942.b3lyp_6-31g(d).inp

012056942.b3lyp_6-31g(d).qchem.inp (generated)

012056942.b3lyp_6-31g(d).gjf (generated)

012056942.b3lyp_6-31g(d).firefly.inp (generated)

012056942.b3lyp_6-31g(d).smash.inp (generated)

012056942.b3lyp_6-31g(d).nwchem.inp (generated) 012056942.b3lyp_6-31g(d).log.xz 012056942.td-b3lyp_6-31g+(d).inp 012056942.td-b3lyp_6-31g+(d).log.xz

012056942.td-b3lyp_6-31+g(d).qchem.inp (generated)

012056942.td-b3lyp_6-31+g(d).gjf (generated)

012056942.td-b3lyp_6-31+g(d).firefly.inp (generated)

012056942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012056942.mol 012056942.PUBCHEM 012056942.mol (via Jmol)
012057007.b3lyp_6-31g(d).inp

012057007.b3lyp_6-31g(d).qchem.inp (generated)

012057007.b3lyp_6-31g(d).gjf (generated)

012057007.b3lyp_6-31g(d).firefly.inp (generated)

012057007.b3lyp_6-31g(d).smash.inp (generated)

012057007.b3lyp_6-31g(d).nwchem.inp (generated) 012057007.b3lyp_6-31g(d).log.xz 012057007.td-b3lyp_6-31g+(d).inp 012057007.td-b3lyp_6-31g+(d).log.xz

012057007.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057007.td-b3lyp_6-31+g(d).gjf (generated)

012057007.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057007.mol 012057007.PUBCHEM 012057007.mol (via Jmol)
012057009.b3lyp_6-31g(d).inp

012057009.b3lyp_6-31g(d).qchem.inp (generated)

012057009.b3lyp_6-31g(d).gjf (generated)

012057009.b3lyp_6-31g(d).firefly.inp (generated)

012057009.b3lyp_6-31g(d).smash.inp (generated)

012057009.b3lyp_6-31g(d).nwchem.inp (generated) 012057009.b3lyp_6-31g(d).log.xz 012057009.mol 012057009.PUBCHEM 012057009.mol (via Jmol)
012057081.b3lyp_6-31g(d).inp

012057081.b3lyp_6-31g(d).qchem.inp (generated)

012057081.b3lyp_6-31g(d).gjf (generated)

012057081.b3lyp_6-31g(d).firefly.inp (generated)

012057081.b3lyp_6-31g(d).smash.inp (generated)

012057081.b3lyp_6-31g(d).nwchem.inp (generated) 012057081.b3lyp_6-31g(d).log.xz 012057081.td-b3lyp_6-31g+(d).inp 012057081.td-b3lyp_6-31g+(d).log.xz

012057081.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057081.td-b3lyp_6-31+g(d).gjf (generated)

012057081.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057081.mol 012057081.PUBCHEM 012057081.mol (via Jmol)
012057098.b3lyp_6-31g(d).inp

012057098.b3lyp_6-31g(d).qchem.inp (generated)

012057098.b3lyp_6-31g(d).gjf (generated)

012057098.b3lyp_6-31g(d).firefly.inp (generated)

012057098.b3lyp_6-31g(d).smash.inp (generated)

012057098.b3lyp_6-31g(d).nwchem.inp (generated) 012057098.b3lyp_6-31g(d).log.xz 012057098.td-b3lyp_6-31g+(d).inp 012057098.td-b3lyp_6-31g+(d).log.xz

012057098.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057098.td-b3lyp_6-31+g(d).gjf (generated)

012057098.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057098.mol 012057098.PUBCHEM 012057098.mol (via Jmol)
012057099.b3lyp_6-31g(d).inp

012057099.b3lyp_6-31g(d).qchem.inp (generated)

012057099.b3lyp_6-31g(d).gjf (generated)

012057099.b3lyp_6-31g(d).firefly.inp (generated)

012057099.b3lyp_6-31g(d).smash.inp (generated)

012057099.b3lyp_6-31g(d).nwchem.inp (generated) 012057099.b3lyp_6-31g(d).log.xz 012057099.td-b3lyp_6-31g+(d).inp 012057099.td-b3lyp_6-31g+(d).log.xz

012057099.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057099.td-b3lyp_6-31+g(d).gjf (generated)

012057099.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057099.mol 012057099.PUBCHEM 012057099.mol (via Jmol)
012057100.b3lyp_6-31g(d).inp

012057100.b3lyp_6-31g(d).qchem.inp (generated)

012057100.b3lyp_6-31g(d).gjf (generated)

012057100.b3lyp_6-31g(d).firefly.inp (generated)

012057100.b3lyp_6-31g(d).smash.inp (generated)

012057100.b3lyp_6-31g(d).nwchem.inp (generated) 012057100.b3lyp_6-31g(d).log.xz 012057100.td-b3lyp_6-31g+(d).inp 012057100.td-b3lyp_6-31g+(d).log.xz

012057100.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057100.td-b3lyp_6-31+g(d).gjf (generated)

012057100.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057100.mol 012057100.PUBCHEM 012057100.mol (via Jmol)
012057110.b3lyp_6-31g(d).inp

012057110.b3lyp_6-31g(d).qchem.inp (generated)

012057110.b3lyp_6-31g(d).gjf (generated)

012057110.b3lyp_6-31g(d).firefly.inp (generated)

012057110.b3lyp_6-31g(d).smash.inp (generated)

012057110.b3lyp_6-31g(d).nwchem.inp (generated) 012057110.b3lyp_6-31g(d).log.xz 012057110.td-b3lyp_6-31g+(d).inp 012057110.td-b3lyp_6-31g+(d).log.xz

012057110.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057110.td-b3lyp_6-31+g(d).gjf (generated)

012057110.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057110.mol 012057110.PUBCHEM 012057110.mol (via Jmol)
012057120.b3lyp_6-31g(d).inp

012057120.b3lyp_6-31g(d).qchem.inp (generated)

012057120.b3lyp_6-31g(d).gjf (generated)

012057120.b3lyp_6-31g(d).firefly.inp (generated)

012057120.b3lyp_6-31g(d).smash.inp (generated)

012057120.b3lyp_6-31g(d).nwchem.inp (generated) 012057120.b3lyp_6-31g(d).log.xz 012057120.td-b3lyp_6-31g+(d).inp 012057120.td-b3lyp_6-31g+(d).log.xz

012057120.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057120.td-b3lyp_6-31+g(d).gjf (generated)

012057120.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057120.mol 012057120.PUBCHEM 012057120.mol (via Jmol)
012057122.b3lyp_6-31g(d).inp

012057122.b3lyp_6-31g(d).qchem.inp (generated)

012057122.b3lyp_6-31g(d).gjf (generated)

012057122.b3lyp_6-31g(d).firefly.inp (generated)

012057122.b3lyp_6-31g(d).smash.inp (generated)

012057122.b3lyp_6-31g(d).nwchem.inp (generated) 012057122.b3lyp_6-31g(d).log.xz 012057122.td-b3lyp_6-31g+(d).inp 012057122.td-b3lyp_6-31g+(d).log.xz

012057122.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057122.td-b3lyp_6-31+g(d).gjf (generated)

012057122.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057122.mol 012057122.PUBCHEM 012057122.mol (via Jmol)
012057126.b3lyp_6-31g(d).inp

012057126.b3lyp_6-31g(d).qchem.inp (generated)

012057126.b3lyp_6-31g(d).gjf (generated)

012057126.b3lyp_6-31g(d).firefly.inp (generated)

012057126.b3lyp_6-31g(d).smash.inp (generated)

012057126.b3lyp_6-31g(d).nwchem.inp (generated) 012057126.b3lyp_6-31g(d).log.xz 012057126.td-b3lyp_6-31g+(d).inp 012057126.td-b3lyp_6-31g+(d).log.xz

012057126.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057126.td-b3lyp_6-31+g(d).gjf (generated)

012057126.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057126.mol 012057126.PUBCHEM 012057126.mol (via Jmol)
012057220.b3lyp_6-31g(d).inp

012057220.b3lyp_6-31g(d).qchem.inp (generated)

012057220.b3lyp_6-31g(d).gjf (generated)

012057220.b3lyp_6-31g(d).firefly.inp (generated)

012057220.b3lyp_6-31g(d).smash.inp (generated)

012057220.b3lyp_6-31g(d).nwchem.inp (generated) 012057220.b3lyp_6-31g(d).log.xz 012057220.td-b3lyp_6-31g+(d).inp 012057220.td-b3lyp_6-31g+(d).log.xz

012057220.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057220.td-b3lyp_6-31+g(d).gjf (generated)

012057220.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057220.mol 012057220.PUBCHEM 012057220.mol (via Jmol)
012057246.b3lyp_6-31g(d).inp

012057246.b3lyp_6-31g(d).qchem.inp (generated)

012057246.b3lyp_6-31g(d).gjf (generated)

012057246.b3lyp_6-31g(d).firefly.inp (generated)

012057246.b3lyp_6-31g(d).smash.inp (generated)

012057246.b3lyp_6-31g(d).nwchem.inp (generated) 012057246.b3lyp_6-31g(d).log.xz 012057246.td-b3lyp_6-31g+(d).inp 012057246.td-b3lyp_6-31g+(d).log.xz

012057246.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057246.td-b3lyp_6-31+g(d).gjf (generated)

012057246.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057246.mol 012057246.PUBCHEM 012057246.mol (via Jmol)
012057247.b3lyp_6-31g(d).inp

012057247.b3lyp_6-31g(d).qchem.inp (generated)

012057247.b3lyp_6-31g(d).gjf (generated)

012057247.b3lyp_6-31g(d).firefly.inp (generated)

012057247.b3lyp_6-31g(d).smash.inp (generated)

012057247.b3lyp_6-31g(d).nwchem.inp (generated) 012057247.b3lyp_6-31g(d).log.xz 012057247.td-b3lyp_6-31g+(d).inp 012057247.td-b3lyp_6-31g+(d).log.xz

012057247.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057247.td-b3lyp_6-31+g(d).gjf (generated)

012057247.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057247.mol 012057247.PUBCHEM 012057247.mol (via Jmol)
012057248.b3lyp_6-31g(d).inp

012057248.b3lyp_6-31g(d).qchem.inp (generated)

012057248.b3lyp_6-31g(d).gjf (generated)

012057248.b3lyp_6-31g(d).firefly.inp (generated)

012057248.b3lyp_6-31g(d).smash.inp (generated)

012057248.b3lyp_6-31g(d).nwchem.inp (generated) 012057248.b3lyp_6-31g(d).log.xz 012057248.td-b3lyp_6-31g+(d).inp 012057248.td-b3lyp_6-31g+(d).log.xz

012057248.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057248.td-b3lyp_6-31+g(d).gjf (generated)

012057248.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057248.mol 012057248.PUBCHEM 012057248.mol (via Jmol)
012057259.b3lyp_6-31g(d).inp

012057259.b3lyp_6-31g(d).qchem.inp (generated)

012057259.b3lyp_6-31g(d).gjf (generated)

012057259.b3lyp_6-31g(d).firefly.inp (generated)

012057259.b3lyp_6-31g(d).smash.inp (generated)

012057259.b3lyp_6-31g(d).nwchem.inp (generated) 012057259.b3lyp_6-31g(d).log.xz 012057259.td-b3lyp_6-31g+(d).inp 012057259.td-b3lyp_6-31g+(d).log.xz

012057259.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057259.td-b3lyp_6-31+g(d).gjf (generated)

012057259.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057259.mol 012057259.PUBCHEM 012057259.mol (via Jmol)
012057381.b3lyp_6-31g(d).inp

012057381.b3lyp_6-31g(d).qchem.inp (generated)

012057381.b3lyp_6-31g(d).gjf (generated)

012057381.b3lyp_6-31g(d).firefly.inp (generated)

012057381.b3lyp_6-31g(d).smash.inp (generated)

012057381.b3lyp_6-31g(d).nwchem.inp (generated) 012057381.b3lyp_6-31g(d).log.xz 012057381.td-b3lyp_6-31g+(d).inp 012057381.td-b3lyp_6-31g+(d).log.xz

012057381.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057381.td-b3lyp_6-31+g(d).gjf (generated)

012057381.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057381.mol 012057381.PUBCHEM 012057381.mol (via Jmol)
012057388.b3lyp_6-31g(d).inp

012057388.b3lyp_6-31g(d).qchem.inp (generated)

012057388.b3lyp_6-31g(d).gjf (generated)

012057388.b3lyp_6-31g(d).firefly.inp (generated)

012057388.b3lyp_6-31g(d).smash.inp (generated)

012057388.b3lyp_6-31g(d).nwchem.inp (generated) 012057388.b3lyp_6-31g(d).log.xz 012057388.td-b3lyp_6-31g+(d).inp 012057388.td-b3lyp_6-31g+(d).log.xz

012057388.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057388.td-b3lyp_6-31+g(d).gjf (generated)

012057388.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057388.mol 012057388.PUBCHEM 012057388.mol (via Jmol)
012057397.b3lyp_6-31g(d).inp

012057397.b3lyp_6-31g(d).qchem.inp (generated)

012057397.b3lyp_6-31g(d).gjf (generated)

012057397.b3lyp_6-31g(d).firefly.inp (generated)

012057397.b3lyp_6-31g(d).smash.inp (generated)

012057397.b3lyp_6-31g(d).nwchem.inp (generated) 012057397.b3lyp_6-31g(d).log.xz 012057397.td-b3lyp_6-31g+(d).inp 012057397.td-b3lyp_6-31g+(d).log.xz

012057397.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057397.td-b3lyp_6-31+g(d).gjf (generated)

012057397.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057397.mol 012057397.PUBCHEM 012057397.mol (via Jmol)
012057465.b3lyp_6-31g(d).inp

012057465.b3lyp_6-31g(d).qchem.inp (generated)

012057465.b3lyp_6-31g(d).gjf (generated)

012057465.b3lyp_6-31g(d).firefly.inp (generated)

012057465.b3lyp_6-31g(d).smash.inp (generated)

012057465.b3lyp_6-31g(d).nwchem.inp (generated) 012057465.b3lyp_6-31g(d).log.xz 012057465.mol 012057465.PUBCHEM 012057465.mol (via Jmol)
012057467.b3lyp_6-31g(d).inp

012057467.b3lyp_6-31g(d).qchem.inp (generated)

012057467.b3lyp_6-31g(d).gjf (generated)

012057467.b3lyp_6-31g(d).firefly.inp (generated)

012057467.b3lyp_6-31g(d).smash.inp (generated)

012057467.b3lyp_6-31g(d).nwchem.inp (generated) 012057467.b3lyp_6-31g(d).log.xz 012057467.td-b3lyp_6-31g+(d).inp 012057467.td-b3lyp_6-31g+(d).log.xz

012057467.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057467.td-b3lyp_6-31+g(d).gjf (generated)

012057467.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057467.mol 012057467.PUBCHEM 012057467.mol (via Jmol)
012057519.b3lyp_6-31g(d).inp

012057519.b3lyp_6-31g(d).qchem.inp (generated)

012057519.b3lyp_6-31g(d).gjf (generated)

012057519.b3lyp_6-31g(d).firefly.inp (generated)

012057519.b3lyp_6-31g(d).smash.inp (generated)

012057519.b3lyp_6-31g(d).nwchem.inp (generated) 012057519.b3lyp_6-31g(d).log.xz 012057519.td-b3lyp_6-31g+(d).inp 012057519.td-b3lyp_6-31g+(d).log.xz

012057519.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057519.td-b3lyp_6-31+g(d).gjf (generated)

012057519.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057519.mol 012057519.PUBCHEM 012057519.mol (via Jmol)
012057537.b3lyp_6-31g(d).inp

012057537.b3lyp_6-31g(d).qchem.inp (generated)

012057537.b3lyp_6-31g(d).gjf (generated)

012057537.b3lyp_6-31g(d).firefly.inp (generated)

012057537.b3lyp_6-31g(d).smash.inp (generated)

012057537.b3lyp_6-31g(d).nwchem.inp (generated) 012057537.b3lyp_6-31g(d).log.xz 012057537.td-b3lyp_6-31g+(d).inp 012057537.td-b3lyp_6-31g+(d).log.xz

012057537.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057537.td-b3lyp_6-31+g(d).gjf (generated)

012057537.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057537.mol 012057537.PUBCHEM 012057537.mol (via Jmol)
012057545.b3lyp_6-31g(d).inp

012057545.b3lyp_6-31g(d).qchem.inp (generated)

012057545.b3lyp_6-31g(d).gjf (generated)

012057545.b3lyp_6-31g(d).firefly.inp (generated)

012057545.b3lyp_6-31g(d).smash.inp (generated)

012057545.b3lyp_6-31g(d).nwchem.inp (generated) 012057545.b3lyp_6-31g(d).log.xz 012057545.td-b3lyp_6-31g+(d).inp 012057545.td-b3lyp_6-31g+(d).log.xz

012057545.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057545.td-b3lyp_6-31+g(d).gjf (generated)

012057545.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057545.mol 012057545.PUBCHEM 012057545.mol (via Jmol)
012057559.b3lyp_6-31g(d).inp

012057559.b3lyp_6-31g(d).qchem.inp (generated)

012057559.b3lyp_6-31g(d).gjf (generated)

012057559.b3lyp_6-31g(d).firefly.inp (generated)

012057559.b3lyp_6-31g(d).smash.inp (generated)

012057559.b3lyp_6-31g(d).nwchem.inp (generated) 012057559.b3lyp_6-31g(d).log.xz 012057559.td-b3lyp_6-31g+(d).inp 012057559.td-b3lyp_6-31g+(d).log.xz

012057559.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057559.td-b3lyp_6-31+g(d).gjf (generated)

012057559.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057559.mol 012057559.PUBCHEM 012057559.mol (via Jmol)
012057593.b3lyp_6-31g(d).inp

012057593.b3lyp_6-31g(d).qchem.inp (generated)

012057593.b3lyp_6-31g(d).gjf (generated)

012057593.b3lyp_6-31g(d).firefly.inp (generated)

012057593.b3lyp_6-31g(d).smash.inp (generated)

012057593.b3lyp_6-31g(d).nwchem.inp (generated) 012057593.b3lyp_6-31g(d).log.xz 012057593.td-b3lyp_6-31g+(d).inp 012057593.td-b3lyp_6-31g+(d).log.xz

012057593.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057593.td-b3lyp_6-31+g(d).gjf (generated)

012057593.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057593.mol 012057593.PUBCHEM 012057593.mol (via Jmol)
012057845.b3lyp_6-31g(d).inp

012057845.b3lyp_6-31g(d).qchem.inp (generated)

012057845.b3lyp_6-31g(d).gjf (generated)

012057845.b3lyp_6-31g(d).firefly.inp (generated)

012057845.b3lyp_6-31g(d).smash.inp (generated)

012057845.b3lyp_6-31g(d).nwchem.inp (generated) 012057845.b3lyp_6-31g(d).log.xz 012057845.td-b3lyp_6-31g+(d).inp 012057845.td-b3lyp_6-31g+(d).log.xz

012057845.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057845.td-b3lyp_6-31+g(d).gjf (generated)

012057845.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057845.mol 012057845.PUBCHEM 012057845.mol (via Jmol)
012057941.b3lyp_6-31g(d).inp

012057941.b3lyp_6-31g(d).qchem.inp (generated)

012057941.b3lyp_6-31g(d).gjf (generated)

012057941.b3lyp_6-31g(d).firefly.inp (generated)

012057941.b3lyp_6-31g(d).smash.inp (generated)

012057941.b3lyp_6-31g(d).nwchem.inp (generated) 012057941.b3lyp_6-31g(d).log.xz 012057941.td-b3lyp_6-31g+(d).inp 012057941.td-b3lyp_6-31g+(d).log.xz

012057941.td-b3lyp_6-31+g(d).qchem.inp (generated)

012057941.td-b3lyp_6-31+g(d).gjf (generated)

012057941.td-b3lyp_6-31+g(d).firefly.inp (generated)

012057941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012057941.mol 012057941.PUBCHEM 012057941.mol (via Jmol)
012057948.b3lyp_6-31g(d).inp

012057948.b3lyp_6-31g(d).qchem.inp (generated)

012057948.b3lyp_6-31g(d).gjf (generated)

012057948.b3lyp_6-31g(d).firefly.inp (generated)

012057948.b3lyp_6-31g(d).smash.inp (generated)

012057948.b3lyp_6-31g(d).nwchem.inp (generated) 012057948.b3lyp_6-31g(d).log.xz 012057948.mol 012057948.PUBCHEM 012057948.mol (via Jmol)
012058167.b3lyp_6-31g(d).inp

012058167.b3lyp_6-31g(d).qchem.inp (generated)

012058167.b3lyp_6-31g(d).gjf (generated)

012058167.b3lyp_6-31g(d).firefly.inp (generated)

012058167.b3lyp_6-31g(d).smash.inp (generated)

012058167.b3lyp_6-31g(d).nwchem.inp (generated) 012058167.b3lyp_6-31g(d).log.xz 012058167.td-b3lyp_6-31g+(d).inp 012058167.td-b3lyp_6-31g+(d).log.xz

012058167.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058167.td-b3lyp_6-31+g(d).gjf (generated)

012058167.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058167.mol 012058167.PUBCHEM 012058167.mol (via Jmol)
012058256.b3lyp_6-31g(d).inp

012058256.b3lyp_6-31g(d).qchem.inp (generated)

012058256.b3lyp_6-31g(d).gjf (generated)

012058256.b3lyp_6-31g(d).firefly.inp (generated)

012058256.b3lyp_6-31g(d).smash.inp (generated)

012058256.b3lyp_6-31g(d).nwchem.inp (generated) 012058256.b3lyp_6-31g(d).log.xz 012058256.td-b3lyp_6-31g+(d).inp 012058256.td-b3lyp_6-31g+(d).log.xz

012058256.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058256.td-b3lyp_6-31+g(d).gjf (generated)

012058256.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058256.mol 012058256.PUBCHEM 012058256.mol (via Jmol)
012058275.b3lyp_6-31g(d).inp

012058275.b3lyp_6-31g(d).qchem.inp (generated)

012058275.b3lyp_6-31g(d).gjf (generated)

012058275.b3lyp_6-31g(d).firefly.inp (generated)

012058275.b3lyp_6-31g(d).smash.inp (generated)

012058275.b3lyp_6-31g(d).nwchem.inp (generated) 012058275.b3lyp_6-31g(d).log.xz 012058275.td-b3lyp_6-31g+(d).inp 012058275.td-b3lyp_6-31g+(d).log.xz

012058275.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058275.td-b3lyp_6-31+g(d).gjf (generated)

012058275.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058275.mol 012058275.PUBCHEM 012058275.mol (via Jmol)
012058299.b3lyp_6-31g(d).inp

012058299.b3lyp_6-31g(d).qchem.inp (generated)

012058299.b3lyp_6-31g(d).gjf (generated)

012058299.b3lyp_6-31g(d).firefly.inp (generated)

012058299.b3lyp_6-31g(d).smash.inp (generated)

012058299.b3lyp_6-31g(d).nwchem.inp (generated) 012058299.b3lyp_6-31g(d).log.xz 012058299.td-b3lyp_6-31g+(d).inp 012058299.td-b3lyp_6-31g+(d).log.xz

012058299.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058299.td-b3lyp_6-31+g(d).gjf (generated)

012058299.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058299.mol 012058299.PUBCHEM 012058299.mol (via Jmol)
012058391.b3lyp_6-31g(d).inp

012058391.b3lyp_6-31g(d).qchem.inp (generated)

012058391.b3lyp_6-31g(d).gjf (generated)

012058391.b3lyp_6-31g(d).firefly.inp (generated)

012058391.b3lyp_6-31g(d).smash.inp (generated)

012058391.b3lyp_6-31g(d).nwchem.inp (generated) 012058391.b3lyp_6-31g(d).log.xz 012058391.td-b3lyp_6-31g+(d).inp 012058391.td-b3lyp_6-31g+(d).log.xz

012058391.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058391.td-b3lyp_6-31+g(d).gjf (generated)

012058391.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058391.mol 012058391.PUBCHEM 012058391.mol (via Jmol)
012058632.b3lyp_6-31g(d).inp

012058632.b3lyp_6-31g(d).qchem.inp (generated)

012058632.b3lyp_6-31g(d).gjf (generated)

012058632.b3lyp_6-31g(d).firefly.inp (generated)

012058632.b3lyp_6-31g(d).smash.inp (generated)

012058632.b3lyp_6-31g(d).nwchem.inp (generated) 012058632.b3lyp_6-31g(d).log.xz 012058632.td-b3lyp_6-31g+(d).inp 012058632.td-b3lyp_6-31g+(d).log.xz

012058632.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058632.td-b3lyp_6-31+g(d).gjf (generated)

012058632.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058632.mol 012058632.PUBCHEM 012058632.mol (via Jmol)
012058670.b3lyp_6-31g(d).inp

012058670.b3lyp_6-31g(d).qchem.inp (generated)

012058670.b3lyp_6-31g(d).gjf (generated)

012058670.b3lyp_6-31g(d).firefly.inp (generated)

012058670.b3lyp_6-31g(d).smash.inp (generated)

012058670.b3lyp_6-31g(d).nwchem.inp (generated) 012058670.b3lyp_6-31g(d).log.xz 012058670.mol 012058670.PUBCHEM 012058670.mol (via Jmol)
012058695.b3lyp_6-31g(d).inp

012058695.b3lyp_6-31g(d).qchem.inp (generated)

012058695.b3lyp_6-31g(d).gjf (generated)

012058695.b3lyp_6-31g(d).firefly.inp (generated)

012058695.b3lyp_6-31g(d).smash.inp (generated)

012058695.b3lyp_6-31g(d).nwchem.inp (generated) 012058695.b3lyp_6-31g(d).log.xz 012058695.td-b3lyp_6-31g+(d).inp 012058695.td-b3lyp_6-31g+(d).log.xz

012058695.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058695.td-b3lyp_6-31+g(d).gjf (generated)

012058695.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058695.mol 012058695.PUBCHEM 012058695.mol (via Jmol)
012058782.b3lyp_6-31g(d).inp

012058782.b3lyp_6-31g(d).qchem.inp (generated)

012058782.b3lyp_6-31g(d).gjf (generated)

012058782.b3lyp_6-31g(d).firefly.inp (generated)

012058782.b3lyp_6-31g(d).smash.inp (generated)

012058782.b3lyp_6-31g(d).nwchem.inp (generated) 012058782.b3lyp_6-31g(d).log.xz 012058782.td-b3lyp_6-31g+(d).inp 012058782.td-b3lyp_6-31g+(d).log.xz

012058782.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058782.td-b3lyp_6-31+g(d).gjf (generated)

012058782.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058782.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058782.mol 012058782.PUBCHEM 012058782.mol (via Jmol)
012058803.b3lyp_6-31g(d).inp

012058803.b3lyp_6-31g(d).qchem.inp (generated)

012058803.b3lyp_6-31g(d).gjf (generated)

012058803.b3lyp_6-31g(d).firefly.inp (generated)

012058803.b3lyp_6-31g(d).smash.inp (generated)

012058803.b3lyp_6-31g(d).nwchem.inp (generated) 012058803.b3lyp_6-31g(d).log.xz 012058803.td-b3lyp_6-31g+(d).inp 012058803.td-b3lyp_6-31g+(d).log.xz

012058803.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058803.td-b3lyp_6-31+g(d).gjf (generated)

012058803.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058803.mol 012058803.PUBCHEM 012058803.mol (via Jmol)
012058857.b3lyp_6-31g(d).inp

012058857.b3lyp_6-31g(d).qchem.inp (generated)

012058857.b3lyp_6-31g(d).gjf (generated)

012058857.b3lyp_6-31g(d).firefly.inp (generated)

012058857.b3lyp_6-31g(d).smash.inp (generated)

012058857.b3lyp_6-31g(d).nwchem.inp (generated) 012058857.b3lyp_6-31g(d).log.xz 012058857.td-b3lyp_6-31g+(d).inp 012058857.td-b3lyp_6-31g+(d).log.xz

012058857.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058857.td-b3lyp_6-31+g(d).gjf (generated)

012058857.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058857.mol 012058857.PUBCHEM 012058857.mol (via Jmol)
012058934.b3lyp_6-31g(d).inp

012058934.b3lyp_6-31g(d).qchem.inp (generated)

012058934.b3lyp_6-31g(d).gjf (generated)

012058934.b3lyp_6-31g(d).firefly.inp (generated)

012058934.b3lyp_6-31g(d).smash.inp (generated)

012058934.b3lyp_6-31g(d).nwchem.inp (generated) 012058934.b3lyp_6-31g(d).log.xz 012058934.td-b3lyp_6-31g+(d).inp 012058934.td-b3lyp_6-31g+(d).log.xz

012058934.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058934.td-b3lyp_6-31+g(d).gjf (generated)

012058934.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058934.mol 012058934.PUBCHEM 012058934.mol (via Jmol)
012058938.b3lyp_6-31g(d).inp

012058938.b3lyp_6-31g(d).qchem.inp (generated)

012058938.b3lyp_6-31g(d).gjf (generated)

012058938.b3lyp_6-31g(d).firefly.inp (generated)

012058938.b3lyp_6-31g(d).smash.inp (generated)

012058938.b3lyp_6-31g(d).nwchem.inp (generated) 012058938.b3lyp_6-31g(d).log.xz 012058938.td-b3lyp_6-31g+(d).inp 012058938.td-b3lyp_6-31g+(d).log.xz

012058938.td-b3lyp_6-31+g(d).qchem.inp (generated)

012058938.td-b3lyp_6-31+g(d).gjf (generated)

012058938.td-b3lyp_6-31+g(d).firefly.inp (generated)

012058938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012058938.mol 012058938.PUBCHEM 012058938.mol (via Jmol)
012059093.b3lyp_6-31g(d).inp

012059093.b3lyp_6-31g(d).qchem.inp (generated)

012059093.b3lyp_6-31g(d).gjf (generated)

012059093.b3lyp_6-31g(d).firefly.inp (generated)

012059093.b3lyp_6-31g(d).smash.inp (generated)

012059093.b3lyp_6-31g(d).nwchem.inp (generated) 012059093.b3lyp_6-31g(d).log.xz 012059093.td-b3lyp_6-31g+(d).inp 012059093.td-b3lyp_6-31g+(d).log.xz

012059093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059093.td-b3lyp_6-31+g(d).gjf (generated)

012059093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059093.mol 012059093.PUBCHEM 012059093.mol (via Jmol)
012059143.b3lyp_6-31g(d).inp

012059143.b3lyp_6-31g(d).qchem.inp (generated)

012059143.b3lyp_6-31g(d).gjf (generated)

012059143.b3lyp_6-31g(d).firefly.inp (generated)

012059143.b3lyp_6-31g(d).smash.inp (generated)

012059143.b3lyp_6-31g(d).nwchem.inp (generated) 012059143.b3lyp_6-31g(d).log.xz 012059143.td-b3lyp_6-31g+(d).inp 012059143.td-b3lyp_6-31g+(d).log.xz

012059143.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059143.td-b3lyp_6-31+g(d).gjf (generated)

012059143.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059143.mol 012059143.PUBCHEM 012059143.mol (via Jmol)
012059217.b3lyp_6-31g(d).inp

012059217.b3lyp_6-31g(d).qchem.inp (generated)

012059217.b3lyp_6-31g(d).gjf (generated)

012059217.b3lyp_6-31g(d).firefly.inp (generated)

012059217.b3lyp_6-31g(d).smash.inp (generated)

012059217.b3lyp_6-31g(d).nwchem.inp (generated) 012059217.b3lyp_6-31g(d).log.xz 012059217.td-b3lyp_6-31g+(d).inp 012059217.td-b3lyp_6-31g+(d).log.xz

012059217.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059217.td-b3lyp_6-31+g(d).gjf (generated)

012059217.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059217.mol 012059217.PUBCHEM 012059217.mol (via Jmol)
012059334.b3lyp_6-31g(d).inp

012059334.b3lyp_6-31g(d).qchem.inp (generated)

012059334.b3lyp_6-31g(d).gjf (generated)

012059334.b3lyp_6-31g(d).firefly.inp (generated)

012059334.b3lyp_6-31g(d).smash.inp (generated)

012059334.b3lyp_6-31g(d).nwchem.inp (generated) 012059334.b3lyp_6-31g(d).log.xz 012059334.td-b3lyp_6-31g+(d).inp 012059334.td-b3lyp_6-31g+(d).log.xz

012059334.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059334.td-b3lyp_6-31+g(d).gjf (generated)

012059334.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059334.mol 012059334.PUBCHEM 012059334.mol (via Jmol)
012059342.b3lyp_6-31g(d).inp

012059342.b3lyp_6-31g(d).qchem.inp (generated)

012059342.b3lyp_6-31g(d).gjf (generated)

012059342.b3lyp_6-31g(d).firefly.inp (generated)

012059342.b3lyp_6-31g(d).smash.inp (generated)

012059342.b3lyp_6-31g(d).nwchem.inp (generated) 012059342.b3lyp_6-31g(d).log.xz 012059342.mol 012059342.PUBCHEM 012059342.mol (via Jmol)
012059357.b3lyp_6-31g(d).inp

012059357.b3lyp_6-31g(d).qchem.inp (generated)

012059357.b3lyp_6-31g(d).gjf (generated)

012059357.b3lyp_6-31g(d).firefly.inp (generated)

012059357.b3lyp_6-31g(d).smash.inp (generated)

012059357.b3lyp_6-31g(d).nwchem.inp (generated) 012059357.b3lyp_6-31g(d).log.xz 012059357.td-b3lyp_6-31g+(d).inp 012059357.td-b3lyp_6-31g+(d).log.xz

012059357.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059357.td-b3lyp_6-31+g(d).gjf (generated)

012059357.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059357.mol 012059357.PUBCHEM 012059357.mol (via Jmol)
012059583.b3lyp_6-31g(d).inp

012059583.b3lyp_6-31g(d).qchem.inp (generated)

012059583.b3lyp_6-31g(d).gjf (generated)

012059583.b3lyp_6-31g(d).firefly.inp (generated)

012059583.b3lyp_6-31g(d).smash.inp (generated)

012059583.b3lyp_6-31g(d).nwchem.inp (generated) 012059583.b3lyp_6-31g(d).log.xz 012059583.td-b3lyp_6-31g+(d).inp 012059583.td-b3lyp_6-31g+(d).log.xz

012059583.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059583.td-b3lyp_6-31+g(d).gjf (generated)

012059583.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059583.mol 012059583.PUBCHEM 012059583.mol (via Jmol)
012059680.b3lyp_6-31g(d).inp

012059680.b3lyp_6-31g(d).qchem.inp (generated)

012059680.b3lyp_6-31g(d).gjf (generated)

012059680.b3lyp_6-31g(d).firefly.inp (generated)

012059680.b3lyp_6-31g(d).smash.inp (generated)

012059680.b3lyp_6-31g(d).nwchem.inp (generated) 012059680.b3lyp_6-31g(d).log.xz 012059680.td-b3lyp_6-31g+(d).inp 012059680.td-b3lyp_6-31g+(d).log.xz

012059680.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059680.td-b3lyp_6-31+g(d).gjf (generated)

012059680.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059680.mol 012059680.PUBCHEM 012059680.mol (via Jmol)
012059829.b3lyp_6-31g(d).inp

012059829.b3lyp_6-31g(d).qchem.inp (generated)

012059829.b3lyp_6-31g(d).gjf (generated)

012059829.b3lyp_6-31g(d).firefly.inp (generated)

012059829.b3lyp_6-31g(d).smash.inp (generated)

012059829.b3lyp_6-31g(d).nwchem.inp (generated) 012059829.b3lyp_6-31g(d).log.xz 012059829.td-b3lyp_6-31g+(d).inp 012059829.td-b3lyp_6-31g+(d).log.xz

012059829.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059829.td-b3lyp_6-31+g(d).gjf (generated)

012059829.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059829.mol 012059829.PUBCHEM 012059829.mol (via Jmol)
012059830.b3lyp_6-31g(d).inp

012059830.b3lyp_6-31g(d).qchem.inp (generated)

012059830.b3lyp_6-31g(d).gjf (generated)

012059830.b3lyp_6-31g(d).firefly.inp (generated)

012059830.b3lyp_6-31g(d).smash.inp (generated)

012059830.b3lyp_6-31g(d).nwchem.inp (generated) 012059830.b3lyp_6-31g(d).log.xz 012059830.td-b3lyp_6-31g+(d).inp 012059830.td-b3lyp_6-31g+(d).log.xz

012059830.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059830.td-b3lyp_6-31+g(d).gjf (generated)

012059830.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059830.mol 012059830.PUBCHEM 012059830.mol (via Jmol)
012059835.b3lyp_6-31g(d).inp

012059835.b3lyp_6-31g(d).qchem.inp (generated)

012059835.b3lyp_6-31g(d).gjf (generated)

012059835.b3lyp_6-31g(d).firefly.inp (generated)

012059835.b3lyp_6-31g(d).smash.inp (generated)

012059835.b3lyp_6-31g(d).nwchem.inp (generated) 012059835.b3lyp_6-31g(d).log.xz 012059835.td-b3lyp_6-31g+(d).inp 012059835.td-b3lyp_6-31g+(d).log.xz

012059835.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059835.td-b3lyp_6-31+g(d).gjf (generated)

012059835.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059835.mol 012059835.PUBCHEM 012059835.mol (via Jmol)
012059836.b3lyp_6-31g(d).inp

012059836.b3lyp_6-31g(d).qchem.inp (generated)

012059836.b3lyp_6-31g(d).gjf (generated)

012059836.b3lyp_6-31g(d).firefly.inp (generated)

012059836.b3lyp_6-31g(d).smash.inp (generated)

012059836.b3lyp_6-31g(d).nwchem.inp (generated) 012059836.b3lyp_6-31g(d).log.xz 012059836.td-b3lyp_6-31g+(d).inp 012059836.td-b3lyp_6-31g+(d).log.xz

012059836.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059836.td-b3lyp_6-31+g(d).gjf (generated)

012059836.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059836.mol 012059836.PUBCHEM 012059836.mol (via Jmol)
012059838.b3lyp_6-31g(d).inp

012059838.b3lyp_6-31g(d).qchem.inp (generated)

012059838.b3lyp_6-31g(d).gjf (generated)

012059838.b3lyp_6-31g(d).firefly.inp (generated)

012059838.b3lyp_6-31g(d).smash.inp (generated)

012059838.b3lyp_6-31g(d).nwchem.inp (generated) 012059838.b3lyp_6-31g(d).log.xz 012059838.td-b3lyp_6-31g+(d).inp 012059838.td-b3lyp_6-31g+(d).log.xz

012059838.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059838.td-b3lyp_6-31+g(d).gjf (generated)

012059838.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059838.mol 012059838.PUBCHEM 012059838.mol (via Jmol)
012059839.b3lyp_6-31g(d).inp

012059839.b3lyp_6-31g(d).qchem.inp (generated)

012059839.b3lyp_6-31g(d).gjf (generated)

012059839.b3lyp_6-31g(d).firefly.inp (generated)

012059839.b3lyp_6-31g(d).smash.inp (generated)

012059839.b3lyp_6-31g(d).nwchem.inp (generated) 012059839.b3lyp_6-31g(d).log.xz 012059839.td-b3lyp_6-31g+(d).inp 012059839.td-b3lyp_6-31g+(d).log.xz

012059839.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059839.td-b3lyp_6-31+g(d).gjf (generated)

012059839.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059839.mol 012059839.PUBCHEM 012059839.mol (via Jmol)
012059840.b3lyp_6-31g(d).inp

012059840.b3lyp_6-31g(d).qchem.inp (generated)

012059840.b3lyp_6-31g(d).gjf (generated)

012059840.b3lyp_6-31g(d).firefly.inp (generated)

012059840.b3lyp_6-31g(d).smash.inp (generated)

012059840.b3lyp_6-31g(d).nwchem.inp (generated) 012059840.b3lyp_6-31g(d).log.xz 012059840.td-b3lyp_6-31g+(d).inp 012059840.td-b3lyp_6-31g+(d).log.xz

012059840.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059840.td-b3lyp_6-31+g(d).gjf (generated)

012059840.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059840.mol 012059840.PUBCHEM 012059840.mol (via Jmol)
012059846.b3lyp_6-31g(d).inp

012059846.b3lyp_6-31g(d).qchem.inp (generated)

012059846.b3lyp_6-31g(d).gjf (generated)

012059846.b3lyp_6-31g(d).firefly.inp (generated)

012059846.b3lyp_6-31g(d).smash.inp (generated)

012059846.b3lyp_6-31g(d).nwchem.inp (generated) 012059846.b3lyp_6-31g(d).log.xz 012059846.mol 012059846.PUBCHEM 012059846.mol (via Jmol)
012059849.b3lyp_6-31g(d).inp

012059849.b3lyp_6-31g(d).qchem.inp (generated)

012059849.b3lyp_6-31g(d).gjf (generated)

012059849.b3lyp_6-31g(d).firefly.inp (generated)

012059849.b3lyp_6-31g(d).smash.inp (generated)

012059849.b3lyp_6-31g(d).nwchem.inp (generated) 012059849.b3lyp_6-31g(d).log.xz 012059849.td-b3lyp_6-31g+(d).inp 012059849.td-b3lyp_6-31g+(d).log.xz

012059849.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059849.td-b3lyp_6-31+g(d).gjf (generated)

012059849.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059849.mol 012059849.PUBCHEM 012059849.mol (via Jmol)
012059883.b3lyp_6-31g(d).inp

012059883.b3lyp_6-31g(d).qchem.inp (generated)

012059883.b3lyp_6-31g(d).gjf (generated)

012059883.b3lyp_6-31g(d).firefly.inp (generated)

012059883.b3lyp_6-31g(d).smash.inp (generated)

012059883.b3lyp_6-31g(d).nwchem.inp (generated) 012059883.b3lyp_6-31g(d).log.xz 012059883.td-b3lyp_6-31g+(d).inp 012059883.td-b3lyp_6-31g+(d).log.xz

012059883.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059883.td-b3lyp_6-31+g(d).gjf (generated)

012059883.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059883.mol 012059883.PUBCHEM 012059883.mol (via Jmol)
012059884.b3lyp_6-31g(d).inp

012059884.b3lyp_6-31g(d).qchem.inp (generated)

012059884.b3lyp_6-31g(d).gjf (generated)

012059884.b3lyp_6-31g(d).firefly.inp (generated)

012059884.b3lyp_6-31g(d).smash.inp (generated)

012059884.b3lyp_6-31g(d).nwchem.inp (generated) 012059884.b3lyp_6-31g(d).log.xz 012059884.td-b3lyp_6-31g+(d).inp 012059884.td-b3lyp_6-31g+(d).log.xz

012059884.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059884.td-b3lyp_6-31+g(d).gjf (generated)

012059884.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059884.mol 012059884.PUBCHEM 012059884.mol (via Jmol)
012059898.b3lyp_6-31g(d).inp

012059898.b3lyp_6-31g(d).qchem.inp (generated)

012059898.b3lyp_6-31g(d).gjf (generated)

012059898.b3lyp_6-31g(d).firefly.inp (generated)

012059898.b3lyp_6-31g(d).smash.inp (generated)

012059898.b3lyp_6-31g(d).nwchem.inp (generated) 012059898.b3lyp_6-31g(d).log.xz 012059898.mol 012059898.PUBCHEM 012059898.mol (via Jmol)
012059918.b3lyp_6-31g(d).inp

012059918.b3lyp_6-31g(d).qchem.inp (generated)

012059918.b3lyp_6-31g(d).gjf (generated)

012059918.b3lyp_6-31g(d).firefly.inp (generated)

012059918.b3lyp_6-31g(d).smash.inp (generated)

012059918.b3lyp_6-31g(d).nwchem.inp (generated) 012059918.b3lyp_6-31g(d).log.xz 012059918.td-b3lyp_6-31g+(d).inp 012059918.td-b3lyp_6-31g+(d).log.xz

012059918.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059918.td-b3lyp_6-31+g(d).gjf (generated)

012059918.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059918.mol 012059918.PUBCHEM 012059918.mol (via Jmol)
012059929.b3lyp_6-31g(d).inp

012059929.b3lyp_6-31g(d).qchem.inp (generated)

012059929.b3lyp_6-31g(d).gjf (generated)

012059929.b3lyp_6-31g(d).firefly.inp (generated)

012059929.b3lyp_6-31g(d).smash.inp (generated)

012059929.b3lyp_6-31g(d).nwchem.inp (generated) 012059929.b3lyp_6-31g(d).log.xz 012059929.td-b3lyp_6-31g+(d).inp 012059929.td-b3lyp_6-31g+(d).log.xz

012059929.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059929.td-b3lyp_6-31+g(d).gjf (generated)

012059929.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059929.mol 012059929.PUBCHEM 012059929.mol (via Jmol)
012059958.b3lyp_6-31g(d).inp

012059958.b3lyp_6-31g(d).qchem.inp (generated)

012059958.b3lyp_6-31g(d).gjf (generated)

012059958.b3lyp_6-31g(d).firefly.inp (generated)

012059958.b3lyp_6-31g(d).smash.inp (generated)

012059958.b3lyp_6-31g(d).nwchem.inp (generated) 012059958.b3lyp_6-31g(d).log.xz 012059958.td-b3lyp_6-31g+(d).inp 012059958.td-b3lyp_6-31g+(d).log.xz

012059958.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059958.td-b3lyp_6-31+g(d).gjf (generated)

012059958.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059958.mol 012059958.PUBCHEM 012059958.mol (via Jmol)
012059960.b3lyp_6-31g(d).inp

012059960.b3lyp_6-31g(d).qchem.inp (generated)

012059960.b3lyp_6-31g(d).gjf (generated)

012059960.b3lyp_6-31g(d).firefly.inp (generated)

012059960.b3lyp_6-31g(d).smash.inp (generated)

012059960.b3lyp_6-31g(d).nwchem.inp (generated) 012059960.b3lyp_6-31g(d).log.xz 012059960.td-b3lyp_6-31g+(d).inp 012059960.td-b3lyp_6-31g+(d).log.xz

012059960.td-b3lyp_6-31+g(d).qchem.inp (generated)

012059960.td-b3lyp_6-31+g(d).gjf (generated)

012059960.td-b3lyp_6-31+g(d).firefly.inp (generated)

012059960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012059960.mol 012059960.PUBCHEM 012059960.mol (via Jmol)
012060008.b3lyp_6-31g(d).inp

012060008.b3lyp_6-31g(d).qchem.inp (generated)

012060008.b3lyp_6-31g(d).gjf (generated)

012060008.b3lyp_6-31g(d).firefly.inp (generated)

012060008.b3lyp_6-31g(d).smash.inp (generated)

012060008.b3lyp_6-31g(d).nwchem.inp (generated) 012060008.b3lyp_6-31g(d).log.xz 012060008.td-b3lyp_6-31g+(d).inp 012060008.td-b3lyp_6-31g+(d).log.xz

012060008.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060008.td-b3lyp_6-31+g(d).gjf (generated)

012060008.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060008.mol 012060008.PUBCHEM 012060008.mol (via Jmol)
012060009.b3lyp_6-31g(d).inp

012060009.b3lyp_6-31g(d).qchem.inp (generated)

012060009.b3lyp_6-31g(d).gjf (generated)

012060009.b3lyp_6-31g(d).firefly.inp (generated)

012060009.b3lyp_6-31g(d).smash.inp (generated)

012060009.b3lyp_6-31g(d).nwchem.inp (generated) 012060009.b3lyp_6-31g(d).log.xz 012060009.td-b3lyp_6-31g+(d).inp 012060009.td-b3lyp_6-31g+(d).log.xz

012060009.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060009.td-b3lyp_6-31+g(d).gjf (generated)

012060009.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060009.mol 012060009.PUBCHEM 012060009.mol (via Jmol)
012060048.b3lyp_6-31g(d).inp

012060048.b3lyp_6-31g(d).qchem.inp (generated)

012060048.b3lyp_6-31g(d).gjf (generated)

012060048.b3lyp_6-31g(d).firefly.inp (generated)

012060048.b3lyp_6-31g(d).smash.inp (generated)

012060048.b3lyp_6-31g(d).nwchem.inp (generated) 012060048.b3lyp_6-31g(d).log.xz 012060048.mol 012060048.PUBCHEM 012060048.mol (via Jmol)
012060097.b3lyp_6-31g(d).inp

012060097.b3lyp_6-31g(d).qchem.inp (generated)

012060097.b3lyp_6-31g(d).gjf (generated)

012060097.b3lyp_6-31g(d).firefly.inp (generated)

012060097.b3lyp_6-31g(d).smash.inp (generated)

012060097.b3lyp_6-31g(d).nwchem.inp (generated) 012060097.b3lyp_6-31g(d).log.xz 012060097.td-b3lyp_6-31g+(d).inp 012060097.td-b3lyp_6-31g+(d).log.xz

012060097.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060097.td-b3lyp_6-31+g(d).gjf (generated)

012060097.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060097.mol 012060097.PUBCHEM 012060097.mol (via Jmol)
012060116.b3lyp_6-31g(d).inp

012060116.b3lyp_6-31g(d).qchem.inp (generated)

012060116.b3lyp_6-31g(d).gjf (generated)

012060116.b3lyp_6-31g(d).firefly.inp (generated)

012060116.b3lyp_6-31g(d).smash.inp (generated)

012060116.b3lyp_6-31g(d).nwchem.inp (generated) 012060116.b3lyp_6-31g(d).log.xz 012060116.td-b3lyp_6-31g+(d).inp 012060116.td-b3lyp_6-31g+(d).log.xz

012060116.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060116.td-b3lyp_6-31+g(d).gjf (generated)

012060116.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060116.mol 012060116.PUBCHEM 012060116.mol (via Jmol)
012060162.b3lyp_6-31g(d).inp

012060162.b3lyp_6-31g(d).qchem.inp (generated)

012060162.b3lyp_6-31g(d).gjf (generated)

012060162.b3lyp_6-31g(d).firefly.inp (generated)

012060162.b3lyp_6-31g(d).smash.inp (generated)

012060162.b3lyp_6-31g(d).nwchem.inp (generated) 012060162.b3lyp_6-31g(d).log.xz 012060162.td-b3lyp_6-31g+(d).inp 012060162.td-b3lyp_6-31g+(d).log.xz

012060162.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060162.td-b3lyp_6-31+g(d).gjf (generated)

012060162.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060162.mol 012060162.PUBCHEM 012060162.mol (via Jmol)
012060164.b3lyp_6-31g(d).inp

012060164.b3lyp_6-31g(d).qchem.inp (generated)

012060164.b3lyp_6-31g(d).gjf (generated)

012060164.b3lyp_6-31g(d).firefly.inp (generated)

012060164.b3lyp_6-31g(d).smash.inp (generated)

012060164.b3lyp_6-31g(d).nwchem.inp (generated) 012060164.b3lyp_6-31g(d).log.xz 012060164.mol 012060164.PUBCHEM 012060164.mol (via Jmol)
012060169.b3lyp_6-31g(d).inp

012060169.b3lyp_6-31g(d).qchem.inp (generated)

012060169.b3lyp_6-31g(d).gjf (generated)

012060169.b3lyp_6-31g(d).firefly.inp (generated)

012060169.b3lyp_6-31g(d).smash.inp (generated)

012060169.b3lyp_6-31g(d).nwchem.inp (generated) 012060169.b3lyp_6-31g(d).log.xz 012060169.td-b3lyp_6-31g+(d).inp 012060169.td-b3lyp_6-31g+(d).log.xz

012060169.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060169.td-b3lyp_6-31+g(d).gjf (generated)

012060169.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060169.mol 012060169.PUBCHEM 012060169.mol (via Jmol)
012060170.b3lyp_6-31g(d).inp

012060170.b3lyp_6-31g(d).qchem.inp (generated)

012060170.b3lyp_6-31g(d).gjf (generated)

012060170.b3lyp_6-31g(d).firefly.inp (generated)

012060170.b3lyp_6-31g(d).smash.inp (generated)

012060170.b3lyp_6-31g(d).nwchem.inp (generated) 012060170.b3lyp_6-31g(d).log.xz 012060170.mol 012060170.PUBCHEM 012060170.mol (via Jmol)
012060192.b3lyp_6-31g(d).inp

012060192.b3lyp_6-31g(d).qchem.inp (generated)

012060192.b3lyp_6-31g(d).gjf (generated)

012060192.b3lyp_6-31g(d).firefly.inp (generated)

012060192.b3lyp_6-31g(d).smash.inp (generated)

012060192.b3lyp_6-31g(d).nwchem.inp (generated) 012060192.b3lyp_6-31g(d).log.xz 012060192.td-b3lyp_6-31g+(d).inp 012060192.td-b3lyp_6-31g+(d).log.xz

012060192.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060192.td-b3lyp_6-31+g(d).gjf (generated)

012060192.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060192.mol 012060192.PUBCHEM 012060192.mol (via Jmol)
012060254.b3lyp_6-31g(d).inp

012060254.b3lyp_6-31g(d).qchem.inp (generated)

012060254.b3lyp_6-31g(d).gjf (generated)

012060254.b3lyp_6-31g(d).firefly.inp (generated)

012060254.b3lyp_6-31g(d).smash.inp (generated)

012060254.b3lyp_6-31g(d).nwchem.inp (generated) 012060254.b3lyp_6-31g(d).log.xz 012060254.td-b3lyp_6-31g+(d).inp 012060254.td-b3lyp_6-31g+(d).log.xz

012060254.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060254.td-b3lyp_6-31+g(d).gjf (generated)

012060254.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060254.mol 012060254.PUBCHEM 012060254.mol (via Jmol)
012060255.b3lyp_6-31g(d).inp

012060255.b3lyp_6-31g(d).qchem.inp (generated)

012060255.b3lyp_6-31g(d).gjf (generated)

012060255.b3lyp_6-31g(d).firefly.inp (generated)

012060255.b3lyp_6-31g(d).smash.inp (generated)

012060255.b3lyp_6-31g(d).nwchem.inp (generated) 012060255.b3lyp_6-31g(d).log.xz 012060255.td-b3lyp_6-31g+(d).inp 012060255.td-b3lyp_6-31g+(d).log.xz

012060255.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060255.td-b3lyp_6-31+g(d).gjf (generated)

012060255.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060255.mol 012060255.PUBCHEM 012060255.mol (via Jmol)
012060256.b3lyp_6-31g(d).inp

012060256.b3lyp_6-31g(d).qchem.inp (generated)

012060256.b3lyp_6-31g(d).gjf (generated)

012060256.b3lyp_6-31g(d).firefly.inp (generated)

012060256.b3lyp_6-31g(d).smash.inp (generated)

012060256.b3lyp_6-31g(d).nwchem.inp (generated) 012060256.b3lyp_6-31g(d).log.xz 012060256.td-b3lyp_6-31g+(d).inp 012060256.td-b3lyp_6-31g+(d).log.xz

012060256.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060256.td-b3lyp_6-31+g(d).gjf (generated)

012060256.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060256.mol 012060256.PUBCHEM 012060256.mol (via Jmol)
012060258.b3lyp_6-31g(d).inp

012060258.b3lyp_6-31g(d).qchem.inp (generated)

012060258.b3lyp_6-31g(d).gjf (generated)

012060258.b3lyp_6-31g(d).firefly.inp (generated)

012060258.b3lyp_6-31g(d).smash.inp (generated)

012060258.b3lyp_6-31g(d).nwchem.inp (generated) 012060258.b3lyp_6-31g(d).log.xz 012060258.td-b3lyp_6-31g+(d).inp 012060258.td-b3lyp_6-31g+(d).log.xz

012060258.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060258.td-b3lyp_6-31+g(d).gjf (generated)

012060258.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060258.mol 012060258.PUBCHEM 012060258.mol (via Jmol)
012060259.b3lyp_6-31g(d).inp

012060259.b3lyp_6-31g(d).qchem.inp (generated)

012060259.b3lyp_6-31g(d).gjf (generated)

012060259.b3lyp_6-31g(d).firefly.inp (generated)

012060259.b3lyp_6-31g(d).smash.inp (generated)

012060259.b3lyp_6-31g(d).nwchem.inp (generated) 012060259.b3lyp_6-31g(d).log.xz 012060259.td-b3lyp_6-31g+(d).inp 012060259.td-b3lyp_6-31g+(d).log.xz

012060259.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060259.td-b3lyp_6-31+g(d).gjf (generated)

012060259.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060259.mol 012060259.PUBCHEM 012060259.mol (via Jmol)
012060260.b3lyp_6-31g(d).inp

012060260.b3lyp_6-31g(d).qchem.inp (generated)

012060260.b3lyp_6-31g(d).gjf (generated)

012060260.b3lyp_6-31g(d).firefly.inp (generated)

012060260.b3lyp_6-31g(d).smash.inp (generated)

012060260.b3lyp_6-31g(d).nwchem.inp (generated) 012060260.b3lyp_6-31g(d).log.xz 012060260.td-b3lyp_6-31g+(d).inp 012060260.td-b3lyp_6-31g+(d).log.xz

012060260.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060260.td-b3lyp_6-31+g(d).gjf (generated)

012060260.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060260.mol 012060260.PUBCHEM 012060260.mol (via Jmol)
012060261.b3lyp_6-31g(d).inp

012060261.b3lyp_6-31g(d).qchem.inp (generated)

012060261.b3lyp_6-31g(d).gjf (generated)

012060261.b3lyp_6-31g(d).firefly.inp (generated)

012060261.b3lyp_6-31g(d).smash.inp (generated)

012060261.b3lyp_6-31g(d).nwchem.inp (generated) 012060261.b3lyp_6-31g(d).log.xz 012060261.td-b3lyp_6-31g+(d).inp 012060261.td-b3lyp_6-31g+(d).log.xz

012060261.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060261.td-b3lyp_6-31+g(d).gjf (generated)

012060261.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060261.mol 012060261.PUBCHEM 012060261.mol (via Jmol)
012060264.b3lyp_6-31g(d).inp

012060264.b3lyp_6-31g(d).qchem.inp (generated)

012060264.b3lyp_6-31g(d).gjf (generated)

012060264.b3lyp_6-31g(d).firefly.inp (generated)

012060264.b3lyp_6-31g(d).smash.inp (generated)

012060264.b3lyp_6-31g(d).nwchem.inp (generated) 012060264.b3lyp_6-31g(d).log.xz 012060264.td-b3lyp_6-31g+(d).inp 012060264.td-b3lyp_6-31g+(d).log.xz

012060264.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060264.td-b3lyp_6-31+g(d).gjf (generated)

012060264.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060264.mol 012060264.PUBCHEM 012060264.mol (via Jmol)
012060265.b3lyp_6-31g(d).inp

012060265.b3lyp_6-31g(d).qchem.inp (generated)

012060265.b3lyp_6-31g(d).gjf (generated)

012060265.b3lyp_6-31g(d).firefly.inp (generated)

012060265.b3lyp_6-31g(d).smash.inp (generated)

012060265.b3lyp_6-31g(d).nwchem.inp (generated) 012060265.b3lyp_6-31g(d).log.xz 012060265.td-b3lyp_6-31g+(d).inp 012060265.td-b3lyp_6-31g+(d).log.xz

012060265.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060265.td-b3lyp_6-31+g(d).gjf (generated)

012060265.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060265.mol 012060265.PUBCHEM 012060265.mol (via Jmol)
012060266.b3lyp_6-31g(d).inp

012060266.b3lyp_6-31g(d).qchem.inp (generated)

012060266.b3lyp_6-31g(d).gjf (generated)

012060266.b3lyp_6-31g(d).firefly.inp (generated)

012060266.b3lyp_6-31g(d).smash.inp (generated)

012060266.b3lyp_6-31g(d).nwchem.inp (generated) 012060266.b3lyp_6-31g(d).log.xz 012060266.td-b3lyp_6-31g+(d).inp 012060266.td-b3lyp_6-31g+(d).log.xz

012060266.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060266.td-b3lyp_6-31+g(d).gjf (generated)

012060266.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060266.mol 012060266.PUBCHEM 012060266.mol (via Jmol)
012060267.b3lyp_6-31g(d).inp

012060267.b3lyp_6-31g(d).qchem.inp (generated)

012060267.b3lyp_6-31g(d).gjf (generated)

012060267.b3lyp_6-31g(d).firefly.inp (generated)

012060267.b3lyp_6-31g(d).smash.inp (generated)

012060267.b3lyp_6-31g(d).nwchem.inp (generated) 012060267.b3lyp_6-31g(d).log.xz 012060267.td-b3lyp_6-31g+(d).inp 012060267.td-b3lyp_6-31g+(d).log.xz

012060267.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060267.td-b3lyp_6-31+g(d).gjf (generated)

012060267.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060267.mol 012060267.PUBCHEM 012060267.mol (via Jmol)
012060298.b3lyp_6-31g(d).inp

012060298.b3lyp_6-31g(d).qchem.inp (generated)

012060298.b3lyp_6-31g(d).gjf (generated)

012060298.b3lyp_6-31g(d).firefly.inp (generated)

012060298.b3lyp_6-31g(d).smash.inp (generated)

012060298.b3lyp_6-31g(d).nwchem.inp (generated) 012060298.b3lyp_6-31g(d).log.xz 012060298.td-b3lyp_6-31g+(d).inp 012060298.td-b3lyp_6-31g+(d).log.xz

012060298.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060298.td-b3lyp_6-31+g(d).gjf (generated)

012060298.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060298.mol 012060298.PUBCHEM 012060298.mol (via Jmol)
012060307.b3lyp_6-31g(d).inp

012060307.b3lyp_6-31g(d).qchem.inp (generated)

012060307.b3lyp_6-31g(d).gjf (generated)

012060307.b3lyp_6-31g(d).firefly.inp (generated)

012060307.b3lyp_6-31g(d).smash.inp (generated)

012060307.b3lyp_6-31g(d).nwchem.inp (generated) 012060307.b3lyp_6-31g(d).log.xz 012060307.td-b3lyp_6-31g+(d).inp 012060307.td-b3lyp_6-31g+(d).log.xz

012060307.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060307.td-b3lyp_6-31+g(d).gjf (generated)

012060307.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060307.mol 012060307.PUBCHEM 012060307.mol (via Jmol)
012060312.b3lyp_6-31g(d).inp

012060312.b3lyp_6-31g(d).qchem.inp (generated)

012060312.b3lyp_6-31g(d).gjf (generated)

012060312.b3lyp_6-31g(d).firefly.inp (generated)

012060312.b3lyp_6-31g(d).smash.inp (generated)

012060312.b3lyp_6-31g(d).nwchem.inp (generated) 012060312.b3lyp_6-31g(d).log.xz 012060312.td-b3lyp_6-31g+(d).inp 012060312.td-b3lyp_6-31g+(d).log.xz

012060312.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060312.td-b3lyp_6-31+g(d).gjf (generated)

012060312.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060312.mol 012060312.PUBCHEM 012060312.mol (via Jmol)
012060313.b3lyp_6-31g(d).inp

012060313.b3lyp_6-31g(d).qchem.inp (generated)

012060313.b3lyp_6-31g(d).gjf (generated)

012060313.b3lyp_6-31g(d).firefly.inp (generated)

012060313.b3lyp_6-31g(d).smash.inp (generated)

012060313.b3lyp_6-31g(d).nwchem.inp (generated) 012060313.b3lyp_6-31g(d).log.xz 012060313.td-b3lyp_6-31g+(d).inp 012060313.td-b3lyp_6-31g+(d).log.xz

012060313.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060313.td-b3lyp_6-31+g(d).gjf (generated)

012060313.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060313.mol 012060313.PUBCHEM 012060313.mol (via Jmol)
012060327.b3lyp_6-31g(d).inp

012060327.b3lyp_6-31g(d).qchem.inp (generated)

012060327.b3lyp_6-31g(d).gjf (generated)

012060327.b3lyp_6-31g(d).firefly.inp (generated)

012060327.b3lyp_6-31g(d).smash.inp (generated)

012060327.b3lyp_6-31g(d).nwchem.inp (generated) 012060327.b3lyp_6-31g(d).log.xz 012060327.td-b3lyp_6-31g+(d).inp 012060327.td-b3lyp_6-31g+(d).log.xz

012060327.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060327.td-b3lyp_6-31+g(d).gjf (generated)

012060327.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060327.mol 012060327.PUBCHEM 012060327.mol (via Jmol)
012060373.b3lyp_6-31g(d).inp

012060373.b3lyp_6-31g(d).qchem.inp (generated)

012060373.b3lyp_6-31g(d).gjf (generated)

012060373.b3lyp_6-31g(d).firefly.inp (generated)

012060373.b3lyp_6-31g(d).smash.inp (generated)

012060373.b3lyp_6-31g(d).nwchem.inp (generated) 012060373.b3lyp_6-31g(d).log.xz 012060373.td-b3lyp_6-31g+(d).inp 012060373.td-b3lyp_6-31g+(d).log.xz

012060373.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060373.td-b3lyp_6-31+g(d).gjf (generated)

012060373.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060373.mol 012060373.PUBCHEM 012060373.mol (via Jmol)
012060379.b3lyp_6-31g(d).inp

012060379.b3lyp_6-31g(d).qchem.inp (generated)

012060379.b3lyp_6-31g(d).gjf (generated)

012060379.b3lyp_6-31g(d).firefly.inp (generated)

012060379.b3lyp_6-31g(d).smash.inp (generated)

012060379.b3lyp_6-31g(d).nwchem.inp (generated) 012060379.b3lyp_6-31g(d).log.xz 012060379.td-b3lyp_6-31g+(d).inp 012060379.td-b3lyp_6-31g+(d).log.xz

012060379.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060379.td-b3lyp_6-31+g(d).gjf (generated)

012060379.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060379.mol 012060379.PUBCHEM 012060379.mol (via Jmol)
012060382.b3lyp_6-31g(d).inp

012060382.b3lyp_6-31g(d).qchem.inp (generated)

012060382.b3lyp_6-31g(d).gjf (generated)

012060382.b3lyp_6-31g(d).firefly.inp (generated)

012060382.b3lyp_6-31g(d).smash.inp (generated)

012060382.b3lyp_6-31g(d).nwchem.inp (generated) 012060382.b3lyp_6-31g(d).log.xz 012060382.mol 012060382.PUBCHEM 012060382.mol (via Jmol)
012060413.b3lyp_6-31g(d).inp

012060413.b3lyp_6-31g(d).qchem.inp (generated)

012060413.b3lyp_6-31g(d).gjf (generated)

012060413.b3lyp_6-31g(d).firefly.inp (generated)

012060413.b3lyp_6-31g(d).smash.inp (generated)

012060413.b3lyp_6-31g(d).nwchem.inp (generated) 012060413.b3lyp_6-31g(d).log.xz 012060413.td-b3lyp_6-31g+(d).inp 012060413.td-b3lyp_6-31g+(d).log.xz

012060413.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060413.td-b3lyp_6-31+g(d).gjf (generated)

012060413.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060413.mol 012060413.PUBCHEM 012060413.mol (via Jmol)
012060417.b3lyp_6-31g(d).inp

012060417.b3lyp_6-31g(d).qchem.inp (generated)

012060417.b3lyp_6-31g(d).gjf (generated)

012060417.b3lyp_6-31g(d).firefly.inp (generated)

012060417.b3lyp_6-31g(d).smash.inp (generated)

012060417.b3lyp_6-31g(d).nwchem.inp (generated) 012060417.b3lyp_6-31g(d).log.xz 012060417.td-b3lyp_6-31g+(d).inp 012060417.td-b3lyp_6-31g+(d).log.xz

012060417.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060417.td-b3lyp_6-31+g(d).gjf (generated)

012060417.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060417.mol 012060417.PUBCHEM 012060417.mol (via Jmol)
012060419.b3lyp_6-31g(d).inp

012060419.b3lyp_6-31g(d).qchem.inp (generated)

012060419.b3lyp_6-31g(d).gjf (generated)

012060419.b3lyp_6-31g(d).firefly.inp (generated)

012060419.b3lyp_6-31g(d).smash.inp (generated)

012060419.b3lyp_6-31g(d).nwchem.inp (generated) 012060419.b3lyp_6-31g(d).log.xz 012060419.td-b3lyp_6-31g+(d).inp 012060419.td-b3lyp_6-31g+(d).log.xz

012060419.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060419.td-b3lyp_6-31+g(d).gjf (generated)

012060419.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060419.mol 012060419.PUBCHEM 012060419.mol (via Jmol)
012060438.b3lyp_6-31g(d).inp

012060438.b3lyp_6-31g(d).qchem.inp (generated)

012060438.b3lyp_6-31g(d).gjf (generated)

012060438.b3lyp_6-31g(d).firefly.inp (generated)

012060438.b3lyp_6-31g(d).smash.inp (generated)

012060438.b3lyp_6-31g(d).nwchem.inp (generated) 012060438.b3lyp_6-31g(d).log.xz 012060438.td-b3lyp_6-31g+(d).inp 012060438.td-b3lyp_6-31g+(d).log.xz

012060438.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060438.td-b3lyp_6-31+g(d).gjf (generated)

012060438.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060438.mol 012060438.PUBCHEM 012060438.mol (via Jmol)
012060439.b3lyp_6-31g(d).inp

012060439.b3lyp_6-31g(d).qchem.inp (generated)

012060439.b3lyp_6-31g(d).gjf (generated)

012060439.b3lyp_6-31g(d).firefly.inp (generated)

012060439.b3lyp_6-31g(d).smash.inp (generated)

012060439.b3lyp_6-31g(d).nwchem.inp (generated) 012060439.b3lyp_6-31g(d).log.xz 012060439.td-b3lyp_6-31g+(d).inp 012060439.td-b3lyp_6-31g+(d).log.xz

012060439.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060439.td-b3lyp_6-31+g(d).gjf (generated)

012060439.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060439.mol 012060439.PUBCHEM 012060439.mol (via Jmol)
012060477.b3lyp_6-31g(d).inp

012060477.b3lyp_6-31g(d).qchem.inp (generated)

012060477.b3lyp_6-31g(d).gjf (generated)

012060477.b3lyp_6-31g(d).firefly.inp (generated)

012060477.b3lyp_6-31g(d).smash.inp (generated)

012060477.b3lyp_6-31g(d).nwchem.inp (generated) 012060477.b3lyp_6-31g(d).log.xz 012060477.td-b3lyp_6-31g+(d).inp 012060477.td-b3lyp_6-31g+(d).log.xz

012060477.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060477.td-b3lyp_6-31+g(d).gjf (generated)

012060477.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060477.mol 012060477.PUBCHEM 012060477.mol (via Jmol)
012060484.b3lyp_6-31g(d).inp

012060484.b3lyp_6-31g(d).qchem.inp (generated)

012060484.b3lyp_6-31g(d).gjf (generated)

012060484.b3lyp_6-31g(d).firefly.inp (generated)

012060484.b3lyp_6-31g(d).smash.inp (generated)

012060484.b3lyp_6-31g(d).nwchem.inp (generated) 012060484.b3lyp_6-31g(d).log.xz 012060484.td-b3lyp_6-31g+(d).inp 012060484.td-b3lyp_6-31g+(d).log.xz

012060484.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060484.td-b3lyp_6-31+g(d).gjf (generated)

012060484.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060484.mol 012060484.PUBCHEM 012060484.mol (via Jmol)
012060495.b3lyp_6-31g(d).inp

012060495.b3lyp_6-31g(d).qchem.inp (generated)

012060495.b3lyp_6-31g(d).gjf (generated)

012060495.b3lyp_6-31g(d).firefly.inp (generated)

012060495.b3lyp_6-31g(d).smash.inp (generated)

012060495.b3lyp_6-31g(d).nwchem.inp (generated) 012060495.b3lyp_6-31g(d).log.xz 012060495.td-b3lyp_6-31g+(d).inp 012060495.td-b3lyp_6-31g+(d).log.xz

012060495.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060495.td-b3lyp_6-31+g(d).gjf (generated)

012060495.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060495.mol 012060495.PUBCHEM 012060495.mol (via Jmol)
012060511.b3lyp_6-31g(d).inp

012060511.b3lyp_6-31g(d).qchem.inp (generated)

012060511.b3lyp_6-31g(d).gjf (generated)

012060511.b3lyp_6-31g(d).firefly.inp (generated)

012060511.b3lyp_6-31g(d).smash.inp (generated)

012060511.b3lyp_6-31g(d).nwchem.inp (generated) 012060511.b3lyp_6-31g(d).log.xz 012060511.td-b3lyp_6-31g+(d).inp 012060511.td-b3lyp_6-31g+(d).log.xz

012060511.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060511.td-b3lyp_6-31+g(d).gjf (generated)

012060511.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060511.mol 012060511.PUBCHEM 012060511.mol (via Jmol)
012060512.b3lyp_6-31g(d).inp

012060512.b3lyp_6-31g(d).qchem.inp (generated)

012060512.b3lyp_6-31g(d).gjf (generated)

012060512.b3lyp_6-31g(d).firefly.inp (generated)

012060512.b3lyp_6-31g(d).smash.inp (generated)

012060512.b3lyp_6-31g(d).nwchem.inp (generated) 012060512.b3lyp_6-31g(d).log.xz 012060512.td-b3lyp_6-31g+(d).inp 012060512.td-b3lyp_6-31g+(d).log.xz

012060512.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060512.td-b3lyp_6-31+g(d).gjf (generated)

012060512.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060512.mol 012060512.PUBCHEM 012060512.mol (via Jmol)
012060513.b3lyp_6-31g(d).inp

012060513.b3lyp_6-31g(d).qchem.inp (generated)

012060513.b3lyp_6-31g(d).gjf (generated)

012060513.b3lyp_6-31g(d).firefly.inp (generated)

012060513.b3lyp_6-31g(d).smash.inp (generated)

012060513.b3lyp_6-31g(d).nwchem.inp (generated) 012060513.b3lyp_6-31g(d).log.xz 012060513.td-b3lyp_6-31g+(d).inp 012060513.td-b3lyp_6-31g+(d).log.xz

012060513.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060513.td-b3lyp_6-31+g(d).gjf (generated)

012060513.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060513.mol 012060513.PUBCHEM 012060513.mol (via Jmol)
012060664.b3lyp_6-31g(d).inp

012060664.b3lyp_6-31g(d).qchem.inp (generated)

012060664.b3lyp_6-31g(d).gjf (generated)

012060664.b3lyp_6-31g(d).firefly.inp (generated)

012060664.b3lyp_6-31g(d).smash.inp (generated)

012060664.b3lyp_6-31g(d).nwchem.inp (generated) 012060664.b3lyp_6-31g(d).log.xz 012060664.td-b3lyp_6-31g+(d).inp 012060664.td-b3lyp_6-31g+(d).log.xz

012060664.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060664.td-b3lyp_6-31+g(d).gjf (generated)

012060664.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060664.mol 012060664.PUBCHEM 012060664.mol (via Jmol)
012060696.b3lyp_6-31g(d).inp

012060696.b3lyp_6-31g(d).qchem.inp (generated)

012060696.b3lyp_6-31g(d).gjf (generated)

012060696.b3lyp_6-31g(d).firefly.inp (generated)

012060696.b3lyp_6-31g(d).smash.inp (generated)

012060696.b3lyp_6-31g(d).nwchem.inp (generated) 012060696.b3lyp_6-31g(d).log.xz 012060696.td-b3lyp_6-31g+(d).inp 012060696.td-b3lyp_6-31g+(d).log.xz

012060696.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060696.td-b3lyp_6-31+g(d).gjf (generated)

012060696.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060696.mol 012060696.PUBCHEM 012060696.mol (via Jmol)
012060698.b3lyp_6-31g(d).inp

012060698.b3lyp_6-31g(d).qchem.inp (generated)

012060698.b3lyp_6-31g(d).gjf (generated)

012060698.b3lyp_6-31g(d).firefly.inp (generated)

012060698.b3lyp_6-31g(d).smash.inp (generated)

012060698.b3lyp_6-31g(d).nwchem.inp (generated) 012060698.b3lyp_6-31g(d).log.xz 012060698.td-b3lyp_6-31g+(d).inp 012060698.td-b3lyp_6-31g+(d).log.xz

012060698.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060698.td-b3lyp_6-31+g(d).gjf (generated)

012060698.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060698.mol 012060698.PUBCHEM 012060698.mol (via Jmol)
012060699.b3lyp_6-31g(d).inp

012060699.b3lyp_6-31g(d).qchem.inp (generated)

012060699.b3lyp_6-31g(d).gjf (generated)

012060699.b3lyp_6-31g(d).firefly.inp (generated)

012060699.b3lyp_6-31g(d).smash.inp (generated)

012060699.b3lyp_6-31g(d).nwchem.inp (generated) 012060699.b3lyp_6-31g(d).log.xz 012060699.td-b3lyp_6-31g+(d).inp 012060699.td-b3lyp_6-31g+(d).log.xz

012060699.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060699.td-b3lyp_6-31+g(d).gjf (generated)

012060699.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060699.mol 012060699.PUBCHEM 012060699.mol (via Jmol)
012060700.b3lyp_6-31g(d).inp

012060700.b3lyp_6-31g(d).qchem.inp (generated)

012060700.b3lyp_6-31g(d).gjf (generated)

012060700.b3lyp_6-31g(d).firefly.inp (generated)

012060700.b3lyp_6-31g(d).smash.inp (generated)

012060700.b3lyp_6-31g(d).nwchem.inp (generated) 012060700.b3lyp_6-31g(d).log.xz 012060700.td-b3lyp_6-31g+(d).inp 012060700.td-b3lyp_6-31g+(d).log.xz

012060700.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060700.td-b3lyp_6-31+g(d).gjf (generated)

012060700.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060700.mol 012060700.PUBCHEM 012060700.mol (via Jmol)
012060710.b3lyp_6-31g(d).inp

012060710.b3lyp_6-31g(d).qchem.inp (generated)

012060710.b3lyp_6-31g(d).gjf (generated)

012060710.b3lyp_6-31g(d).firefly.inp (generated)

012060710.b3lyp_6-31g(d).smash.inp (generated)

012060710.b3lyp_6-31g(d).nwchem.inp (generated) 012060710.b3lyp_6-31g(d).log.xz 012060710.td-b3lyp_6-31g+(d).inp 012060710.td-b3lyp_6-31g+(d).log.xz

012060710.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060710.td-b3lyp_6-31+g(d).gjf (generated)

012060710.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060710.mol 012060710.PUBCHEM 012060710.mol (via Jmol)
012060711.b3lyp_6-31g(d).inp

012060711.b3lyp_6-31g(d).qchem.inp (generated)

012060711.b3lyp_6-31g(d).gjf (generated)

012060711.b3lyp_6-31g(d).firefly.inp (generated)

012060711.b3lyp_6-31g(d).smash.inp (generated)

012060711.b3lyp_6-31g(d).nwchem.inp (generated) 012060711.b3lyp_6-31g(d).log.xz 012060711.td-b3lyp_6-31g+(d).inp 012060711.td-b3lyp_6-31g+(d).log.xz

012060711.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060711.td-b3lyp_6-31+g(d).gjf (generated)

012060711.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060711.mol 012060711.PUBCHEM 012060711.mol (via Jmol)
012060735.b3lyp_6-31g(d).inp

012060735.b3lyp_6-31g(d).qchem.inp (generated)

012060735.b3lyp_6-31g(d).gjf (generated)

012060735.b3lyp_6-31g(d).firefly.inp (generated)

012060735.b3lyp_6-31g(d).smash.inp (generated)

012060735.b3lyp_6-31g(d).nwchem.inp (generated) 012060735.b3lyp_6-31g(d).log.xz 012060735.mol 012060735.PUBCHEM 012060735.mol (via Jmol)
012060747.b3lyp_6-31g(d).inp

012060747.b3lyp_6-31g(d).qchem.inp (generated)

012060747.b3lyp_6-31g(d).gjf (generated)

012060747.b3lyp_6-31g(d).firefly.inp (generated)

012060747.b3lyp_6-31g(d).smash.inp (generated)

012060747.b3lyp_6-31g(d).nwchem.inp (generated) 012060747.b3lyp_6-31g(d).log.xz 012060747.td-b3lyp_6-31g+(d).inp 012060747.td-b3lyp_6-31g+(d).log.xz

012060747.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060747.td-b3lyp_6-31+g(d).gjf (generated)

012060747.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060747.mol 012060747.PUBCHEM 012060747.mol (via Jmol)
012060751.b3lyp_6-31g(d).inp

012060751.b3lyp_6-31g(d).qchem.inp (generated)

012060751.b3lyp_6-31g(d).gjf (generated)

012060751.b3lyp_6-31g(d).firefly.inp (generated)

012060751.b3lyp_6-31g(d).smash.inp (generated)

012060751.b3lyp_6-31g(d).nwchem.inp (generated) 012060751.b3lyp_6-31g(d).log.xz 012060751.td-b3lyp_6-31g+(d).inp 012060751.td-b3lyp_6-31g+(d).log.xz

012060751.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060751.td-b3lyp_6-31+g(d).gjf (generated)

012060751.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060751.mol 012060751.PUBCHEM 012060751.mol (via Jmol)
012060759.b3lyp_6-31g(d).inp

012060759.b3lyp_6-31g(d).qchem.inp (generated)

012060759.b3lyp_6-31g(d).gjf (generated)

012060759.b3lyp_6-31g(d).firefly.inp (generated)

012060759.b3lyp_6-31g(d).smash.inp (generated)

012060759.b3lyp_6-31g(d).nwchem.inp (generated) 012060759.b3lyp_6-31g(d).log.xz 012060759.td-b3lyp_6-31g+(d).inp 012060759.td-b3lyp_6-31g+(d).log.xz

012060759.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060759.td-b3lyp_6-31+g(d).gjf (generated)

012060759.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060759.mol 012060759.PUBCHEM 012060759.mol (via Jmol)
012060762.b3lyp_6-31g(d).inp

012060762.b3lyp_6-31g(d).qchem.inp (generated)

012060762.b3lyp_6-31g(d).gjf (generated)

012060762.b3lyp_6-31g(d).firefly.inp (generated)

012060762.b3lyp_6-31g(d).smash.inp (generated)

012060762.b3lyp_6-31g(d).nwchem.inp (generated) 012060762.b3lyp_6-31g(d).log.xz 012060762.mol 012060762.PUBCHEM 012060762.mol (via Jmol)
012060764.b3lyp_6-31g(d).inp

012060764.b3lyp_6-31g(d).qchem.inp (generated)

012060764.b3lyp_6-31g(d).gjf (generated)

012060764.b3lyp_6-31g(d).firefly.inp (generated)

012060764.b3lyp_6-31g(d).smash.inp (generated)

012060764.b3lyp_6-31g(d).nwchem.inp (generated) 012060764.b3lyp_6-31g(d).log.xz 012060764.mol 012060764.PUBCHEM 012060764.mol (via Jmol)
012060765.b3lyp_6-31g(d).inp

012060765.b3lyp_6-31g(d).qchem.inp (generated)

012060765.b3lyp_6-31g(d).gjf (generated)

012060765.b3lyp_6-31g(d).firefly.inp (generated)

012060765.b3lyp_6-31g(d).smash.inp (generated)

012060765.b3lyp_6-31g(d).nwchem.inp (generated) 012060765.b3lyp_6-31g(d).log.xz 012060765.td-b3lyp_6-31g+(d).inp 012060765.td-b3lyp_6-31g+(d).log.xz

012060765.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060765.td-b3lyp_6-31+g(d).gjf (generated)

012060765.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060765.mol 012060765.PUBCHEM 012060765.mol (via Jmol)
012060769.b3lyp_6-31g(d).inp

012060769.b3lyp_6-31g(d).qchem.inp (generated)

012060769.b3lyp_6-31g(d).gjf (generated)

012060769.b3lyp_6-31g(d).firefly.inp (generated)

012060769.b3lyp_6-31g(d).smash.inp (generated)

012060769.b3lyp_6-31g(d).nwchem.inp (generated) 012060769.b3lyp_6-31g(d).log.xz 012060769.mol 012060769.PUBCHEM 012060769.mol (via Jmol)
012060801.b3lyp_6-31g(d).inp

012060801.b3lyp_6-31g(d).qchem.inp (generated)

012060801.b3lyp_6-31g(d).gjf (generated)

012060801.b3lyp_6-31g(d).firefly.inp (generated)

012060801.b3lyp_6-31g(d).smash.inp (generated)

012060801.b3lyp_6-31g(d).nwchem.inp (generated) 012060801.b3lyp_6-31g(d).log.xz 012060801.td-b3lyp_6-31g+(d).inp 012060801.td-b3lyp_6-31g+(d).log.xz

012060801.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060801.td-b3lyp_6-31+g(d).gjf (generated)

012060801.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060801.mol 012060801.PUBCHEM 012060801.mol (via Jmol)
012060816.b3lyp_6-31g(d).inp

012060816.b3lyp_6-31g(d).qchem.inp (generated)

012060816.b3lyp_6-31g(d).gjf (generated)

012060816.b3lyp_6-31g(d).firefly.inp (generated)

012060816.b3lyp_6-31g(d).smash.inp (generated)

012060816.b3lyp_6-31g(d).nwchem.inp (generated) 012060816.b3lyp_6-31g(d).log.xz 012060816.td-b3lyp_6-31g+(d).inp 012060816.td-b3lyp_6-31g+(d).log.xz

012060816.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060816.td-b3lyp_6-31+g(d).gjf (generated)

012060816.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060816.mol 012060816.PUBCHEM 012060816.mol (via Jmol)
012060821.b3lyp_6-31g(d).inp

012060821.b3lyp_6-31g(d).qchem.inp (generated)

012060821.b3lyp_6-31g(d).gjf (generated)

012060821.b3lyp_6-31g(d).firefly.inp (generated)

012060821.b3lyp_6-31g(d).smash.inp (generated)

012060821.b3lyp_6-31g(d).nwchem.inp (generated) 012060821.b3lyp_6-31g(d).log.xz 012060821.td-b3lyp_6-31g+(d).inp 012060821.td-b3lyp_6-31g+(d).log.xz

012060821.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060821.td-b3lyp_6-31+g(d).gjf (generated)

012060821.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060821.mol 012060821.PUBCHEM 012060821.mol (via Jmol)
012060822.b3lyp_6-31g(d).inp

012060822.b3lyp_6-31g(d).qchem.inp (generated)

012060822.b3lyp_6-31g(d).gjf (generated)

012060822.b3lyp_6-31g(d).firefly.inp (generated)

012060822.b3lyp_6-31g(d).smash.inp (generated)

012060822.b3lyp_6-31g(d).nwchem.inp (generated) 012060822.b3lyp_6-31g(d).log.xz 012060822.td-b3lyp_6-31g+(d).inp 012060822.td-b3lyp_6-31g+(d).log.xz

012060822.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060822.td-b3lyp_6-31+g(d).gjf (generated)

012060822.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060822.mol 012060822.PUBCHEM 012060822.mol (via Jmol)
012060823.b3lyp_6-31g(d).inp

012060823.b3lyp_6-31g(d).qchem.inp (generated)

012060823.b3lyp_6-31g(d).gjf (generated)

012060823.b3lyp_6-31g(d).firefly.inp (generated)

012060823.b3lyp_6-31g(d).smash.inp (generated)

012060823.b3lyp_6-31g(d).nwchem.inp (generated) 012060823.b3lyp_6-31g(d).log.xz 012060823.td-b3lyp_6-31g+(d).inp 012060823.td-b3lyp_6-31g+(d).log.xz

012060823.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060823.td-b3lyp_6-31+g(d).gjf (generated)

012060823.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060823.mol 012060823.PUBCHEM 012060823.mol (via Jmol)
012060828.b3lyp_6-31g(d).inp

012060828.b3lyp_6-31g(d).qchem.inp (generated)

012060828.b3lyp_6-31g(d).gjf (generated)

012060828.b3lyp_6-31g(d).firefly.inp (generated)

012060828.b3lyp_6-31g(d).smash.inp (generated)

012060828.b3lyp_6-31g(d).nwchem.inp (generated) 012060828.b3lyp_6-31g(d).log.xz 012060828.td-b3lyp_6-31g+(d).inp 012060828.td-b3lyp_6-31g+(d).log.xz

012060828.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060828.td-b3lyp_6-31+g(d).gjf (generated)

012060828.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060828.mol 012060828.PUBCHEM 012060828.mol (via Jmol)
012060830.b3lyp_6-31g(d).inp

012060830.b3lyp_6-31g(d).qchem.inp (generated)

012060830.b3lyp_6-31g(d).gjf (generated)

012060830.b3lyp_6-31g(d).firefly.inp (generated)

012060830.b3lyp_6-31g(d).smash.inp (generated)

012060830.b3lyp_6-31g(d).nwchem.inp (generated) 012060830.b3lyp_6-31g(d).log.xz 012060830.td-b3lyp_6-31g+(d).inp 012060830.td-b3lyp_6-31g+(d).log.xz

012060830.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060830.td-b3lyp_6-31+g(d).gjf (generated)

012060830.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060830.mol 012060830.PUBCHEM 012060830.mol (via Jmol)
012060838.b3lyp_6-31g(d).inp

012060838.b3lyp_6-31g(d).qchem.inp (generated)

012060838.b3lyp_6-31g(d).gjf (generated)

012060838.b3lyp_6-31g(d).firefly.inp (generated)

012060838.b3lyp_6-31g(d).smash.inp (generated)

012060838.b3lyp_6-31g(d).nwchem.inp (generated) 012060838.b3lyp_6-31g(d).log.xz 012060838.td-b3lyp_6-31g+(d).inp 012060838.td-b3lyp_6-31g+(d).log.xz

012060838.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060838.td-b3lyp_6-31+g(d).gjf (generated)

012060838.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060838.mol 012060838.PUBCHEM 012060838.mol (via Jmol)
012060852.b3lyp_6-31g(d).inp

012060852.b3lyp_6-31g(d).qchem.inp (generated)

012060852.b3lyp_6-31g(d).gjf (generated)

012060852.b3lyp_6-31g(d).firefly.inp (generated)

012060852.b3lyp_6-31g(d).smash.inp (generated)

012060852.b3lyp_6-31g(d).nwchem.inp (generated) 012060852.b3lyp_6-31g(d).log.xz 012060852.td-b3lyp_6-31g+(d).inp 012060852.td-b3lyp_6-31g+(d).log.xz

012060852.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060852.td-b3lyp_6-31+g(d).gjf (generated)

012060852.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060852.mol 012060852.PUBCHEM 012060852.mol (via Jmol)
012060862.b3lyp_6-31g(d).inp

012060862.b3lyp_6-31g(d).qchem.inp (generated)

012060862.b3lyp_6-31g(d).gjf (generated)

012060862.b3lyp_6-31g(d).firefly.inp (generated)

012060862.b3lyp_6-31g(d).smash.inp (generated)

012060862.b3lyp_6-31g(d).nwchem.inp (generated) 012060862.b3lyp_6-31g(d).log.xz 012060862.td-b3lyp_6-31g+(d).inp 012060862.td-b3lyp_6-31g+(d).log.xz

012060862.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060862.td-b3lyp_6-31+g(d).gjf (generated)

012060862.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060862.mol 012060862.PUBCHEM 012060862.mol (via Jmol)
012060894.b3lyp_6-31g(d).inp

012060894.b3lyp_6-31g(d).qchem.inp (generated)

012060894.b3lyp_6-31g(d).gjf (generated)

012060894.b3lyp_6-31g(d).firefly.inp (generated)

012060894.b3lyp_6-31g(d).smash.inp (generated)

012060894.b3lyp_6-31g(d).nwchem.inp (generated) 012060894.b3lyp_6-31g(d).log.xz 012060894.td-b3lyp_6-31g+(d).inp 012060894.td-b3lyp_6-31g+(d).log.xz

012060894.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060894.td-b3lyp_6-31+g(d).gjf (generated)

012060894.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060894.mol 012060894.PUBCHEM 012060894.mol (via Jmol)
012060934.b3lyp_6-31g(d).inp

012060934.b3lyp_6-31g(d).qchem.inp (generated)

012060934.b3lyp_6-31g(d).gjf (generated)

012060934.b3lyp_6-31g(d).firefly.inp (generated)

012060934.b3lyp_6-31g(d).smash.inp (generated)

012060934.b3lyp_6-31g(d).nwchem.inp (generated) 012060934.b3lyp_6-31g(d).log.xz 012060934.td-b3lyp_6-31g+(d).inp 012060934.td-b3lyp_6-31g+(d).log.xz

012060934.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060934.td-b3lyp_6-31+g(d).gjf (generated)

012060934.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060934.mol 012060934.PUBCHEM 012060934.mol (via Jmol)
012060953.b3lyp_6-31g(d).inp

012060953.b3lyp_6-31g(d).qchem.inp (generated)

012060953.b3lyp_6-31g(d).gjf (generated)

012060953.b3lyp_6-31g(d).firefly.inp (generated)

012060953.b3lyp_6-31g(d).smash.inp (generated)

012060953.b3lyp_6-31g(d).nwchem.inp (generated) 012060953.b3lyp_6-31g(d).log.xz 012060953.td-b3lyp_6-31g+(d).inp 012060953.td-b3lyp_6-31g+(d).log.xz

012060953.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060953.td-b3lyp_6-31+g(d).gjf (generated)

012060953.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060953.mol 012060953.PUBCHEM 012060953.mol (via Jmol)
012060965.b3lyp_6-31g(d).inp

012060965.b3lyp_6-31g(d).qchem.inp (generated)

012060965.b3lyp_6-31g(d).gjf (generated)

012060965.b3lyp_6-31g(d).firefly.inp (generated)

012060965.b3lyp_6-31g(d).smash.inp (generated)

012060965.b3lyp_6-31g(d).nwchem.inp (generated) 012060965.b3lyp_6-31g(d).log.xz 012060965.td-b3lyp_6-31g+(d).inp 012060965.td-b3lyp_6-31g+(d).log.xz

012060965.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060965.td-b3lyp_6-31+g(d).gjf (generated)

012060965.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060965.mol 012060965.PUBCHEM 012060965.mol (via Jmol)
012060968.b3lyp_6-31g(d).inp

012060968.b3lyp_6-31g(d).qchem.inp (generated)

012060968.b3lyp_6-31g(d).gjf (generated)

012060968.b3lyp_6-31g(d).firefly.inp (generated)

012060968.b3lyp_6-31g(d).smash.inp (generated)

012060968.b3lyp_6-31g(d).nwchem.inp (generated) 012060968.b3lyp_6-31g(d).log.xz 012060968.td-b3lyp_6-31g+(d).inp 012060968.td-b3lyp_6-31g+(d).log.xz

012060968.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060968.td-b3lyp_6-31+g(d).gjf (generated)

012060968.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060968.mol 012060968.PUBCHEM 012060968.mol (via Jmol)
012060997.b3lyp_6-31g(d).inp

012060997.b3lyp_6-31g(d).qchem.inp (generated)

012060997.b3lyp_6-31g(d).gjf (generated)

012060997.b3lyp_6-31g(d).firefly.inp (generated)

012060997.b3lyp_6-31g(d).smash.inp (generated)

012060997.b3lyp_6-31g(d).nwchem.inp (generated) 012060997.b3lyp_6-31g(d).log.xz 012060997.td-b3lyp_6-31g+(d).inp 012060997.td-b3lyp_6-31g+(d).log.xz

012060997.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060997.td-b3lyp_6-31+g(d).gjf (generated)

012060997.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060997.mol 012060997.PUBCHEM 012060997.mol (via Jmol)
012060998.b3lyp_6-31g(d).inp

012060998.b3lyp_6-31g(d).qchem.inp (generated)

012060998.b3lyp_6-31g(d).gjf (generated)

012060998.b3lyp_6-31g(d).firefly.inp (generated)

012060998.b3lyp_6-31g(d).smash.inp (generated)

012060998.b3lyp_6-31g(d).nwchem.inp (generated) 012060998.b3lyp_6-31g(d).log.xz 012060998.td-b3lyp_6-31g+(d).inp 012060998.td-b3lyp_6-31g+(d).log.xz

012060998.td-b3lyp_6-31+g(d).qchem.inp (generated)

012060998.td-b3lyp_6-31+g(d).gjf (generated)

012060998.td-b3lyp_6-31+g(d).firefly.inp (generated)

012060998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012060998.mol 012060998.PUBCHEM 012060998.mol (via Jmol)
012061091.b3lyp_6-31g(d).inp

012061091.b3lyp_6-31g(d).qchem.inp (generated)

012061091.b3lyp_6-31g(d).gjf (generated)

012061091.b3lyp_6-31g(d).firefly.inp (generated)

012061091.b3lyp_6-31g(d).smash.inp (generated)

012061091.b3lyp_6-31g(d).nwchem.inp (generated) 012061091.b3lyp_6-31g(d).log.xz 012061091.td-b3lyp_6-31g+(d).inp 012061091.td-b3lyp_6-31g+(d).log.xz

012061091.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061091.td-b3lyp_6-31+g(d).gjf (generated)

012061091.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061091.mol 012061091.PUBCHEM 012061091.mol (via Jmol)
012061092.b3lyp_6-31g(d).inp

012061092.b3lyp_6-31g(d).qchem.inp (generated)

012061092.b3lyp_6-31g(d).gjf (generated)

012061092.b3lyp_6-31g(d).firefly.inp (generated)

012061092.b3lyp_6-31g(d).smash.inp (generated)

012061092.b3lyp_6-31g(d).nwchem.inp (generated) 012061092.b3lyp_6-31g(d).log.xz 012061092.mol 012061092.PUBCHEM 012061092.mol (via Jmol)
012061093.b3lyp_6-31g(d).inp

012061093.b3lyp_6-31g(d).qchem.inp (generated)

012061093.b3lyp_6-31g(d).gjf (generated)

012061093.b3lyp_6-31g(d).firefly.inp (generated)

012061093.b3lyp_6-31g(d).smash.inp (generated)

012061093.b3lyp_6-31g(d).nwchem.inp (generated) 012061093.b3lyp_6-31g(d).log.xz 012061093.td-b3lyp_6-31g+(d).inp 012061093.td-b3lyp_6-31g+(d).log.xz

012061093.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061093.td-b3lyp_6-31+g(d).gjf (generated)

012061093.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061093.mol 012061093.PUBCHEM 012061093.mol (via Jmol)
012061149.b3lyp_6-31g(d).inp

012061149.b3lyp_6-31g(d).qchem.inp (generated)

012061149.b3lyp_6-31g(d).gjf (generated)

012061149.b3lyp_6-31g(d).firefly.inp (generated)

012061149.b3lyp_6-31g(d).smash.inp (generated)

012061149.b3lyp_6-31g(d).nwchem.inp (generated) 012061149.b3lyp_6-31g(d).log.xz 012061149.td-b3lyp_6-31g+(d).inp 012061149.td-b3lyp_6-31g+(d).log.xz

012061149.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061149.td-b3lyp_6-31+g(d).gjf (generated)

012061149.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061149.mol 012061149.PUBCHEM 012061149.mol (via Jmol)
012061186.b3lyp_6-31g(d).inp

012061186.b3lyp_6-31g(d).qchem.inp (generated)

012061186.b3lyp_6-31g(d).gjf (generated)

012061186.b3lyp_6-31g(d).firefly.inp (generated)

012061186.b3lyp_6-31g(d).smash.inp (generated)

012061186.b3lyp_6-31g(d).nwchem.inp (generated) 012061186.b3lyp_6-31g(d).log.xz 012061186.td-b3lyp_6-31g+(d).inp 012061186.td-b3lyp_6-31g+(d).log.xz

012061186.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061186.td-b3lyp_6-31+g(d).gjf (generated)

012061186.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061186.mol 012061186.PUBCHEM 012061186.mol (via Jmol)
012061214.b3lyp_6-31g(d).inp

012061214.b3lyp_6-31g(d).qchem.inp (generated)

012061214.b3lyp_6-31g(d).gjf (generated)

012061214.b3lyp_6-31g(d).firefly.inp (generated)

012061214.b3lyp_6-31g(d).smash.inp (generated)

012061214.b3lyp_6-31g(d).nwchem.inp (generated) 012061214.b3lyp_6-31g(d).log.xz 012061214.td-b3lyp_6-31g+(d).inp 012061214.td-b3lyp_6-31g+(d).log.xz

012061214.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061214.td-b3lyp_6-31+g(d).gjf (generated)

012061214.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061214.mol 012061214.PUBCHEM 012061214.mol (via Jmol)
012061426.b3lyp_6-31g(d).inp

012061426.b3lyp_6-31g(d).qchem.inp (generated)

012061426.b3lyp_6-31g(d).gjf (generated)

012061426.b3lyp_6-31g(d).firefly.inp (generated)

012061426.b3lyp_6-31g(d).smash.inp (generated)

012061426.b3lyp_6-31g(d).nwchem.inp (generated) 012061426.b3lyp_6-31g(d).log.xz 012061426.td-b3lyp_6-31g+(d).inp 012061426.td-b3lyp_6-31g+(d).log.xz

012061426.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061426.td-b3lyp_6-31+g(d).gjf (generated)

012061426.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061426.mol 012061426.PUBCHEM 012061426.mol (via Jmol)
012061462.b3lyp_6-31g(d).inp

012061462.b3lyp_6-31g(d).qchem.inp (generated)

012061462.b3lyp_6-31g(d).gjf (generated)

012061462.b3lyp_6-31g(d).firefly.inp (generated)

012061462.b3lyp_6-31g(d).smash.inp (generated)

012061462.b3lyp_6-31g(d).nwchem.inp (generated) 012061462.b3lyp_6-31g(d).log.xz 012061462.td-b3lyp_6-31g+(d).inp 012061462.td-b3lyp_6-31g+(d).log.xz

012061462.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061462.td-b3lyp_6-31+g(d).gjf (generated)

012061462.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061462.mol 012061462.PUBCHEM 012061462.mol (via Jmol)
012061464.b3lyp_6-31g(d).inp

012061464.b3lyp_6-31g(d).qchem.inp (generated)

012061464.b3lyp_6-31g(d).gjf (generated)

012061464.b3lyp_6-31g(d).firefly.inp (generated)

012061464.b3lyp_6-31g(d).smash.inp (generated)

012061464.b3lyp_6-31g(d).nwchem.inp (generated) 012061464.b3lyp_6-31g(d).log.xz 012061464.td-b3lyp_6-31g+(d).inp 012061464.td-b3lyp_6-31g+(d).log.xz

012061464.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061464.td-b3lyp_6-31+g(d).gjf (generated)

012061464.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061464.mol 012061464.PUBCHEM 012061464.mol (via Jmol)
012061488.b3lyp_6-31g(d).inp

012061488.b3lyp_6-31g(d).qchem.inp (generated)

012061488.b3lyp_6-31g(d).gjf (generated)

012061488.b3lyp_6-31g(d).firefly.inp (generated)

012061488.b3lyp_6-31g(d).smash.inp (generated)

012061488.b3lyp_6-31g(d).nwchem.inp (generated) 012061488.b3lyp_6-31g(d).log.xz 012061488.td-b3lyp_6-31g+(d).inp 012061488.td-b3lyp_6-31g+(d).log.xz

012061488.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061488.td-b3lyp_6-31+g(d).gjf (generated)

012061488.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061488.mol 012061488.PUBCHEM 012061488.mol (via Jmol)
012061547.b3lyp_6-31g(d).inp

012061547.b3lyp_6-31g(d).qchem.inp (generated)

012061547.b3lyp_6-31g(d).gjf (generated)

012061547.b3lyp_6-31g(d).firefly.inp (generated)

012061547.b3lyp_6-31g(d).smash.inp (generated)

012061547.b3lyp_6-31g(d).nwchem.inp (generated) 012061547.b3lyp_6-31g(d).log.xz 012061547.td-b3lyp_6-31g+(d).inp 012061547.td-b3lyp_6-31g+(d).log.xz

012061547.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061547.td-b3lyp_6-31+g(d).gjf (generated)

012061547.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061547.mol 012061547.PUBCHEM 012061547.mol (via Jmol)
012061627.b3lyp_6-31g(d).inp

012061627.b3lyp_6-31g(d).qchem.inp (generated)

012061627.b3lyp_6-31g(d).gjf (generated)

012061627.b3lyp_6-31g(d).firefly.inp (generated)

012061627.b3lyp_6-31g(d).smash.inp (generated)

012061627.b3lyp_6-31g(d).nwchem.inp (generated) 012061627.b3lyp_6-31g(d).log.xz 012061627.td-b3lyp_6-31g+(d).inp 012061627.td-b3lyp_6-31g+(d).log.xz

012061627.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061627.td-b3lyp_6-31+g(d).gjf (generated)

012061627.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061627.mol 012061627.PUBCHEM 012061627.mol (via Jmol)
012061630.b3lyp_6-31g(d).inp

012061630.b3lyp_6-31g(d).qchem.inp (generated)

012061630.b3lyp_6-31g(d).gjf (generated)

012061630.b3lyp_6-31g(d).firefly.inp (generated)

012061630.b3lyp_6-31g(d).smash.inp (generated)

012061630.b3lyp_6-31g(d).nwchem.inp (generated) 012061630.b3lyp_6-31g(d).log.xz 012061630.td-b3lyp_6-31g+(d).inp 012061630.td-b3lyp_6-31g+(d).log.xz

012061630.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061630.td-b3lyp_6-31+g(d).gjf (generated)

012061630.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061630.mol 012061630.PUBCHEM 012061630.mol (via Jmol)
012061631.b3lyp_6-31g(d).inp

012061631.b3lyp_6-31g(d).qchem.inp (generated)

012061631.b3lyp_6-31g(d).gjf (generated)

012061631.b3lyp_6-31g(d).firefly.inp (generated)

012061631.b3lyp_6-31g(d).smash.inp (generated)

012061631.b3lyp_6-31g(d).nwchem.inp (generated) 012061631.b3lyp_6-31g(d).log.xz 012061631.td-b3lyp_6-31g+(d).inp 012061631.td-b3lyp_6-31g+(d).log.xz

012061631.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061631.td-b3lyp_6-31+g(d).gjf (generated)

012061631.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061631.mol 012061631.PUBCHEM 012061631.mol (via Jmol)
012061683.b3lyp_6-31g(d).inp

012061683.b3lyp_6-31g(d).qchem.inp (generated)

012061683.b3lyp_6-31g(d).gjf (generated)

012061683.b3lyp_6-31g(d).firefly.inp (generated)

012061683.b3lyp_6-31g(d).smash.inp (generated)

012061683.b3lyp_6-31g(d).nwchem.inp (generated) 012061683.b3lyp_6-31g(d).log.xz 012061683.td-b3lyp_6-31g+(d).inp 012061683.td-b3lyp_6-31g+(d).log.xz

012061683.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061683.td-b3lyp_6-31+g(d).gjf (generated)

012061683.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061683.mol 012061683.PUBCHEM 012061683.mol (via Jmol)
012061798.b3lyp_6-31g(d).inp

012061798.b3lyp_6-31g(d).qchem.inp (generated)

012061798.b3lyp_6-31g(d).gjf (generated)

012061798.b3lyp_6-31g(d).firefly.inp (generated)

012061798.b3lyp_6-31g(d).smash.inp (generated)

012061798.b3lyp_6-31g(d).nwchem.inp (generated) 012061798.b3lyp_6-31g(d).log.xz 012061798.td-b3lyp_6-31g+(d).inp 012061798.td-b3lyp_6-31g+(d).log.xz

012061798.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061798.td-b3lyp_6-31+g(d).gjf (generated)

012061798.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061798.mol 012061798.PUBCHEM 012061798.mol (via Jmol)
012061898.b3lyp_6-31g(d).inp

012061898.b3lyp_6-31g(d).qchem.inp (generated)

012061898.b3lyp_6-31g(d).gjf (generated)

012061898.b3lyp_6-31g(d).firefly.inp (generated)

012061898.b3lyp_6-31g(d).smash.inp (generated)

012061898.b3lyp_6-31g(d).nwchem.inp (generated) 012061898.b3lyp_6-31g(d).log.xz 012061898.td-b3lyp_6-31g+(d).inp 012061898.td-b3lyp_6-31g+(d).log.xz

012061898.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061898.td-b3lyp_6-31+g(d).gjf (generated)

012061898.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061898.mol 012061898.PUBCHEM 012061898.mol (via Jmol)
012061921.b3lyp_6-31g(d).inp

012061921.b3lyp_6-31g(d).qchem.inp (generated)

012061921.b3lyp_6-31g(d).gjf (generated)

012061921.b3lyp_6-31g(d).firefly.inp (generated)

012061921.b3lyp_6-31g(d).smash.inp (generated)

012061921.b3lyp_6-31g(d).nwchem.inp (generated) 012061921.b3lyp_6-31g(d).log.xz 012061921.td-b3lyp_6-31g+(d).inp 012061921.td-b3lyp_6-31g+(d).log.xz

012061921.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061921.td-b3lyp_6-31+g(d).gjf (generated)

012061921.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061921.mol 012061921.PUBCHEM 012061921.mol (via Jmol)
012061944.b3lyp_6-31g(d).inp

012061944.b3lyp_6-31g(d).qchem.inp (generated)

012061944.b3lyp_6-31g(d).gjf (generated)

012061944.b3lyp_6-31g(d).firefly.inp (generated)

012061944.b3lyp_6-31g(d).smash.inp (generated)

012061944.b3lyp_6-31g(d).nwchem.inp (generated) 012061944.b3lyp_6-31g(d).log.xz 012061944.td-b3lyp_6-31g+(d).inp 012061944.td-b3lyp_6-31g+(d).log.xz

012061944.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061944.td-b3lyp_6-31+g(d).gjf (generated)

012061944.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061944.mol 012061944.PUBCHEM 012061944.mol (via Jmol)
012061946.b3lyp_6-31g(d).inp

012061946.b3lyp_6-31g(d).qchem.inp (generated)

012061946.b3lyp_6-31g(d).gjf (generated)

012061946.b3lyp_6-31g(d).firefly.inp (generated)

012061946.b3lyp_6-31g(d).smash.inp (generated)

012061946.b3lyp_6-31g(d).nwchem.inp (generated) 012061946.b3lyp_6-31g(d).log.xz 012061946.td-b3lyp_6-31g+(d).inp 012061946.td-b3lyp_6-31g+(d).log.xz

012061946.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061946.td-b3lyp_6-31+g(d).gjf (generated)

012061946.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061946.mol 012061946.PUBCHEM 012061946.mol (via Jmol)
012061966.b3lyp_6-31g(d).inp

012061966.b3lyp_6-31g(d).qchem.inp (generated)

012061966.b3lyp_6-31g(d).gjf (generated)

012061966.b3lyp_6-31g(d).firefly.inp (generated)

012061966.b3lyp_6-31g(d).smash.inp (generated)

012061966.b3lyp_6-31g(d).nwchem.inp (generated) 012061966.b3lyp_6-31g(d).log.xz 012061966.td-b3lyp_6-31g+(d).inp 012061966.td-b3lyp_6-31g+(d).log.xz

012061966.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061966.td-b3lyp_6-31+g(d).gjf (generated)

012061966.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061966.mol 012061966.PUBCHEM 012061966.mol (via Jmol)
012061967.b3lyp_6-31g(d).inp

012061967.b3lyp_6-31g(d).qchem.inp (generated)

012061967.b3lyp_6-31g(d).gjf (generated)

012061967.b3lyp_6-31g(d).firefly.inp (generated)

012061967.b3lyp_6-31g(d).smash.inp (generated)

012061967.b3lyp_6-31g(d).nwchem.inp (generated) 012061967.b3lyp_6-31g(d).log.xz 012061967.td-b3lyp_6-31g+(d).inp 012061967.td-b3lyp_6-31g+(d).log.xz

012061967.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061967.td-b3lyp_6-31+g(d).gjf (generated)

012061967.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061967.mol 012061967.PUBCHEM 012061967.mol (via Jmol)
012061968.b3lyp_6-31g(d).inp

012061968.b3lyp_6-31g(d).qchem.inp (generated)

012061968.b3lyp_6-31g(d).gjf (generated)

012061968.b3lyp_6-31g(d).firefly.inp (generated)

012061968.b3lyp_6-31g(d).smash.inp (generated)

012061968.b3lyp_6-31g(d).nwchem.inp (generated) 012061968.b3lyp_6-31g(d).log.xz 012061968.td-b3lyp_6-31g+(d).inp 012061968.td-b3lyp_6-31g+(d).log.xz

012061968.td-b3lyp_6-31+g(d).qchem.inp (generated)

012061968.td-b3lyp_6-31+g(d).gjf (generated)

012061968.td-b3lyp_6-31+g(d).firefly.inp (generated)

012061968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012061968.mol 012061968.PUBCHEM 012061968.mol (via Jmol)
012062007.b3lyp_6-31g(d).inp

012062007.b3lyp_6-31g(d).qchem.inp (generated)

012062007.b3lyp_6-31g(d).gjf (generated)

012062007.b3lyp_6-31g(d).firefly.inp (generated)

012062007.b3lyp_6-31g(d).smash.inp (generated)

012062007.b3lyp_6-31g(d).nwchem.inp (generated) 012062007.b3lyp_6-31g(d).log.xz 012062007.td-b3lyp_6-31g+(d).inp 012062007.td-b3lyp_6-31g+(d).log.xz

012062007.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062007.td-b3lyp_6-31+g(d).gjf (generated)

012062007.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062007.mol 012062007.PUBCHEM 012062007.mol (via Jmol)
012062104.b3lyp_6-31g(d).inp

012062104.b3lyp_6-31g(d).qchem.inp (generated)

012062104.b3lyp_6-31g(d).gjf (generated)

012062104.b3lyp_6-31g(d).firefly.inp (generated)

012062104.b3lyp_6-31g(d).smash.inp (generated)

012062104.b3lyp_6-31g(d).nwchem.inp (generated) 012062104.b3lyp_6-31g(d).log.xz 012062104.td-b3lyp_6-31g+(d).inp 012062104.td-b3lyp_6-31g+(d).log.xz

012062104.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062104.td-b3lyp_6-31+g(d).gjf (generated)

012062104.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062104.mol 012062104.PUBCHEM 012062104.mol (via Jmol)
012062247.b3lyp_6-31g(d).inp

012062247.b3lyp_6-31g(d).qchem.inp (generated)

012062247.b3lyp_6-31g(d).gjf (generated)

012062247.b3lyp_6-31g(d).firefly.inp (generated)

012062247.b3lyp_6-31g(d).smash.inp (generated)

012062247.b3lyp_6-31g(d).nwchem.inp (generated) 012062247.b3lyp_6-31g(d).log.xz 012062247.td-b3lyp_6-31g+(d).inp 012062247.td-b3lyp_6-31g+(d).log.xz

012062247.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062247.td-b3lyp_6-31+g(d).gjf (generated)

012062247.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062247.mol 012062247.PUBCHEM 012062247.mol (via Jmol)
012062249.b3lyp_6-31g(d).inp

012062249.b3lyp_6-31g(d).qchem.inp (generated)

012062249.b3lyp_6-31g(d).gjf (generated)

012062249.b3lyp_6-31g(d).firefly.inp (generated)

012062249.b3lyp_6-31g(d).smash.inp (generated)

012062249.b3lyp_6-31g(d).nwchem.inp (generated) 012062249.b3lyp_6-31g(d).log.xz 012062249.td-b3lyp_6-31g+(d).inp 012062249.td-b3lyp_6-31g+(d).log.xz

012062249.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062249.td-b3lyp_6-31+g(d).gjf (generated)

012062249.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062249.mol 012062249.PUBCHEM 012062249.mol (via Jmol)
012062344.b3lyp_6-31g(d).inp

012062344.b3lyp_6-31g(d).qchem.inp (generated)

012062344.b3lyp_6-31g(d).gjf (generated)

012062344.b3lyp_6-31g(d).firefly.inp (generated)

012062344.b3lyp_6-31g(d).smash.inp (generated)

012062344.b3lyp_6-31g(d).nwchem.inp (generated) 012062344.b3lyp_6-31g(d).log.xz 012062344.td-b3lyp_6-31g+(d).inp 012062344.td-b3lyp_6-31g+(d).log.xz

012062344.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062344.td-b3lyp_6-31+g(d).gjf (generated)

012062344.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062344.mol 012062344.PUBCHEM 012062344.mol (via Jmol)
012062345.b3lyp_6-31g(d).inp

012062345.b3lyp_6-31g(d).qchem.inp (generated)

012062345.b3lyp_6-31g(d).gjf (generated)

012062345.b3lyp_6-31g(d).firefly.inp (generated)

012062345.b3lyp_6-31g(d).smash.inp (generated)

012062345.b3lyp_6-31g(d).nwchem.inp (generated) 012062345.b3lyp_6-31g(d).log.xz 012062345.td-b3lyp_6-31g+(d).inp 012062345.td-b3lyp_6-31g+(d).log.xz

012062345.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062345.td-b3lyp_6-31+g(d).gjf (generated)

012062345.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062345.mol 012062345.PUBCHEM 012062345.mol (via Jmol)
012062346.b3lyp_6-31g(d).inp

012062346.b3lyp_6-31g(d).qchem.inp (generated)

012062346.b3lyp_6-31g(d).gjf (generated)

012062346.b3lyp_6-31g(d).firefly.inp (generated)

012062346.b3lyp_6-31g(d).smash.inp (generated)

012062346.b3lyp_6-31g(d).nwchem.inp (generated) 012062346.b3lyp_6-31g(d).log.xz 012062346.td-b3lyp_6-31g+(d).inp 012062346.td-b3lyp_6-31g+(d).log.xz

012062346.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062346.td-b3lyp_6-31+g(d).gjf (generated)

012062346.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062346.mol 012062346.PUBCHEM 012062346.mol (via Jmol)
012062347.b3lyp_6-31g(d).inp

012062347.b3lyp_6-31g(d).qchem.inp (generated)

012062347.b3lyp_6-31g(d).gjf (generated)

012062347.b3lyp_6-31g(d).firefly.inp (generated)

012062347.b3lyp_6-31g(d).smash.inp (generated)

012062347.b3lyp_6-31g(d).nwchem.inp (generated) 012062347.b3lyp_6-31g(d).log.xz 012062347.td-b3lyp_6-31g+(d).inp 012062347.td-b3lyp_6-31g+(d).log.xz

012062347.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062347.td-b3lyp_6-31+g(d).gjf (generated)

012062347.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062347.mol 012062347.PUBCHEM 012062347.mol (via Jmol)
012062378.b3lyp_6-31g(d).inp

012062378.b3lyp_6-31g(d).qchem.inp (generated)

012062378.b3lyp_6-31g(d).gjf (generated)

012062378.b3lyp_6-31g(d).firefly.inp (generated)

012062378.b3lyp_6-31g(d).smash.inp (generated)

012062378.b3lyp_6-31g(d).nwchem.inp (generated) 012062378.b3lyp_6-31g(d).log.xz 012062378.td-b3lyp_6-31g+(d).inp 012062378.td-b3lyp_6-31g+(d).log.xz

012062378.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062378.td-b3lyp_6-31+g(d).gjf (generated)

012062378.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062378.mol 012062378.PUBCHEM 012062378.mol (via Jmol)
012062672.b3lyp_6-31g(d).inp

012062672.b3lyp_6-31g(d).qchem.inp (generated)

012062672.b3lyp_6-31g(d).gjf (generated)

012062672.b3lyp_6-31g(d).firefly.inp (generated)

012062672.b3lyp_6-31g(d).smash.inp (generated)

012062672.b3lyp_6-31g(d).nwchem.inp (generated) 012062672.b3lyp_6-31g(d).log.xz 012062672.td-b3lyp_6-31g+(d).inp 012062672.td-b3lyp_6-31g+(d).log.xz

012062672.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062672.td-b3lyp_6-31+g(d).gjf (generated)

012062672.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062672.mol 012062672.PUBCHEM 012062672.mol (via Jmol)
012062674.b3lyp_6-31g(d).inp

012062674.b3lyp_6-31g(d).qchem.inp (generated)

012062674.b3lyp_6-31g(d).gjf (generated)

012062674.b3lyp_6-31g(d).firefly.inp (generated)

012062674.b3lyp_6-31g(d).smash.inp (generated)

012062674.b3lyp_6-31g(d).nwchem.inp (generated) 012062674.b3lyp_6-31g(d).log.xz 012062674.td-b3lyp_6-31g+(d).inp 012062674.td-b3lyp_6-31g+(d).log.xz

012062674.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062674.td-b3lyp_6-31+g(d).gjf (generated)

012062674.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062674.mol 012062674.PUBCHEM 012062674.mol (via Jmol)
012062675.b3lyp_6-31g(d).inp

012062675.b3lyp_6-31g(d).qchem.inp (generated)

012062675.b3lyp_6-31g(d).gjf (generated)

012062675.b3lyp_6-31g(d).firefly.inp (generated)

012062675.b3lyp_6-31g(d).smash.inp (generated)

012062675.b3lyp_6-31g(d).nwchem.inp (generated) 012062675.b3lyp_6-31g(d).log.xz 012062675.mol 012062675.PUBCHEM 012062675.mol (via Jmol)
012062697.b3lyp_6-31g(d).inp

012062697.b3lyp_6-31g(d).qchem.inp (generated)

012062697.b3lyp_6-31g(d).gjf (generated)

012062697.b3lyp_6-31g(d).firefly.inp (generated)

012062697.b3lyp_6-31g(d).smash.inp (generated)

012062697.b3lyp_6-31g(d).nwchem.inp (generated) 012062697.b3lyp_6-31g(d).log.xz 012062697.td-b3lyp_6-31g+(d).inp 012062697.td-b3lyp_6-31g+(d).log.xz

012062697.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062697.td-b3lyp_6-31+g(d).gjf (generated)

012062697.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062697.mol 012062697.PUBCHEM 012062697.mol (via Jmol)
012062733.b3lyp_6-31g(d).inp

012062733.b3lyp_6-31g(d).qchem.inp (generated)

012062733.b3lyp_6-31g(d).gjf (generated)

012062733.b3lyp_6-31g(d).firefly.inp (generated)

012062733.b3lyp_6-31g(d).smash.inp (generated)

012062733.b3lyp_6-31g(d).nwchem.inp (generated) 012062733.b3lyp_6-31g(d).log.xz 012062733.td-b3lyp_6-31g+(d).inp 012062733.td-b3lyp_6-31g+(d).log.xz

012062733.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062733.td-b3lyp_6-31+g(d).gjf (generated)

012062733.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062733.mol 012062733.PUBCHEM 012062733.mol (via Jmol)
012062735.b3lyp_6-31g(d).inp

012062735.b3lyp_6-31g(d).qchem.inp (generated)

012062735.b3lyp_6-31g(d).gjf (generated)

012062735.b3lyp_6-31g(d).firefly.inp (generated)

012062735.b3lyp_6-31g(d).smash.inp (generated)

012062735.b3lyp_6-31g(d).nwchem.inp (generated) 012062735.b3lyp_6-31g(d).log.xz 012062735.td-b3lyp_6-31g+(d).inp 012062735.td-b3lyp_6-31g+(d).log.xz

012062735.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062735.td-b3lyp_6-31+g(d).gjf (generated)

012062735.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062735.mol 012062735.PUBCHEM 012062735.mol (via Jmol)
012062760.b3lyp_6-31g(d).inp

012062760.b3lyp_6-31g(d).qchem.inp (generated)

012062760.b3lyp_6-31g(d).gjf (generated)

012062760.b3lyp_6-31g(d).firefly.inp (generated)

012062760.b3lyp_6-31g(d).smash.inp (generated)

012062760.b3lyp_6-31g(d).nwchem.inp (generated) 012062760.b3lyp_6-31g(d).log.xz 012062760.td-b3lyp_6-31g+(d).inp 012062760.td-b3lyp_6-31g+(d).log.xz

012062760.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062760.td-b3lyp_6-31+g(d).gjf (generated)

012062760.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062760.mol 012062760.PUBCHEM 012062760.mol (via Jmol)
012062858.b3lyp_6-31g(d).inp

012062858.b3lyp_6-31g(d).qchem.inp (generated)

012062858.b3lyp_6-31g(d).gjf (generated)

012062858.b3lyp_6-31g(d).firefly.inp (generated)

012062858.b3lyp_6-31g(d).smash.inp (generated)

012062858.b3lyp_6-31g(d).nwchem.inp (generated) 012062858.b3lyp_6-31g(d).log.xz 012062858.td-b3lyp_6-31g+(d).inp 012062858.td-b3lyp_6-31g+(d).log.xz

012062858.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062858.td-b3lyp_6-31+g(d).gjf (generated)

012062858.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062858.mol 012062858.PUBCHEM 012062858.mol (via Jmol)
012062907.b3lyp_6-31g(d).inp

012062907.b3lyp_6-31g(d).qchem.inp (generated)

012062907.b3lyp_6-31g(d).gjf (generated)

012062907.b3lyp_6-31g(d).firefly.inp (generated)

012062907.b3lyp_6-31g(d).smash.inp (generated)

012062907.b3lyp_6-31g(d).nwchem.inp (generated) 012062907.b3lyp_6-31g(d).log.xz 012062907.td-b3lyp_6-31g+(d).inp 012062907.td-b3lyp_6-31g+(d).log.xz

012062907.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062907.td-b3lyp_6-31+g(d).gjf (generated)

012062907.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062907.mol 012062907.PUBCHEM 012062907.mol (via Jmol)
012062914.b3lyp_6-31g(d).inp

012062914.b3lyp_6-31g(d).qchem.inp (generated)

012062914.b3lyp_6-31g(d).gjf (generated)

012062914.b3lyp_6-31g(d).firefly.inp (generated)

012062914.b3lyp_6-31g(d).smash.inp (generated)

012062914.b3lyp_6-31g(d).nwchem.inp (generated) 012062914.b3lyp_6-31g(d).log.xz 012062914.td-b3lyp_6-31g+(d).inp 012062914.td-b3lyp_6-31g+(d).log.xz

012062914.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062914.td-b3lyp_6-31+g(d).gjf (generated)

012062914.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062914.mol 012062914.PUBCHEM 012062914.mol (via Jmol)
012062938.b3lyp_6-31g(d).inp

012062938.b3lyp_6-31g(d).qchem.inp (generated)

012062938.b3lyp_6-31g(d).gjf (generated)

012062938.b3lyp_6-31g(d).firefly.inp (generated)

012062938.b3lyp_6-31g(d).smash.inp (generated)

012062938.b3lyp_6-31g(d).nwchem.inp (generated) 012062938.b3lyp_6-31g(d).log.xz 012062938.td-b3lyp_6-31g+(d).inp 012062938.td-b3lyp_6-31g+(d).log.xz

012062938.td-b3lyp_6-31+g(d).qchem.inp (generated)

012062938.td-b3lyp_6-31+g(d).gjf (generated)

012062938.td-b3lyp_6-31+g(d).firefly.inp (generated)

012062938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012062938.mol 012062938.PUBCHEM 012062938.mol (via Jmol)
012063018.b3lyp_6-31g(d).inp

012063018.b3lyp_6-31g(d).qchem.inp (generated)

012063018.b3lyp_6-31g(d).gjf (generated)

012063018.b3lyp_6-31g(d).firefly.inp (generated)

012063018.b3lyp_6-31g(d).smash.inp (generated)

012063018.b3lyp_6-31g(d).nwchem.inp (generated) 012063018.b3lyp_6-31g(d).log.xz 012063018.td-b3lyp_6-31g+(d).inp 012063018.td-b3lyp_6-31g+(d).log.xz

012063018.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063018.td-b3lyp_6-31+g(d).gjf (generated)

012063018.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063018.mol 012063018.PUBCHEM 012063018.mol (via Jmol)
012063076.b3lyp_6-31g(d).inp

012063076.b3lyp_6-31g(d).qchem.inp (generated)

012063076.b3lyp_6-31g(d).gjf (generated)

012063076.b3lyp_6-31g(d).firefly.inp (generated)

012063076.b3lyp_6-31g(d).smash.inp (generated)

012063076.b3lyp_6-31g(d).nwchem.inp (generated) 012063076.b3lyp_6-31g(d).log.xz 012063076.td-b3lyp_6-31g+(d).inp 012063076.td-b3lyp_6-31g+(d).log.xz

012063076.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063076.td-b3lyp_6-31+g(d).gjf (generated)

012063076.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063076.mol 012063076.PUBCHEM 012063076.mol (via Jmol)
012063077.b3lyp_6-31g(d).inp

012063077.b3lyp_6-31g(d).qchem.inp (generated)

012063077.b3lyp_6-31g(d).gjf (generated)

012063077.b3lyp_6-31g(d).firefly.inp (generated)

012063077.b3lyp_6-31g(d).smash.inp (generated)

012063077.b3lyp_6-31g(d).nwchem.inp (generated) 012063077.b3lyp_6-31g(d).log.xz 012063077.td-b3lyp_6-31g+(d).inp 012063077.td-b3lyp_6-31g+(d).log.xz

012063077.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063077.td-b3lyp_6-31+g(d).gjf (generated)

012063077.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063077.mol 012063077.PUBCHEM 012063077.mol (via Jmol)
012063130.b3lyp_6-31g(d).inp

012063130.b3lyp_6-31g(d).qchem.inp (generated)

012063130.b3lyp_6-31g(d).gjf (generated)

012063130.b3lyp_6-31g(d).firefly.inp (generated)

012063130.b3lyp_6-31g(d).smash.inp (generated)

012063130.b3lyp_6-31g(d).nwchem.inp (generated) 012063130.b3lyp_6-31g(d).log.xz 012063130.td-b3lyp_6-31g+(d).inp 012063130.td-b3lyp_6-31g+(d).log.xz

012063130.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063130.td-b3lyp_6-31+g(d).gjf (generated)

012063130.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063130.mol 012063130.PUBCHEM 012063130.mol (via Jmol)
012063159.b3lyp_6-31g(d).inp

012063159.b3lyp_6-31g(d).qchem.inp (generated)

012063159.b3lyp_6-31g(d).gjf (generated)

012063159.b3lyp_6-31g(d).firefly.inp (generated)

012063159.b3lyp_6-31g(d).smash.inp (generated)

012063159.b3lyp_6-31g(d).nwchem.inp (generated) 012063159.b3lyp_6-31g(d).log.xz 012063159.td-b3lyp_6-31g+(d).inp 012063159.td-b3lyp_6-31g+(d).log.xz

012063159.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063159.td-b3lyp_6-31+g(d).gjf (generated)

012063159.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063159.mol 012063159.PUBCHEM 012063159.mol (via Jmol)
012063282.b3lyp_6-31g(d).inp

012063282.b3lyp_6-31g(d).qchem.inp (generated)

012063282.b3lyp_6-31g(d).gjf (generated)

012063282.b3lyp_6-31g(d).firefly.inp (generated)

012063282.b3lyp_6-31g(d).smash.inp (generated)

012063282.b3lyp_6-31g(d).nwchem.inp (generated) 012063282.b3lyp_6-31g(d).log.xz 012063282.td-b3lyp_6-31g+(d).inp 012063282.td-b3lyp_6-31g+(d).log.xz

012063282.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063282.td-b3lyp_6-31+g(d).gjf (generated)

012063282.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063282.mol 012063282.PUBCHEM 012063282.mol (via Jmol)
012063283.b3lyp_6-31g(d).inp

012063283.b3lyp_6-31g(d).qchem.inp (generated)

012063283.b3lyp_6-31g(d).gjf (generated)

012063283.b3lyp_6-31g(d).firefly.inp (generated)

012063283.b3lyp_6-31g(d).smash.inp (generated)

012063283.b3lyp_6-31g(d).nwchem.inp (generated) 012063283.b3lyp_6-31g(d).log.xz 012063283.td-b3lyp_6-31g+(d).inp 012063283.td-b3lyp_6-31g+(d).log.xz

012063283.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063283.td-b3lyp_6-31+g(d).gjf (generated)

012063283.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063283.mol 012063283.PUBCHEM 012063283.mol (via Jmol)
012063323.b3lyp_6-31g(d).inp

012063323.b3lyp_6-31g(d).qchem.inp (generated)

012063323.b3lyp_6-31g(d).gjf (generated)

012063323.b3lyp_6-31g(d).firefly.inp (generated)

012063323.b3lyp_6-31g(d).smash.inp (generated)

012063323.b3lyp_6-31g(d).nwchem.inp (generated) 012063323.b3lyp_6-31g(d).log.xz 012063323.td-b3lyp_6-31g+(d).inp 012063323.td-b3lyp_6-31g+(d).log.xz

012063323.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063323.td-b3lyp_6-31+g(d).gjf (generated)

012063323.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063323.mol 012063323.PUBCHEM 012063323.mol (via Jmol)
012063394.b3lyp_6-31g(d).inp

012063394.b3lyp_6-31g(d).qchem.inp (generated)

012063394.b3lyp_6-31g(d).gjf (generated)

012063394.b3lyp_6-31g(d).firefly.inp (generated)

012063394.b3lyp_6-31g(d).smash.inp (generated)

012063394.b3lyp_6-31g(d).nwchem.inp (generated) 012063394.b3lyp_6-31g(d).log.xz 012063394.mol 012063394.PUBCHEM 012063394.mol (via Jmol)
012063447.b3lyp_6-31g(d).inp

012063447.b3lyp_6-31g(d).qchem.inp (generated)

012063447.b3lyp_6-31g(d).gjf (generated)

012063447.b3lyp_6-31g(d).firefly.inp (generated)

012063447.b3lyp_6-31g(d).smash.inp (generated)

012063447.b3lyp_6-31g(d).nwchem.inp (generated) 012063447.b3lyp_6-31g(d).log.xz 012063447.td-b3lyp_6-31g+(d).inp 012063447.td-b3lyp_6-31g+(d).log.xz

012063447.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063447.td-b3lyp_6-31+g(d).gjf (generated)

012063447.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063447.mol 012063447.PUBCHEM 012063447.mol (via Jmol)
012063448.b3lyp_6-31g(d).inp

012063448.b3lyp_6-31g(d).qchem.inp (generated)

012063448.b3lyp_6-31g(d).gjf (generated)

012063448.b3lyp_6-31g(d).firefly.inp (generated)

012063448.b3lyp_6-31g(d).smash.inp (generated)

012063448.b3lyp_6-31g(d).nwchem.inp (generated) 012063448.b3lyp_6-31g(d).log.xz 012063448.td-b3lyp_6-31g+(d).inp 012063448.td-b3lyp_6-31g+(d).log.xz

012063448.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063448.td-b3lyp_6-31+g(d).gjf (generated)

012063448.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063448.mol 012063448.PUBCHEM 012063448.mol (via Jmol)
012063478.b3lyp_6-31g(d).inp

012063478.b3lyp_6-31g(d).qchem.inp (generated)

012063478.b3lyp_6-31g(d).gjf (generated)

012063478.b3lyp_6-31g(d).firefly.inp (generated)

012063478.b3lyp_6-31g(d).smash.inp (generated)

012063478.b3lyp_6-31g(d).nwchem.inp (generated) 012063478.b3lyp_6-31g(d).log.xz 012063478.td-b3lyp_6-31g+(d).inp 012063478.td-b3lyp_6-31g+(d).log.xz

012063478.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063478.td-b3lyp_6-31+g(d).gjf (generated)

012063478.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063478.mol 012063478.PUBCHEM 012063478.mol (via Jmol)
012063543.b3lyp_6-31g(d).inp

012063543.b3lyp_6-31g(d).qchem.inp (generated)

012063543.b3lyp_6-31g(d).gjf (generated)

012063543.b3lyp_6-31g(d).firefly.inp (generated)

012063543.b3lyp_6-31g(d).smash.inp (generated)

012063543.b3lyp_6-31g(d).nwchem.inp (generated) 012063543.b3lyp_6-31g(d).log.xz 012063543.td-b3lyp_6-31g+(d).inp 012063543.td-b3lyp_6-31g+(d).log.xz

012063543.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063543.td-b3lyp_6-31+g(d).gjf (generated)

012063543.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063543.mol 012063543.PUBCHEM 012063543.mol (via Jmol)
012063558.b3lyp_6-31g(d).inp

012063558.b3lyp_6-31g(d).qchem.inp (generated)

012063558.b3lyp_6-31g(d).gjf (generated)

012063558.b3lyp_6-31g(d).firefly.inp (generated)

012063558.b3lyp_6-31g(d).smash.inp (generated)

012063558.b3lyp_6-31g(d).nwchem.inp (generated) 012063558.b3lyp_6-31g(d).log.xz 012063558.td-b3lyp_6-31g+(d).inp 012063558.td-b3lyp_6-31g+(d).log.xz

012063558.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063558.td-b3lyp_6-31+g(d).gjf (generated)

012063558.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063558.mol 012063558.PUBCHEM 012063558.mol (via Jmol)
012063559.b3lyp_6-31g(d).inp

012063559.b3lyp_6-31g(d).qchem.inp (generated)

012063559.b3lyp_6-31g(d).gjf (generated)

012063559.b3lyp_6-31g(d).firefly.inp (generated)

012063559.b3lyp_6-31g(d).smash.inp (generated)

012063559.b3lyp_6-31g(d).nwchem.inp (generated) 012063559.b3lyp_6-31g(d).log.xz 012063559.td-b3lyp_6-31g+(d).inp 012063559.td-b3lyp_6-31g+(d).log.xz

012063559.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063559.td-b3lyp_6-31+g(d).gjf (generated)

012063559.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063559.mol 012063559.PUBCHEM 012063559.mol (via Jmol)
012063560.b3lyp_6-31g(d).inp

012063560.b3lyp_6-31g(d).qchem.inp (generated)

012063560.b3lyp_6-31g(d).gjf (generated)

012063560.b3lyp_6-31g(d).firefly.inp (generated)

012063560.b3lyp_6-31g(d).smash.inp (generated)

012063560.b3lyp_6-31g(d).nwchem.inp (generated) 012063560.b3lyp_6-31g(d).log.xz 012063560.td-b3lyp_6-31g+(d).inp 012063560.td-b3lyp_6-31g+(d).log.xz

012063560.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063560.td-b3lyp_6-31+g(d).gjf (generated)

012063560.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063560.mol 012063560.PUBCHEM 012063560.mol (via Jmol)
012063570.b3lyp_6-31g(d).inp

012063570.b3lyp_6-31g(d).qchem.inp (generated)

012063570.b3lyp_6-31g(d).gjf (generated)

012063570.b3lyp_6-31g(d).firefly.inp (generated)

012063570.b3lyp_6-31g(d).smash.inp (generated)

012063570.b3lyp_6-31g(d).nwchem.inp (generated) 012063570.b3lyp_6-31g(d).log.xz 012063570.td-b3lyp_6-31g+(d).inp 012063570.td-b3lyp_6-31g+(d).log.xz

012063570.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063570.td-b3lyp_6-31+g(d).gjf (generated)

012063570.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063570.mol 012063570.PUBCHEM 012063570.mol (via Jmol)
012063572.b3lyp_6-31g(d).inp

012063572.b3lyp_6-31g(d).qchem.inp (generated)

012063572.b3lyp_6-31g(d).gjf (generated)

012063572.b3lyp_6-31g(d).firefly.inp (generated)

012063572.b3lyp_6-31g(d).smash.inp (generated)

012063572.b3lyp_6-31g(d).nwchem.inp (generated) 012063572.b3lyp_6-31g(d).log.xz 012063572.td-b3lyp_6-31g+(d).inp 012063572.td-b3lyp_6-31g+(d).log.xz

012063572.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063572.td-b3lyp_6-31+g(d).gjf (generated)

012063572.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063572.mol 012063572.PUBCHEM 012063572.mol (via Jmol)
012063669.b3lyp_6-31g(d).inp

012063669.b3lyp_6-31g(d).qchem.inp (generated)

012063669.b3lyp_6-31g(d).gjf (generated)

012063669.b3lyp_6-31g(d).firefly.inp (generated)

012063669.b3lyp_6-31g(d).smash.inp (generated)

012063669.b3lyp_6-31g(d).nwchem.inp (generated) 012063669.b3lyp_6-31g(d).log.xz 012063669.mol 012063669.PUBCHEM 012063669.mol (via Jmol)
012063678.b3lyp_6-31g(d).inp

012063678.b3lyp_6-31g(d).qchem.inp (generated)

012063678.b3lyp_6-31g(d).gjf (generated)

012063678.b3lyp_6-31g(d).firefly.inp (generated)

012063678.b3lyp_6-31g(d).smash.inp (generated)

012063678.b3lyp_6-31g(d).nwchem.inp (generated) 012063678.b3lyp_6-31g(d).log.xz 012063678.td-b3lyp_6-31g+(d).inp 012063678.td-b3lyp_6-31g+(d).log.xz

012063678.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063678.td-b3lyp_6-31+g(d).gjf (generated)

012063678.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063678.mol 012063678.PUBCHEM 012063678.mol (via Jmol)
012063749.b3lyp_6-31g(d).inp

012063749.b3lyp_6-31g(d).qchem.inp (generated)

012063749.b3lyp_6-31g(d).gjf (generated)

012063749.b3lyp_6-31g(d).firefly.inp (generated)

012063749.b3lyp_6-31g(d).smash.inp (generated)

012063749.b3lyp_6-31g(d).nwchem.inp (generated) 012063749.b3lyp_6-31g(d).log.xz 012063749.td-b3lyp_6-31g+(d).inp 012063749.td-b3lyp_6-31g+(d).log.xz

012063749.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063749.td-b3lyp_6-31+g(d).gjf (generated)

012063749.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063749.mol 012063749.PUBCHEM 012063749.mol (via Jmol)
012063760.b3lyp_6-31g(d).inp

012063760.b3lyp_6-31g(d).qchem.inp (generated)

012063760.b3lyp_6-31g(d).gjf (generated)

012063760.b3lyp_6-31g(d).firefly.inp (generated)

012063760.b3lyp_6-31g(d).smash.inp (generated)

012063760.b3lyp_6-31g(d).nwchem.inp (generated) 012063760.b3lyp_6-31g(d).log.xz 012063760.td-b3lyp_6-31g+(d).inp 012063760.td-b3lyp_6-31g+(d).log.xz

012063760.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063760.td-b3lyp_6-31+g(d).gjf (generated)

012063760.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063760.mol 012063760.PUBCHEM 012063760.mol (via Jmol)
012063782.b3lyp_6-31g(d).inp

012063782.b3lyp_6-31g(d).qchem.inp (generated)

012063782.b3lyp_6-31g(d).gjf (generated)

012063782.b3lyp_6-31g(d).firefly.inp (generated)

012063782.b3lyp_6-31g(d).smash.inp (generated)

012063782.b3lyp_6-31g(d).nwchem.inp (generated) 012063782.b3lyp_6-31g(d).log.xz 012063782.mol 012063782.PUBCHEM 012063782.mol (via Jmol)
012063831.b3lyp_6-31g(d).inp

012063831.b3lyp_6-31g(d).qchem.inp (generated)

012063831.b3lyp_6-31g(d).gjf (generated)

012063831.b3lyp_6-31g(d).firefly.inp (generated)

012063831.b3lyp_6-31g(d).smash.inp (generated)

012063831.b3lyp_6-31g(d).nwchem.inp (generated) 012063831.b3lyp_6-31g(d).log.xz 012063831.td-b3lyp_6-31g+(d).inp 012063831.td-b3lyp_6-31g+(d).log.xz

012063831.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063831.td-b3lyp_6-31+g(d).gjf (generated)

012063831.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063831.mol 012063831.PUBCHEM 012063831.mol (via Jmol)
012063880.b3lyp_6-31g(d).inp

012063880.b3lyp_6-31g(d).qchem.inp (generated)

012063880.b3lyp_6-31g(d).gjf (generated)

012063880.b3lyp_6-31g(d).firefly.inp (generated)

012063880.b3lyp_6-31g(d).smash.inp (generated)

012063880.b3lyp_6-31g(d).nwchem.inp (generated) 012063880.b3lyp_6-31g(d).log.xz 012063880.td-b3lyp_6-31g+(d).inp 012063880.td-b3lyp_6-31g+(d).log.xz

012063880.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063880.td-b3lyp_6-31+g(d).gjf (generated)

012063880.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063880.mol 012063880.PUBCHEM 012063880.mol (via Jmol)
012063882.b3lyp_6-31g(d).inp

012063882.b3lyp_6-31g(d).qchem.inp (generated)

012063882.b3lyp_6-31g(d).gjf (generated)

012063882.b3lyp_6-31g(d).firefly.inp (generated)

012063882.b3lyp_6-31g(d).smash.inp (generated)

012063882.b3lyp_6-31g(d).nwchem.inp (generated) 012063882.b3lyp_6-31g(d).log.xz 012063882.td-b3lyp_6-31g+(d).inp 012063882.td-b3lyp_6-31g+(d).log.xz

012063882.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063882.td-b3lyp_6-31+g(d).gjf (generated)

012063882.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063882.mol 012063882.PUBCHEM 012063882.mol (via Jmol)
012063886.b3lyp_6-31g(d).inp

012063886.b3lyp_6-31g(d).qchem.inp (generated)

012063886.b3lyp_6-31g(d).gjf (generated)

012063886.b3lyp_6-31g(d).firefly.inp (generated)

012063886.b3lyp_6-31g(d).smash.inp (generated)

012063886.b3lyp_6-31g(d).nwchem.inp (generated) 012063886.b3lyp_6-31g(d).log.xz 012063886.td-b3lyp_6-31g+(d).inp 012063886.td-b3lyp_6-31g+(d).log.xz

012063886.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063886.td-b3lyp_6-31+g(d).gjf (generated)

012063886.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063886.mol 012063886.PUBCHEM 012063886.mol (via Jmol)
012063890.b3lyp_6-31g(d).inp

012063890.b3lyp_6-31g(d).qchem.inp (generated)

012063890.b3lyp_6-31g(d).gjf (generated)

012063890.b3lyp_6-31g(d).firefly.inp (generated)

012063890.b3lyp_6-31g(d).smash.inp (generated)

012063890.b3lyp_6-31g(d).nwchem.inp (generated) 012063890.b3lyp_6-31g(d).log.xz 012063890.mol 012063890.PUBCHEM 012063890.mol (via Jmol)
012063893.b3lyp_6-31g(d).inp

012063893.b3lyp_6-31g(d).qchem.inp (generated)

012063893.b3lyp_6-31g(d).gjf (generated)

012063893.b3lyp_6-31g(d).firefly.inp (generated)

012063893.b3lyp_6-31g(d).smash.inp (generated)

012063893.b3lyp_6-31g(d).nwchem.inp (generated) 012063893.b3lyp_6-31g(d).log.xz 012063893.td-b3lyp_6-31g+(d).inp 012063893.td-b3lyp_6-31g+(d).log.xz

012063893.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063893.td-b3lyp_6-31+g(d).gjf (generated)

012063893.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063893.mol 012063893.PUBCHEM 012063893.mol (via Jmol)
012063895.b3lyp_6-31g(d).inp

012063895.b3lyp_6-31g(d).qchem.inp (generated)

012063895.b3lyp_6-31g(d).gjf (generated)

012063895.b3lyp_6-31g(d).firefly.inp (generated)

012063895.b3lyp_6-31g(d).smash.inp (generated)

012063895.b3lyp_6-31g(d).nwchem.inp (generated) 012063895.b3lyp_6-31g(d).log.xz 012063895.td-b3lyp_6-31g+(d).inp 012063895.td-b3lyp_6-31g+(d).log.xz

012063895.td-b3lyp_6-31+g(d).qchem.inp (generated)

012063895.td-b3lyp_6-31+g(d).gjf (generated)

012063895.td-b3lyp_6-31+g(d).firefly.inp (generated)

012063895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012063895.mol 012063895.PUBCHEM 012063895.mol (via Jmol)
012063953.b3lyp_6-31g(d).inp

012063953.b3lyp_6-31g(d).qchem.inp (generated)

012063953.b3lyp_6-31g(d).gjf (generated)

012063953.b3lyp_6-31g(d).firefly.inp (generated)

012063953.b3lyp_6-31g(d).smash.inp (generated)

012063953.b3lyp_6-31g(d).nwchem.inp (generated) 012063953.b3lyp_6-31g(d).log.xz 012063953.td-b3lyp_6-31g+(d).inp