Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 4143 (3928) in this page
045100045.b3lyp_6-31g(d).inp

045100045.b3lyp_6-31g(d).qchem.inp (generated)

045100045.b3lyp_6-31g(d).gjf (generated)

045100045.b3lyp_6-31g(d).firefly.inp (generated)

045100045.b3lyp_6-31g(d).smash.inp (generated)

045100045.b3lyp_6-31g(d).nwchem.inp (generated) 045100045.b3lyp_6-31g(d).log.xz 045100045.td-b3lyp_6-31g+(d).inp 045100045.td-b3lyp_6-31g+(d).log.xz

045100045.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100045.td-b3lyp_6-31+g(d).gjf (generated)

045100045.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100045.mol 045100045.PUBCHEM 045100045.mol (via Jmol)
045100238.b3lyp_6-31g(d).inp

045100238.b3lyp_6-31g(d).qchem.inp (generated)

045100238.b3lyp_6-31g(d).gjf (generated)

045100238.b3lyp_6-31g(d).firefly.inp (generated)

045100238.b3lyp_6-31g(d).smash.inp (generated)

045100238.b3lyp_6-31g(d).nwchem.inp (generated) 045100238.b3lyp_6-31g(d).log.xz 045100238.td-b3lyp_6-31g+(d).inp 045100238.td-b3lyp_6-31g+(d).log.xz

045100238.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100238.td-b3lyp_6-31+g(d).gjf (generated)

045100238.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100238.mol 045100238.PUBCHEM 045100238.mol (via Jmol)
045100269.b3lyp_6-31g(d).inp

045100269.b3lyp_6-31g(d).qchem.inp (generated)

045100269.b3lyp_6-31g(d).gjf (generated)

045100269.b3lyp_6-31g(d).firefly.inp (generated)

045100269.b3lyp_6-31g(d).smash.inp (generated)

045100269.b3lyp_6-31g(d).nwchem.inp (generated) 045100269.b3lyp_6-31g(d).log.xz 045100269.td-b3lyp_6-31g+(d).inp 045100269.td-b3lyp_6-31g+(d).log.xz

045100269.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100269.td-b3lyp_6-31+g(d).gjf (generated)

045100269.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100269.mol 045100269.PUBCHEM 045100269.mol (via Jmol)
045100274.b3lyp_6-31g(d).inp

045100274.b3lyp_6-31g(d).qchem.inp (generated)

045100274.b3lyp_6-31g(d).gjf (generated)

045100274.b3lyp_6-31g(d).firefly.inp (generated)

045100274.b3lyp_6-31g(d).smash.inp (generated)

045100274.b3lyp_6-31g(d).nwchem.inp (generated) 045100274.b3lyp_6-31g(d).log.xz 045100274.td-b3lyp_6-31g+(d).inp 045100274.td-b3lyp_6-31g+(d).log.xz

045100274.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100274.td-b3lyp_6-31+g(d).gjf (generated)

045100274.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100274.mol 045100274.PUBCHEM 045100274.mol (via Jmol)
045100288.b3lyp_6-31g(d).inp

045100288.b3lyp_6-31g(d).qchem.inp (generated)

045100288.b3lyp_6-31g(d).gjf (generated)

045100288.b3lyp_6-31g(d).firefly.inp (generated)

045100288.b3lyp_6-31g(d).smash.inp (generated)

045100288.b3lyp_6-31g(d).nwchem.inp (generated) 045100288.b3lyp_6-31g(d).log.xz 045100288.td-b3lyp_6-31g+(d).inp 045100288.td-b3lyp_6-31g+(d).log.xz

045100288.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100288.td-b3lyp_6-31+g(d).gjf (generated)

045100288.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100288.mol 045100288.PUBCHEM 045100288.mol (via Jmol)
045100325.b3lyp_6-31g(d).inp

045100325.b3lyp_6-31g(d).qchem.inp (generated)

045100325.b3lyp_6-31g(d).gjf (generated)

045100325.b3lyp_6-31g(d).firefly.inp (generated)

045100325.b3lyp_6-31g(d).smash.inp (generated)

045100325.b3lyp_6-31g(d).nwchem.inp (generated) 045100325.b3lyp_6-31g(d).log.xz 045100325.td-b3lyp_6-31g+(d).inp 045100325.td-b3lyp_6-31g+(d).log.xz

045100325.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100325.td-b3lyp_6-31+g(d).gjf (generated)

045100325.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100325.mol 045100325.PUBCHEM 045100325.mol (via Jmol)
045100332.b3lyp_6-31g(d).inp

045100332.b3lyp_6-31g(d).qchem.inp (generated)

045100332.b3lyp_6-31g(d).gjf (generated)

045100332.b3lyp_6-31g(d).firefly.inp (generated)

045100332.b3lyp_6-31g(d).smash.inp (generated)

045100332.b3lyp_6-31g(d).nwchem.inp (generated) 045100332.b3lyp_6-31g(d).log.xz 045100332.td-b3lyp_6-31g+(d).inp 045100332.td-b3lyp_6-31g+(d).log.xz

045100332.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100332.td-b3lyp_6-31+g(d).gjf (generated)

045100332.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100332.mol 045100332.PUBCHEM 045100332.mol (via Jmol)
045100334.b3lyp_6-31g(d).inp

045100334.b3lyp_6-31g(d).qchem.inp (generated)

045100334.b3lyp_6-31g(d).gjf (generated)

045100334.b3lyp_6-31g(d).firefly.inp (generated)

045100334.b3lyp_6-31g(d).smash.inp (generated)

045100334.b3lyp_6-31g(d).nwchem.inp (generated) 045100334.b3lyp_6-31g(d).log.xz 045100334.td-b3lyp_6-31g+(d).inp 045100334.td-b3lyp_6-31g+(d).log.xz

045100334.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100334.td-b3lyp_6-31+g(d).gjf (generated)

045100334.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100334.mol 045100334.PUBCHEM 045100334.mol (via Jmol)
045100336.b3lyp_6-31g(d).inp

045100336.b3lyp_6-31g(d).qchem.inp (generated)

045100336.b3lyp_6-31g(d).gjf (generated)

045100336.b3lyp_6-31g(d).firefly.inp (generated)

045100336.b3lyp_6-31g(d).smash.inp (generated)

045100336.b3lyp_6-31g(d).nwchem.inp (generated) 045100336.b3lyp_6-31g(d).log.xz 045100336.td-b3lyp_6-31g+(d).inp 045100336.td-b3lyp_6-31g+(d).log.xz

045100336.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100336.td-b3lyp_6-31+g(d).gjf (generated)

045100336.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100336.mol 045100336.PUBCHEM 045100336.mol (via Jmol)
045100341.b3lyp_6-31g(d).inp

045100341.b3lyp_6-31g(d).qchem.inp (generated)

045100341.b3lyp_6-31g(d).gjf (generated)

045100341.b3lyp_6-31g(d).firefly.inp (generated)

045100341.b3lyp_6-31g(d).smash.inp (generated)

045100341.b3lyp_6-31g(d).nwchem.inp (generated) 045100341.b3lyp_6-31g(d).log.xz 045100341.td-b3lyp_6-31g+(d).inp 045100341.td-b3lyp_6-31g+(d).log.xz

045100341.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100341.td-b3lyp_6-31+g(d).gjf (generated)

045100341.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100341.mol 045100341.PUBCHEM 045100341.mol (via Jmol)
045100344.b3lyp_6-31g(d).inp

045100344.b3lyp_6-31g(d).qchem.inp (generated)

045100344.b3lyp_6-31g(d).gjf (generated)

045100344.b3lyp_6-31g(d).firefly.inp (generated)

045100344.b3lyp_6-31g(d).smash.inp (generated)

045100344.b3lyp_6-31g(d).nwchem.inp (generated) 045100344.b3lyp_6-31g(d).log.xz 045100344.td-b3lyp_6-31g+(d).inp 045100344.td-b3lyp_6-31g+(d).log.xz

045100344.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100344.td-b3lyp_6-31+g(d).gjf (generated)

045100344.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100344.mol 045100344.PUBCHEM 045100344.mol (via Jmol)
045100463.b3lyp_6-31g(d).inp

045100463.b3lyp_6-31g(d).qchem.inp (generated)

045100463.b3lyp_6-31g(d).gjf (generated)

045100463.b3lyp_6-31g(d).firefly.inp (generated)

045100463.b3lyp_6-31g(d).smash.inp (generated)

045100463.b3lyp_6-31g(d).nwchem.inp (generated) 045100463.b3lyp_6-31g(d).log.xz 045100463.td-b3lyp_6-31g+(d).inp 045100463.td-b3lyp_6-31g+(d).log.xz

045100463.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100463.td-b3lyp_6-31+g(d).gjf (generated)

045100463.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100463.mol 045100463.PUBCHEM 045100463.mol (via Jmol)
045100472.b3lyp_6-31g(d).inp

045100472.b3lyp_6-31g(d).qchem.inp (generated)

045100472.b3lyp_6-31g(d).gjf (generated)

045100472.b3lyp_6-31g(d).firefly.inp (generated)

045100472.b3lyp_6-31g(d).smash.inp (generated)

045100472.b3lyp_6-31g(d).nwchem.inp (generated) 045100472.b3lyp_6-31g(d).log.xz 045100472.td-b3lyp_6-31g+(d).inp 045100472.td-b3lyp_6-31g+(d).log.xz

045100472.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100472.td-b3lyp_6-31+g(d).gjf (generated)

045100472.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100472.mol 045100472.PUBCHEM 045100472.mol (via Jmol)
045100473.b3lyp_6-31g(d).inp

045100473.b3lyp_6-31g(d).qchem.inp (generated)

045100473.b3lyp_6-31g(d).gjf (generated)

045100473.b3lyp_6-31g(d).firefly.inp (generated)

045100473.b3lyp_6-31g(d).smash.inp (generated)

045100473.b3lyp_6-31g(d).nwchem.inp (generated) 045100473.b3lyp_6-31g(d).log.xz 045100473.td-b3lyp_6-31g+(d).inp 045100473.td-b3lyp_6-31g+(d).log.xz

045100473.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100473.td-b3lyp_6-31+g(d).gjf (generated)

045100473.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100473.mol 045100473.PUBCHEM 045100473.mol (via Jmol)
045100487.b3lyp_6-31g(d).inp

045100487.b3lyp_6-31g(d).qchem.inp (generated)

045100487.b3lyp_6-31g(d).gjf (generated)

045100487.b3lyp_6-31g(d).firefly.inp (generated)

045100487.b3lyp_6-31g(d).smash.inp (generated)

045100487.b3lyp_6-31g(d).nwchem.inp (generated) 045100487.b3lyp_6-31g(d).log.xz 045100487.td-b3lyp_6-31g+(d).inp 045100487.td-b3lyp_6-31g+(d).log.xz

045100487.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100487.td-b3lyp_6-31+g(d).gjf (generated)

045100487.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100487.mol 045100487.PUBCHEM 045100487.mol (via Jmol)
045100509.b3lyp_6-31g(d).inp

045100509.b3lyp_6-31g(d).qchem.inp (generated)

045100509.b3lyp_6-31g(d).gjf (generated)

045100509.b3lyp_6-31g(d).firefly.inp (generated)

045100509.b3lyp_6-31g(d).smash.inp (generated)

045100509.b3lyp_6-31g(d).nwchem.inp (generated) 045100509.b3lyp_6-31g(d).log.xz 045100509.td-b3lyp_6-31g+(d).inp 045100509.td-b3lyp_6-31g+(d).log.xz

045100509.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100509.td-b3lyp_6-31+g(d).gjf (generated)

045100509.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100509.mol 045100509.PUBCHEM 045100509.mol (via Jmol)
045100556.b3lyp_6-31g(d).inp

045100556.b3lyp_6-31g(d).qchem.inp (generated)

045100556.b3lyp_6-31g(d).gjf (generated)

045100556.b3lyp_6-31g(d).firefly.inp (generated)

045100556.b3lyp_6-31g(d).smash.inp (generated)

045100556.b3lyp_6-31g(d).nwchem.inp (generated) 045100556.b3lyp_6-31g(d).log.xz 045100556.td-b3lyp_6-31g+(d).inp 045100556.td-b3lyp_6-31g+(d).log.xz

045100556.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100556.td-b3lyp_6-31+g(d).gjf (generated)

045100556.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100556.mol 045100556.PUBCHEM 045100556.mol (via Jmol)
045100587.b3lyp_6-31g(d).inp

045100587.b3lyp_6-31g(d).qchem.inp (generated)

045100587.b3lyp_6-31g(d).gjf (generated)

045100587.b3lyp_6-31g(d).firefly.inp (generated)

045100587.b3lyp_6-31g(d).smash.inp (generated)

045100587.b3lyp_6-31g(d).nwchem.inp (generated) 045100587.b3lyp_6-31g(d).log.xz 045100587.td-b3lyp_6-31g+(d).inp 045100587.td-b3lyp_6-31g+(d).log.xz

045100587.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100587.td-b3lyp_6-31+g(d).gjf (generated)

045100587.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100587.mol 045100587.PUBCHEM 045100587.mol (via Jmol)
045100589.b3lyp_6-31g(d).inp

045100589.b3lyp_6-31g(d).qchem.inp (generated)

045100589.b3lyp_6-31g(d).gjf (generated)

045100589.b3lyp_6-31g(d).firefly.inp (generated)

045100589.b3lyp_6-31g(d).smash.inp (generated)

045100589.b3lyp_6-31g(d).nwchem.inp (generated) 045100589.b3lyp_6-31g(d).log.xz 045100589.td-b3lyp_6-31g+(d).inp 045100589.td-b3lyp_6-31g+(d).log.xz

045100589.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100589.td-b3lyp_6-31+g(d).gjf (generated)

045100589.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100589.mol 045100589.PUBCHEM 045100589.mol (via Jmol)
045100590.b3lyp_6-31g(d).inp

045100590.b3lyp_6-31g(d).qchem.inp (generated)

045100590.b3lyp_6-31g(d).gjf (generated)

045100590.b3lyp_6-31g(d).firefly.inp (generated)

045100590.b3lyp_6-31g(d).smash.inp (generated)

045100590.b3lyp_6-31g(d).nwchem.inp (generated) 045100590.b3lyp_6-31g(d).log.xz 045100590.td-b3lyp_6-31g+(d).inp 045100590.td-b3lyp_6-31g+(d).log.xz

045100590.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100590.td-b3lyp_6-31+g(d).gjf (generated)

045100590.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100590.mol 045100590.PUBCHEM 045100590.mol (via Jmol)
045100725.b3lyp_6-31g(d).inp

045100725.b3lyp_6-31g(d).qchem.inp (generated)

045100725.b3lyp_6-31g(d).gjf (generated)

045100725.b3lyp_6-31g(d).firefly.inp (generated)

045100725.b3lyp_6-31g(d).smash.inp (generated)

045100725.b3lyp_6-31g(d).nwchem.inp (generated) 045100725.b3lyp_6-31g(d).log.xz 045100725.mol 045100725.PUBCHEM 045100725.mol (via Jmol)
045100750.b3lyp_6-31g(d).inp

045100750.b3lyp_6-31g(d).qchem.inp (generated)

045100750.b3lyp_6-31g(d).gjf (generated)

045100750.b3lyp_6-31g(d).firefly.inp (generated)

045100750.b3lyp_6-31g(d).smash.inp (generated)

045100750.b3lyp_6-31g(d).nwchem.inp (generated) 045100750.b3lyp_6-31g(d).log.xz 045100750.td-b3lyp_6-31g+(d).inp 045100750.td-b3lyp_6-31g+(d).log.xz

045100750.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100750.td-b3lyp_6-31+g(d).gjf (generated)

045100750.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100750.mol 045100750.PUBCHEM 045100750.mol (via Jmol)
045100784.b3lyp_6-31g(d).inp

045100784.b3lyp_6-31g(d).qchem.inp (generated)

045100784.b3lyp_6-31g(d).gjf (generated)

045100784.b3lyp_6-31g(d).firefly.inp (generated)

045100784.b3lyp_6-31g(d).smash.inp (generated)

045100784.b3lyp_6-31g(d).nwchem.inp (generated) 045100784.b3lyp_6-31g(d).log.xz 045100784.td-b3lyp_6-31g+(d).inp 045100784.td-b3lyp_6-31g+(d).log.xz

045100784.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100784.td-b3lyp_6-31+g(d).gjf (generated)

045100784.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100784.mol 045100784.PUBCHEM 045100784.mol (via Jmol)
045100785.b3lyp_6-31g(d).inp

045100785.b3lyp_6-31g(d).qchem.inp (generated)

045100785.b3lyp_6-31g(d).gjf (generated)

045100785.b3lyp_6-31g(d).firefly.inp (generated)

045100785.b3lyp_6-31g(d).smash.inp (generated)

045100785.b3lyp_6-31g(d).nwchem.inp (generated) 045100785.b3lyp_6-31g(d).log.xz 045100785.mol 045100785.PUBCHEM 045100785.mol (via Jmol)
045100814.b3lyp_6-31g(d).inp

045100814.b3lyp_6-31g(d).qchem.inp (generated)

045100814.b3lyp_6-31g(d).gjf (generated)

045100814.b3lyp_6-31g(d).firefly.inp (generated)

045100814.b3lyp_6-31g(d).smash.inp (generated)

045100814.b3lyp_6-31g(d).nwchem.inp (generated) 045100814.b3lyp_6-31g(d).log.xz 045100814.td-b3lyp_6-31g+(d).inp 045100814.td-b3lyp_6-31g+(d).log.xz

045100814.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100814.td-b3lyp_6-31+g(d).gjf (generated)

045100814.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100814.mol 045100814.PUBCHEM 045100814.mol (via Jmol)
045100937.b3lyp_6-31g(d).inp

045100937.b3lyp_6-31g(d).qchem.inp (generated)

045100937.b3lyp_6-31g(d).gjf (generated)

045100937.b3lyp_6-31g(d).firefly.inp (generated)

045100937.b3lyp_6-31g(d).smash.inp (generated)

045100937.b3lyp_6-31g(d).nwchem.inp (generated) 045100937.b3lyp_6-31g(d).log.xz 045100937.td-b3lyp_6-31g+(d).inp 045100937.td-b3lyp_6-31g+(d).log.xz

045100937.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100937.td-b3lyp_6-31+g(d).gjf (generated)

045100937.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100937.mol 045100937.PUBCHEM 045100937.mol (via Jmol)
045100947.b3lyp_6-31g(d).inp

045100947.b3lyp_6-31g(d).qchem.inp (generated)

045100947.b3lyp_6-31g(d).gjf (generated)

045100947.b3lyp_6-31g(d).firefly.inp (generated)

045100947.b3lyp_6-31g(d).smash.inp (generated)

045100947.b3lyp_6-31g(d).nwchem.inp (generated) 045100947.b3lyp_6-31g(d).log.xz 045100947.td-b3lyp_6-31g+(d).inp 045100947.td-b3lyp_6-31g+(d).log.xz

045100947.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100947.td-b3lyp_6-31+g(d).gjf (generated)

045100947.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100947.mol 045100947.PUBCHEM 045100947.mol (via Jmol)
045100966.b3lyp_6-31g(d).inp

045100966.b3lyp_6-31g(d).qchem.inp (generated)

045100966.b3lyp_6-31g(d).gjf (generated)

045100966.b3lyp_6-31g(d).firefly.inp (generated)

045100966.b3lyp_6-31g(d).smash.inp (generated)

045100966.b3lyp_6-31g(d).nwchem.inp (generated) 045100966.b3lyp_6-31g(d).log.xz 045100966.td-b3lyp_6-31g+(d).inp 045100966.td-b3lyp_6-31g+(d).log.xz

045100966.td-b3lyp_6-31+g(d).qchem.inp (generated)

045100966.td-b3lyp_6-31+g(d).gjf (generated)

045100966.td-b3lyp_6-31+g(d).firefly.inp (generated)

045100966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045100966.mol 045100966.PUBCHEM 045100966.mol (via Jmol)
045101019.b3lyp_6-31g(d).inp

045101019.b3lyp_6-31g(d).qchem.inp (generated)

045101019.b3lyp_6-31g(d).gjf (generated)

045101019.b3lyp_6-31g(d).firefly.inp (generated)

045101019.b3lyp_6-31g(d).smash.inp (generated)

045101019.b3lyp_6-31g(d).nwchem.inp (generated) 045101019.b3lyp_6-31g(d).log.xz 045101019.mol 045101019.PUBCHEM 045101019.mol (via Jmol)
045101021.b3lyp_6-31g(d).inp

045101021.b3lyp_6-31g(d).qchem.inp (generated)

045101021.b3lyp_6-31g(d).gjf (generated)

045101021.b3lyp_6-31g(d).firefly.inp (generated)

045101021.b3lyp_6-31g(d).smash.inp (generated)

045101021.b3lyp_6-31g(d).nwchem.inp (generated) 045101021.b3lyp_6-31g(d).log.xz 045101021.td-b3lyp_6-31g+(d).inp 045101021.td-b3lyp_6-31g+(d).log.xz

045101021.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101021.td-b3lyp_6-31+g(d).gjf (generated)

045101021.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101021.mol 045101021.PUBCHEM 045101021.mol (via Jmol)
045101044.b3lyp_6-31g(d).inp

045101044.b3lyp_6-31g(d).qchem.inp (generated)

045101044.b3lyp_6-31g(d).gjf (generated)

045101044.b3lyp_6-31g(d).firefly.inp (generated)

045101044.b3lyp_6-31g(d).smash.inp (generated)

045101044.b3lyp_6-31g(d).nwchem.inp (generated) 045101044.b3lyp_6-31g(d).log.xz 045101044.td-b3lyp_6-31g+(d).inp 045101044.td-b3lyp_6-31g+(d).log.xz

045101044.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101044.td-b3lyp_6-31+g(d).gjf (generated)

045101044.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101044.mol 045101044.PUBCHEM 045101044.mol (via Jmol)
045101045.b3lyp_6-31g(d).inp

045101045.b3lyp_6-31g(d).qchem.inp (generated)

045101045.b3lyp_6-31g(d).gjf (generated)

045101045.b3lyp_6-31g(d).firefly.inp (generated)

045101045.b3lyp_6-31g(d).smash.inp (generated)

045101045.b3lyp_6-31g(d).nwchem.inp (generated) 045101045.b3lyp_6-31g(d).log.xz 045101045.td-b3lyp_6-31g+(d).inp 045101045.td-b3lyp_6-31g+(d).log.xz

045101045.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101045.td-b3lyp_6-31+g(d).gjf (generated)

045101045.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101045.mol 045101045.PUBCHEM 045101045.mol (via Jmol)
045101047.b3lyp_6-31g(d).inp

045101047.b3lyp_6-31g(d).qchem.inp (generated)

045101047.b3lyp_6-31g(d).gjf (generated)

045101047.b3lyp_6-31g(d).firefly.inp (generated)

045101047.b3lyp_6-31g(d).smash.inp (generated)

045101047.b3lyp_6-31g(d).nwchem.inp (generated) 045101047.b3lyp_6-31g(d).log.xz 045101047.mol 045101047.PUBCHEM 045101047.mol (via Jmol)
045101048.b3lyp_6-31g(d).inp

045101048.b3lyp_6-31g(d).qchem.inp (generated)

045101048.b3lyp_6-31g(d).gjf (generated)

045101048.b3lyp_6-31g(d).firefly.inp (generated)

045101048.b3lyp_6-31g(d).smash.inp (generated)

045101048.b3lyp_6-31g(d).nwchem.inp (generated) 045101048.b3lyp_6-31g(d).log.xz 045101048.td-b3lyp_6-31g+(d).inp 045101048.td-b3lyp_6-31g+(d).log.xz

045101048.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101048.td-b3lyp_6-31+g(d).gjf (generated)

045101048.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101048.mol 045101048.PUBCHEM 045101048.mol (via Jmol)
045101049.b3lyp_6-31g(d).inp

045101049.b3lyp_6-31g(d).qchem.inp (generated)

045101049.b3lyp_6-31g(d).gjf (generated)

045101049.b3lyp_6-31g(d).firefly.inp (generated)

045101049.b3lyp_6-31g(d).smash.inp (generated)

045101049.b3lyp_6-31g(d).nwchem.inp (generated) 045101049.b3lyp_6-31g(d).log.xz 045101049.td-b3lyp_6-31g+(d).inp 045101049.td-b3lyp_6-31g+(d).log.xz

045101049.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101049.td-b3lyp_6-31+g(d).gjf (generated)

045101049.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101049.mol 045101049.PUBCHEM 045101049.mol (via Jmol)
045101073.b3lyp_6-31g(d).inp

045101073.b3lyp_6-31g(d).qchem.inp (generated)

045101073.b3lyp_6-31g(d).gjf (generated)

045101073.b3lyp_6-31g(d).firefly.inp (generated)

045101073.b3lyp_6-31g(d).smash.inp (generated)

045101073.b3lyp_6-31g(d).nwchem.inp (generated) 045101073.b3lyp_6-31g(d).log.xz 045101073.td-b3lyp_6-31g+(d).inp 045101073.td-b3lyp_6-31g+(d).log.xz

045101073.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101073.td-b3lyp_6-31+g(d).gjf (generated)

045101073.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101073.mol 045101073.PUBCHEM 045101073.mol (via Jmol)
045101087.b3lyp_6-31g(d).inp

045101087.b3lyp_6-31g(d).qchem.inp (generated)

045101087.b3lyp_6-31g(d).gjf (generated)

045101087.b3lyp_6-31g(d).firefly.inp (generated)

045101087.b3lyp_6-31g(d).smash.inp (generated)

045101087.b3lyp_6-31g(d).nwchem.inp (generated) 045101087.b3lyp_6-31g(d).log.xz 045101087.td-b3lyp_6-31g+(d).inp 045101087.td-b3lyp_6-31g+(d).log.xz

045101087.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101087.td-b3lyp_6-31+g(d).gjf (generated)

045101087.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101087.mol 045101087.PUBCHEM 045101087.mol (via Jmol)
045101103.b3lyp_6-31g(d).inp

045101103.b3lyp_6-31g(d).qchem.inp (generated)

045101103.b3lyp_6-31g(d).gjf (generated)

045101103.b3lyp_6-31g(d).firefly.inp (generated)

045101103.b3lyp_6-31g(d).smash.inp (generated)

045101103.b3lyp_6-31g(d).nwchem.inp (generated) 045101103.b3lyp_6-31g(d).log.xz 045101103.td-b3lyp_6-31g+(d).inp 045101103.td-b3lyp_6-31g+(d).log.xz

045101103.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101103.td-b3lyp_6-31+g(d).gjf (generated)

045101103.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101103.mol 045101103.PUBCHEM 045101103.mol (via Jmol)
045101105.b3lyp_6-31g(d).inp

045101105.b3lyp_6-31g(d).qchem.inp (generated)

045101105.b3lyp_6-31g(d).gjf (generated)

045101105.b3lyp_6-31g(d).firefly.inp (generated)

045101105.b3lyp_6-31g(d).smash.inp (generated)

045101105.b3lyp_6-31g(d).nwchem.inp (generated) 045101105.b3lyp_6-31g(d).log.xz 045101105.mol 045101105.PUBCHEM 045101105.mol (via Jmol)
045101106.b3lyp_6-31g(d).inp

045101106.b3lyp_6-31g(d).qchem.inp (generated)

045101106.b3lyp_6-31g(d).gjf (generated)

045101106.b3lyp_6-31g(d).firefly.inp (generated)

045101106.b3lyp_6-31g(d).smash.inp (generated)

045101106.b3lyp_6-31g(d).nwchem.inp (generated) 045101106.b3lyp_6-31g(d).log.xz 045101106.mol 045101106.PUBCHEM 045101106.mol (via Jmol)
045101107.b3lyp_6-31g(d).inp

045101107.b3lyp_6-31g(d).qchem.inp (generated)

045101107.b3lyp_6-31g(d).gjf (generated)

045101107.b3lyp_6-31g(d).firefly.inp (generated)

045101107.b3lyp_6-31g(d).smash.inp (generated)

045101107.b3lyp_6-31g(d).nwchem.inp (generated) 045101107.b3lyp_6-31g(d).log.xz 045101107.td-b3lyp_6-31g+(d).inp 045101107.td-b3lyp_6-31g+(d).log.xz

045101107.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101107.td-b3lyp_6-31+g(d).gjf (generated)

045101107.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101107.mol 045101107.PUBCHEM 045101107.mol (via Jmol)
045101108.b3lyp_6-31g(d).inp

045101108.b3lyp_6-31g(d).qchem.inp (generated)

045101108.b3lyp_6-31g(d).gjf (generated)

045101108.b3lyp_6-31g(d).firefly.inp (generated)

045101108.b3lyp_6-31g(d).smash.inp (generated)

045101108.b3lyp_6-31g(d).nwchem.inp (generated) 045101108.b3lyp_6-31g(d).log.xz 045101108.td-b3lyp_6-31g+(d).inp 045101108.td-b3lyp_6-31g+(d).log.xz

045101108.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101108.td-b3lyp_6-31+g(d).gjf (generated)

045101108.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101108.mol 045101108.PUBCHEM 045101108.mol (via Jmol)
045101110.b3lyp_6-31g(d).inp

045101110.b3lyp_6-31g(d).qchem.inp (generated)

045101110.b3lyp_6-31g(d).gjf (generated)

045101110.b3lyp_6-31g(d).firefly.inp (generated)

045101110.b3lyp_6-31g(d).smash.inp (generated)

045101110.b3lyp_6-31g(d).nwchem.inp (generated) 045101110.b3lyp_6-31g(d).log.xz 045101110.td-b3lyp_6-31g+(d).inp 045101110.td-b3lyp_6-31g+(d).log.xz

045101110.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101110.td-b3lyp_6-31+g(d).gjf (generated)

045101110.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101110.mol 045101110.PUBCHEM 045101110.mol (via Jmol)
045101148.b3lyp_6-31g(d).inp

045101148.b3lyp_6-31g(d).qchem.inp (generated)

045101148.b3lyp_6-31g(d).gjf (generated)

045101148.b3lyp_6-31g(d).firefly.inp (generated)

045101148.b3lyp_6-31g(d).smash.inp (generated)

045101148.b3lyp_6-31g(d).nwchem.inp (generated) 045101148.b3lyp_6-31g(d).log.xz 045101148.td-b3lyp_6-31g+(d).inp 045101148.td-b3lyp_6-31g+(d).log.xz

045101148.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101148.td-b3lyp_6-31+g(d).gjf (generated)

045101148.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101148.mol 045101148.PUBCHEM 045101148.mol (via Jmol)
045101197.b3lyp_6-31g(d).inp

045101197.b3lyp_6-31g(d).qchem.inp (generated)

045101197.b3lyp_6-31g(d).gjf (generated)

045101197.b3lyp_6-31g(d).firefly.inp (generated)

045101197.b3lyp_6-31g(d).smash.inp (generated)

045101197.b3lyp_6-31g(d).nwchem.inp (generated) 045101197.b3lyp_6-31g(d).log.xz 045101197.mol 045101197.PUBCHEM 045101197.mol (via Jmol)
045101198.b3lyp_6-31g(d).inp

045101198.b3lyp_6-31g(d).qchem.inp (generated)

045101198.b3lyp_6-31g(d).gjf (generated)

045101198.b3lyp_6-31g(d).firefly.inp (generated)

045101198.b3lyp_6-31g(d).smash.inp (generated)

045101198.b3lyp_6-31g(d).nwchem.inp (generated) 045101198.b3lyp_6-31g(d).log.xz 045101198.mol 045101198.PUBCHEM 045101198.mol (via Jmol)
045101255.b3lyp_6-31g(d).inp

045101255.b3lyp_6-31g(d).qchem.inp (generated)

045101255.b3lyp_6-31g(d).gjf (generated)

045101255.b3lyp_6-31g(d).firefly.inp (generated)

045101255.b3lyp_6-31g(d).smash.inp (generated)

045101255.b3lyp_6-31g(d).nwchem.inp (generated) 045101255.b3lyp_6-31g(d).log.xz 045101255.mol 045101255.PUBCHEM 045101255.mol (via Jmol)
045101274.b3lyp_6-31g(d).inp

045101274.b3lyp_6-31g(d).qchem.inp (generated)

045101274.b3lyp_6-31g(d).gjf (generated)

045101274.b3lyp_6-31g(d).firefly.inp (generated)

045101274.b3lyp_6-31g(d).smash.inp (generated)

045101274.b3lyp_6-31g(d).nwchem.inp (generated) 045101274.b3lyp_6-31g(d).log.xz 045101274.td-b3lyp_6-31g+(d).inp 045101274.td-b3lyp_6-31g+(d).log.xz

045101274.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101274.td-b3lyp_6-31+g(d).gjf (generated)

045101274.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101274.mol 045101274.PUBCHEM 045101274.mol (via Jmol)
045101275.b3lyp_6-31g(d).inp

045101275.b3lyp_6-31g(d).qchem.inp (generated)

045101275.b3lyp_6-31g(d).gjf (generated)

045101275.b3lyp_6-31g(d).firefly.inp (generated)

045101275.b3lyp_6-31g(d).smash.inp (generated)

045101275.b3lyp_6-31g(d).nwchem.inp (generated) 045101275.b3lyp_6-31g(d).log.xz 045101275.mol 045101275.PUBCHEM 045101275.mol (via Jmol)
045101277.b3lyp_6-31g(d).inp

045101277.b3lyp_6-31g(d).qchem.inp (generated)

045101277.b3lyp_6-31g(d).gjf (generated)

045101277.b3lyp_6-31g(d).firefly.inp (generated)

045101277.b3lyp_6-31g(d).smash.inp (generated)

045101277.b3lyp_6-31g(d).nwchem.inp (generated) 045101277.b3lyp_6-31g(d).log.xz 045101277.td-b3lyp_6-31g+(d).inp 045101277.td-b3lyp_6-31g+(d).log.xz

045101277.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101277.td-b3lyp_6-31+g(d).gjf (generated)

045101277.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101277.mol 045101277.PUBCHEM 045101277.mol (via Jmol)
045101343.b3lyp_6-31g(d).inp

045101343.b3lyp_6-31g(d).qchem.inp (generated)

045101343.b3lyp_6-31g(d).gjf (generated)

045101343.b3lyp_6-31g(d).firefly.inp (generated)

045101343.b3lyp_6-31g(d).smash.inp (generated)

045101343.b3lyp_6-31g(d).nwchem.inp (generated) 045101343.b3lyp_6-31g(d).log.xz 045101343.td-b3lyp_6-31g+(d).inp 045101343.td-b3lyp_6-31g+(d).log.xz

045101343.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101343.td-b3lyp_6-31+g(d).gjf (generated)

045101343.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101343.mol 045101343.PUBCHEM 045101343.mol (via Jmol)
045101395.b3lyp_6-31g(d).inp

045101395.b3lyp_6-31g(d).qchem.inp (generated)

045101395.b3lyp_6-31g(d).gjf (generated)

045101395.b3lyp_6-31g(d).firefly.inp (generated)

045101395.b3lyp_6-31g(d).smash.inp (generated)

045101395.b3lyp_6-31g(d).nwchem.inp (generated) 045101395.b3lyp_6-31g(d).log.xz 045101395.td-b3lyp_6-31g+(d).inp 045101395.td-b3lyp_6-31g+(d).log.xz

045101395.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101395.td-b3lyp_6-31+g(d).gjf (generated)

045101395.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101395.mol 045101395.PUBCHEM 045101395.mol (via Jmol)
045101396.b3lyp_6-31g(d).inp

045101396.b3lyp_6-31g(d).qchem.inp (generated)

045101396.b3lyp_6-31g(d).gjf (generated)

045101396.b3lyp_6-31g(d).firefly.inp (generated)

045101396.b3lyp_6-31g(d).smash.inp (generated)

045101396.b3lyp_6-31g(d).nwchem.inp (generated) 045101396.b3lyp_6-31g(d).log.xz 045101396.mol 045101396.PUBCHEM 045101396.mol (via Jmol)
045101397.b3lyp_6-31g(d).inp

045101397.b3lyp_6-31g(d).qchem.inp (generated)

045101397.b3lyp_6-31g(d).gjf (generated)

045101397.b3lyp_6-31g(d).firefly.inp (generated)

045101397.b3lyp_6-31g(d).smash.inp (generated)

045101397.b3lyp_6-31g(d).nwchem.inp (generated) 045101397.b3lyp_6-31g(d).log.xz 045101397.mol 045101397.PUBCHEM 045101397.mol (via Jmol)
045101545.b3lyp_6-31g(d).inp

045101545.b3lyp_6-31g(d).qchem.inp (generated)

045101545.b3lyp_6-31g(d).gjf (generated)

045101545.b3lyp_6-31g(d).firefly.inp (generated)

045101545.b3lyp_6-31g(d).smash.inp (generated)

045101545.b3lyp_6-31g(d).nwchem.inp (generated) 045101545.b3lyp_6-31g(d).log.xz 045101545.td-b3lyp_6-31g+(d).inp 045101545.td-b3lyp_6-31g+(d).log.xz

045101545.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101545.td-b3lyp_6-31+g(d).gjf (generated)

045101545.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101545.mol 045101545.PUBCHEM 045101545.mol (via Jmol)
045101557.b3lyp_6-31g(d).inp

045101557.b3lyp_6-31g(d).qchem.inp (generated)

045101557.b3lyp_6-31g(d).gjf (generated)

045101557.b3lyp_6-31g(d).firefly.inp (generated)

045101557.b3lyp_6-31g(d).smash.inp (generated)

045101557.b3lyp_6-31g(d).nwchem.inp (generated) 045101557.b3lyp_6-31g(d).log.xz 045101557.td-b3lyp_6-31g+(d).inp 045101557.td-b3lyp_6-31g+(d).log.xz

045101557.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101557.td-b3lyp_6-31+g(d).gjf (generated)

045101557.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101557.mol 045101557.PUBCHEM 045101557.mol (via Jmol)
045101558.b3lyp_6-31g(d).inp

045101558.b3lyp_6-31g(d).qchem.inp (generated)

045101558.b3lyp_6-31g(d).gjf (generated)

045101558.b3lyp_6-31g(d).firefly.inp (generated)

045101558.b3lyp_6-31g(d).smash.inp (generated)

045101558.b3lyp_6-31g(d).nwchem.inp (generated) 045101558.b3lyp_6-31g(d).log.xz 045101558.td-b3lyp_6-31g+(d).inp 045101558.td-b3lyp_6-31g+(d).log.xz

045101558.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101558.td-b3lyp_6-31+g(d).gjf (generated)

045101558.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101558.mol 045101558.PUBCHEM 045101558.mol (via Jmol)
045101585.b3lyp_6-31g(d).inp

045101585.b3lyp_6-31g(d).qchem.inp (generated)

045101585.b3lyp_6-31g(d).gjf (generated)

045101585.b3lyp_6-31g(d).firefly.inp (generated)

045101585.b3lyp_6-31g(d).smash.inp (generated)

045101585.b3lyp_6-31g(d).nwchem.inp (generated) 045101585.b3lyp_6-31g(d).log.xz 045101585.mol 045101585.PUBCHEM 045101585.mol (via Jmol)
045101596.b3lyp_6-31g(d).inp

045101596.b3lyp_6-31g(d).qchem.inp (generated)

045101596.b3lyp_6-31g(d).gjf (generated)

045101596.b3lyp_6-31g(d).firefly.inp (generated)

045101596.b3lyp_6-31g(d).smash.inp (generated)

045101596.b3lyp_6-31g(d).nwchem.inp (generated) 045101596.b3lyp_6-31g(d).log.xz 045101596.td-b3lyp_6-31g+(d).inp 045101596.td-b3lyp_6-31g+(d).log.xz

045101596.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101596.td-b3lyp_6-31+g(d).gjf (generated)

045101596.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101596.mol 045101596.PUBCHEM 045101596.mol (via Jmol)
045101599.b3lyp_6-31g(d).inp

045101599.b3lyp_6-31g(d).qchem.inp (generated)

045101599.b3lyp_6-31g(d).gjf (generated)

045101599.b3lyp_6-31g(d).firefly.inp (generated)

045101599.b3lyp_6-31g(d).smash.inp (generated)

045101599.b3lyp_6-31g(d).nwchem.inp (generated) 045101599.b3lyp_6-31g(d).log.xz 045101599.td-b3lyp_6-31g+(d).inp 045101599.td-b3lyp_6-31g+(d).log.xz

045101599.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101599.td-b3lyp_6-31+g(d).gjf (generated)

045101599.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101599.mol 045101599.PUBCHEM 045101599.mol (via Jmol)
045101600.b3lyp_6-31g(d).inp

045101600.b3lyp_6-31g(d).qchem.inp (generated)

045101600.b3lyp_6-31g(d).gjf (generated)

045101600.b3lyp_6-31g(d).firefly.inp (generated)

045101600.b3lyp_6-31g(d).smash.inp (generated)

045101600.b3lyp_6-31g(d).nwchem.inp (generated) 045101600.b3lyp_6-31g(d).log.xz 045101600.td-b3lyp_6-31g+(d).inp 045101600.td-b3lyp_6-31g+(d).log.xz

045101600.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101600.td-b3lyp_6-31+g(d).gjf (generated)

045101600.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101600.mol 045101600.PUBCHEM 045101600.mol (via Jmol)
045101606.b3lyp_6-31g(d).inp

045101606.b3lyp_6-31g(d).qchem.inp (generated)

045101606.b3lyp_6-31g(d).gjf (generated)

045101606.b3lyp_6-31g(d).firefly.inp (generated)

045101606.b3lyp_6-31g(d).smash.inp (generated)

045101606.b3lyp_6-31g(d).nwchem.inp (generated) 045101606.b3lyp_6-31g(d).log.xz 045101606.td-b3lyp_6-31g+(d).inp 045101606.td-b3lyp_6-31g+(d).log.xz

045101606.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101606.td-b3lyp_6-31+g(d).gjf (generated)

045101606.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101606.mol 045101606.PUBCHEM 045101606.mol (via Jmol)
045101617.b3lyp_6-31g(d).inp

045101617.b3lyp_6-31g(d).qchem.inp (generated)

045101617.b3lyp_6-31g(d).gjf (generated)

045101617.b3lyp_6-31g(d).firefly.inp (generated)

045101617.b3lyp_6-31g(d).smash.inp (generated)

045101617.b3lyp_6-31g(d).nwchem.inp (generated) 045101617.b3lyp_6-31g(d).log.xz 045101617.td-b3lyp_6-31g+(d).inp 045101617.td-b3lyp_6-31g+(d).log.xz

045101617.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101617.td-b3lyp_6-31+g(d).gjf (generated)

045101617.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101617.mol 045101617.PUBCHEM 045101617.mol (via Jmol)
045101630.b3lyp_6-31g(d).inp

045101630.b3lyp_6-31g(d).qchem.inp (generated)

045101630.b3lyp_6-31g(d).gjf (generated)

045101630.b3lyp_6-31g(d).firefly.inp (generated)

045101630.b3lyp_6-31g(d).smash.inp (generated)

045101630.b3lyp_6-31g(d).nwchem.inp (generated) 045101630.b3lyp_6-31g(d).log.xz 045101630.td-b3lyp_6-31g+(d).inp 045101630.td-b3lyp_6-31g+(d).log.xz

045101630.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101630.td-b3lyp_6-31+g(d).gjf (generated)

045101630.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101630.mol 045101630.PUBCHEM 045101630.mol (via Jmol)
045101631.b3lyp_6-31g(d).inp

045101631.b3lyp_6-31g(d).qchem.inp (generated)

045101631.b3lyp_6-31g(d).gjf (generated)

045101631.b3lyp_6-31g(d).firefly.inp (generated)

045101631.b3lyp_6-31g(d).smash.inp (generated)

045101631.b3lyp_6-31g(d).nwchem.inp (generated) 045101631.b3lyp_6-31g(d).log.xz 045101631.td-b3lyp_6-31g+(d).inp 045101631.td-b3lyp_6-31g+(d).log.xz

045101631.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101631.td-b3lyp_6-31+g(d).gjf (generated)

045101631.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101631.mol 045101631.PUBCHEM 045101631.mol (via Jmol)
045101632.b3lyp_6-31g(d).inp

045101632.b3lyp_6-31g(d).qchem.inp (generated)

045101632.b3lyp_6-31g(d).gjf (generated)

045101632.b3lyp_6-31g(d).firefly.inp (generated)

045101632.b3lyp_6-31g(d).smash.inp (generated)

045101632.b3lyp_6-31g(d).nwchem.inp (generated) 045101632.b3lyp_6-31g(d).log.xz 045101632.td-b3lyp_6-31g+(d).inp 045101632.td-b3lyp_6-31g+(d).log.xz

045101632.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101632.td-b3lyp_6-31+g(d).gjf (generated)

045101632.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101632.mol 045101632.PUBCHEM 045101632.mol (via Jmol)
045101633.b3lyp_6-31g(d).inp

045101633.b3lyp_6-31g(d).qchem.inp (generated)

045101633.b3lyp_6-31g(d).gjf (generated)

045101633.b3lyp_6-31g(d).firefly.inp (generated)

045101633.b3lyp_6-31g(d).smash.inp (generated)

045101633.b3lyp_6-31g(d).nwchem.inp (generated) 045101633.b3lyp_6-31g(d).log.xz 045101633.td-b3lyp_6-31g+(d).inp 045101633.td-b3lyp_6-31g+(d).log.xz

045101633.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101633.td-b3lyp_6-31+g(d).gjf (generated)

045101633.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101633.mol 045101633.PUBCHEM 045101633.mol (via Jmol)
045101640.b3lyp_6-31g(d).inp

045101640.b3lyp_6-31g(d).qchem.inp (generated)

045101640.b3lyp_6-31g(d).gjf (generated)

045101640.b3lyp_6-31g(d).firefly.inp (generated)

045101640.b3lyp_6-31g(d).smash.inp (generated)

045101640.b3lyp_6-31g(d).nwchem.inp (generated) 045101640.b3lyp_6-31g(d).log.xz 045101640.td-b3lyp_6-31g+(d).inp 045101640.td-b3lyp_6-31g+(d).log.xz

045101640.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101640.td-b3lyp_6-31+g(d).gjf (generated)

045101640.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101640.mol 045101640.PUBCHEM 045101640.mol (via Jmol)
045101647.b3lyp_6-31g(d).inp

045101647.b3lyp_6-31g(d).qchem.inp (generated)

045101647.b3lyp_6-31g(d).gjf (generated)

045101647.b3lyp_6-31g(d).firefly.inp (generated)

045101647.b3lyp_6-31g(d).smash.inp (generated)

045101647.b3lyp_6-31g(d).nwchem.inp (generated) 045101647.b3lyp_6-31g(d).log.xz 045101647.mol 045101647.PUBCHEM 045101647.mol (via Jmol)
045101648.b3lyp_6-31g(d).inp

045101648.b3lyp_6-31g(d).qchem.inp (generated)

045101648.b3lyp_6-31g(d).gjf (generated)

045101648.b3lyp_6-31g(d).firefly.inp (generated)

045101648.b3lyp_6-31g(d).smash.inp (generated)

045101648.b3lyp_6-31g(d).nwchem.inp (generated) 045101648.b3lyp_6-31g(d).log.xz 045101648.td-b3lyp_6-31g+(d).inp 045101648.td-b3lyp_6-31g+(d).log.xz

045101648.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101648.td-b3lyp_6-31+g(d).gjf (generated)

045101648.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101648.mol 045101648.PUBCHEM 045101648.mol (via Jmol)
045101650.b3lyp_6-31g(d).inp

045101650.b3lyp_6-31g(d).qchem.inp (generated)

045101650.b3lyp_6-31g(d).gjf (generated)

045101650.b3lyp_6-31g(d).firefly.inp (generated)

045101650.b3lyp_6-31g(d).smash.inp (generated)

045101650.b3lyp_6-31g(d).nwchem.inp (generated) 045101650.b3lyp_6-31g(d).log.xz 045101650.td-b3lyp_6-31g+(d).inp 045101650.td-b3lyp_6-31g+(d).log.xz

045101650.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101650.td-b3lyp_6-31+g(d).gjf (generated)

045101650.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101650.mol 045101650.PUBCHEM 045101650.mol (via Jmol)
045101655.b3lyp_6-31g(d).inp

045101655.b3lyp_6-31g(d).qchem.inp (generated)

045101655.b3lyp_6-31g(d).gjf (generated)

045101655.b3lyp_6-31g(d).firefly.inp (generated)

045101655.b3lyp_6-31g(d).smash.inp (generated)

045101655.b3lyp_6-31g(d).nwchem.inp (generated) 045101655.b3lyp_6-31g(d).log.xz 045101655.td-b3lyp_6-31g+(d).inp 045101655.td-b3lyp_6-31g+(d).log.xz

045101655.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101655.td-b3lyp_6-31+g(d).gjf (generated)

045101655.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101655.mol 045101655.PUBCHEM 045101655.mol (via Jmol)
045101671.b3lyp_6-31g(d).inp

045101671.b3lyp_6-31g(d).qchem.inp (generated)

045101671.b3lyp_6-31g(d).gjf (generated)

045101671.b3lyp_6-31g(d).firefly.inp (generated)

045101671.b3lyp_6-31g(d).smash.inp (generated)

045101671.b3lyp_6-31g(d).nwchem.inp (generated) 045101671.b3lyp_6-31g(d).log.xz 045101671.td-b3lyp_6-31g+(d).inp 045101671.td-b3lyp_6-31g+(d).log.xz

045101671.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101671.td-b3lyp_6-31+g(d).gjf (generated)

045101671.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101671.mol 045101671.PUBCHEM 045101671.mol (via Jmol)
045101676.b3lyp_6-31g(d).inp

045101676.b3lyp_6-31g(d).qchem.inp (generated)

045101676.b3lyp_6-31g(d).gjf (generated)

045101676.b3lyp_6-31g(d).firefly.inp (generated)

045101676.b3lyp_6-31g(d).smash.inp (generated)

045101676.b3lyp_6-31g(d).nwchem.inp (generated) 045101676.b3lyp_6-31g(d).log.xz 045101676.td-b3lyp_6-31g+(d).inp 045101676.td-b3lyp_6-31g+(d).log.xz

045101676.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101676.td-b3lyp_6-31+g(d).gjf (generated)

045101676.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101676.mol 045101676.PUBCHEM 045101676.mol (via Jmol)
045101693.b3lyp_6-31g(d).inp

045101693.b3lyp_6-31g(d).qchem.inp (generated)

045101693.b3lyp_6-31g(d).gjf (generated)

045101693.b3lyp_6-31g(d).firefly.inp (generated)

045101693.b3lyp_6-31g(d).smash.inp (generated)

045101693.b3lyp_6-31g(d).nwchem.inp (generated) 045101693.b3lyp_6-31g(d).log.xz 045101693.td-b3lyp_6-31g+(d).inp 045101693.td-b3lyp_6-31g+(d).log.xz

045101693.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101693.td-b3lyp_6-31+g(d).gjf (generated)

045101693.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101693.mol 045101693.PUBCHEM 045101693.mol (via Jmol)
045101765.b3lyp_6-31g(d).inp

045101765.b3lyp_6-31g(d).qchem.inp (generated)

045101765.b3lyp_6-31g(d).gjf (generated)

045101765.b3lyp_6-31g(d).firefly.inp (generated)

045101765.b3lyp_6-31g(d).smash.inp (generated)

045101765.b3lyp_6-31g(d).nwchem.inp (generated) 045101765.b3lyp_6-31g(d).log.xz 045101765.td-b3lyp_6-31g+(d).inp 045101765.td-b3lyp_6-31g+(d).log.xz

045101765.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101765.td-b3lyp_6-31+g(d).gjf (generated)

045101765.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101765.mol 045101765.PUBCHEM 045101765.mol (via Jmol)
045101766.b3lyp_6-31g(d).inp

045101766.b3lyp_6-31g(d).qchem.inp (generated)

045101766.b3lyp_6-31g(d).gjf (generated)

045101766.b3lyp_6-31g(d).firefly.inp (generated)

045101766.b3lyp_6-31g(d).smash.inp (generated)

045101766.b3lyp_6-31g(d).nwchem.inp (generated) 045101766.b3lyp_6-31g(d).log.xz 045101766.td-b3lyp_6-31g+(d).inp 045101766.td-b3lyp_6-31g+(d).log.xz

045101766.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101766.td-b3lyp_6-31+g(d).gjf (generated)

045101766.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101766.mol 045101766.PUBCHEM 045101766.mol (via Jmol)
045101774.b3lyp_6-31g(d).inp

045101774.b3lyp_6-31g(d).qchem.inp (generated)

045101774.b3lyp_6-31g(d).gjf (generated)

045101774.b3lyp_6-31g(d).firefly.inp (generated)

045101774.b3lyp_6-31g(d).smash.inp (generated)

045101774.b3lyp_6-31g(d).nwchem.inp (generated) 045101774.b3lyp_6-31g(d).log.xz 045101774.td-b3lyp_6-31g+(d).inp 045101774.td-b3lyp_6-31g+(d).log.xz

045101774.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101774.td-b3lyp_6-31+g(d).gjf (generated)

045101774.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101774.mol 045101774.PUBCHEM 045101774.mol (via Jmol)
045101776.b3lyp_6-31g(d).inp

045101776.b3lyp_6-31g(d).qchem.inp (generated)

045101776.b3lyp_6-31g(d).gjf (generated)

045101776.b3lyp_6-31g(d).firefly.inp (generated)

045101776.b3lyp_6-31g(d).smash.inp (generated)

045101776.b3lyp_6-31g(d).nwchem.inp (generated) 045101776.b3lyp_6-31g(d).log.xz 045101776.td-b3lyp_6-31g+(d).inp 045101776.td-b3lyp_6-31g+(d).log.xz

045101776.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101776.td-b3lyp_6-31+g(d).gjf (generated)

045101776.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101776.mol 045101776.PUBCHEM 045101776.mol (via Jmol)
045101780.b3lyp_6-31g(d).inp

045101780.b3lyp_6-31g(d).qchem.inp (generated)

045101780.b3lyp_6-31g(d).gjf (generated)

045101780.b3lyp_6-31g(d).firefly.inp (generated)

045101780.b3lyp_6-31g(d).smash.inp (generated)

045101780.b3lyp_6-31g(d).nwchem.inp (generated) 045101780.b3lyp_6-31g(d).log.xz 045101780.td-b3lyp_6-31g+(d).inp 045101780.td-b3lyp_6-31g+(d).log.xz

045101780.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101780.td-b3lyp_6-31+g(d).gjf (generated)

045101780.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101780.mol 045101780.PUBCHEM 045101780.mol (via Jmol)
045101817.b3lyp_6-31g(d).inp

045101817.b3lyp_6-31g(d).qchem.inp (generated)

045101817.b3lyp_6-31g(d).gjf (generated)

045101817.b3lyp_6-31g(d).firefly.inp (generated)

045101817.b3lyp_6-31g(d).smash.inp (generated)

045101817.b3lyp_6-31g(d).nwchem.inp (generated) 045101817.b3lyp_6-31g(d).log.xz 045101817.td-b3lyp_6-31g+(d).inp 045101817.td-b3lyp_6-31g+(d).log.xz

045101817.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101817.td-b3lyp_6-31+g(d).gjf (generated)

045101817.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101817.mol 045101817.PUBCHEM 045101817.mol (via Jmol)
045101850.b3lyp_6-31g(d).inp

045101850.b3lyp_6-31g(d).qchem.inp (generated)

045101850.b3lyp_6-31g(d).gjf (generated)

045101850.b3lyp_6-31g(d).firefly.inp (generated)

045101850.b3lyp_6-31g(d).smash.inp (generated)

045101850.b3lyp_6-31g(d).nwchem.inp (generated) 045101850.b3lyp_6-31g(d).log.xz 045101850.td-b3lyp_6-31g+(d).inp 045101850.td-b3lyp_6-31g+(d).log.xz

045101850.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101850.td-b3lyp_6-31+g(d).gjf (generated)

045101850.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101850.mol 045101850.PUBCHEM 045101850.mol (via Jmol)
045101851.b3lyp_6-31g(d).inp

045101851.b3lyp_6-31g(d).qchem.inp (generated)

045101851.b3lyp_6-31g(d).gjf (generated)

045101851.b3lyp_6-31g(d).firefly.inp (generated)

045101851.b3lyp_6-31g(d).smash.inp (generated)

045101851.b3lyp_6-31g(d).nwchem.inp (generated) 045101851.b3lyp_6-31g(d).log.xz 045101851.td-b3lyp_6-31g+(d).inp 045101851.td-b3lyp_6-31g+(d).log.xz

045101851.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101851.td-b3lyp_6-31+g(d).gjf (generated)

045101851.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101851.mol 045101851.PUBCHEM 045101851.mol (via Jmol)
045101852.b3lyp_6-31g(d).inp

045101852.b3lyp_6-31g(d).qchem.inp (generated)

045101852.b3lyp_6-31g(d).gjf (generated)

045101852.b3lyp_6-31g(d).firefly.inp (generated)

045101852.b3lyp_6-31g(d).smash.inp (generated)

045101852.b3lyp_6-31g(d).nwchem.inp (generated) 045101852.b3lyp_6-31g(d).log.xz 045101852.td-b3lyp_6-31g+(d).inp 045101852.td-b3lyp_6-31g+(d).log.xz

045101852.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101852.td-b3lyp_6-31+g(d).gjf (generated)

045101852.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101852.mol 045101852.PUBCHEM 045101852.mol (via Jmol)
045101897.b3lyp_6-31g(d).inp

045101897.b3lyp_6-31g(d).qchem.inp (generated)

045101897.b3lyp_6-31g(d).gjf (generated)

045101897.b3lyp_6-31g(d).firefly.inp (generated)

045101897.b3lyp_6-31g(d).smash.inp (generated)

045101897.b3lyp_6-31g(d).nwchem.inp (generated) 045101897.b3lyp_6-31g(d).log.xz 045101897.td-b3lyp_6-31g+(d).inp 045101897.td-b3lyp_6-31g+(d).log.xz

045101897.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101897.td-b3lyp_6-31+g(d).gjf (generated)

045101897.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101897.mol 045101897.PUBCHEM 045101897.mol (via Jmol)
045101905.b3lyp_6-31g(d).inp

045101905.b3lyp_6-31g(d).qchem.inp (generated)

045101905.b3lyp_6-31g(d).gjf (generated)

045101905.b3lyp_6-31g(d).firefly.inp (generated)

045101905.b3lyp_6-31g(d).smash.inp (generated)

045101905.b3lyp_6-31g(d).nwchem.inp (generated) 045101905.b3lyp_6-31g(d).log.xz 045101905.td-b3lyp_6-31g+(d).inp 045101905.td-b3lyp_6-31g+(d).log.xz

045101905.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101905.td-b3lyp_6-31+g(d).gjf (generated)

045101905.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101905.mol 045101905.PUBCHEM 045101905.mol (via Jmol)
045101906.b3lyp_6-31g(d).inp

045101906.b3lyp_6-31g(d).qchem.inp (generated)

045101906.b3lyp_6-31g(d).gjf (generated)

045101906.b3lyp_6-31g(d).firefly.inp (generated)

045101906.b3lyp_6-31g(d).smash.inp (generated)

045101906.b3lyp_6-31g(d).nwchem.inp (generated) 045101906.b3lyp_6-31g(d).log.xz 045101906.td-b3lyp_6-31g+(d).inp 045101906.td-b3lyp_6-31g+(d).log.xz

045101906.td-b3lyp_6-31+g(d).qchem.inp (generated)

045101906.td-b3lyp_6-31+g(d).gjf (generated)

045101906.td-b3lyp_6-31+g(d).firefly.inp (generated)

045101906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045101906.mol 045101906.PUBCHEM 045101906.mol (via Jmol)
045102017.b3lyp_6-31g(d).inp

045102017.b3lyp_6-31g(d).qchem.inp (generated)

045102017.b3lyp_6-31g(d).gjf (generated)

045102017.b3lyp_6-31g(d).firefly.inp (generated)

045102017.b3lyp_6-31g(d).smash.inp (generated)

045102017.b3lyp_6-31g(d).nwchem.inp (generated) 045102017.b3lyp_6-31g(d).log.xz 045102017.mol 045102017.PUBCHEM 045102017.mol (via Jmol)
045102018.b3lyp_6-31g(d).inp

045102018.b3lyp_6-31g(d).qchem.inp (generated)

045102018.b3lyp_6-31g(d).gjf (generated)

045102018.b3lyp_6-31g(d).firefly.inp (generated)

045102018.b3lyp_6-31g(d).smash.inp (generated)

045102018.b3lyp_6-31g(d).nwchem.inp (generated) 045102018.b3lyp_6-31g(d).log.xz 045102018.mol 045102018.PUBCHEM 045102018.mol (via Jmol)
045102040.b3lyp_6-31g(d).inp

045102040.b3lyp_6-31g(d).qchem.inp (generated)

045102040.b3lyp_6-31g(d).gjf (generated)

045102040.b3lyp_6-31g(d).firefly.inp (generated)

045102040.b3lyp_6-31g(d).smash.inp (generated)

045102040.b3lyp_6-31g(d).nwchem.inp (generated) 045102040.b3lyp_6-31g(d).log.xz 045102040.td-b3lyp_6-31g+(d).inp 045102040.td-b3lyp_6-31g+(d).log.xz

045102040.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102040.td-b3lyp_6-31+g(d).gjf (generated)

045102040.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102040.mol 045102040.PUBCHEM 045102040.mol (via Jmol)
045102102.b3lyp_6-31g(d).inp

045102102.b3lyp_6-31g(d).qchem.inp (generated)

045102102.b3lyp_6-31g(d).gjf (generated)

045102102.b3lyp_6-31g(d).firefly.inp (generated)

045102102.b3lyp_6-31g(d).smash.inp (generated)

045102102.b3lyp_6-31g(d).nwchem.inp (generated) 045102102.b3lyp_6-31g(d).log.xz 045102102.td-b3lyp_6-31g+(d).inp 045102102.td-b3lyp_6-31g+(d).log.xz

045102102.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102102.td-b3lyp_6-31+g(d).gjf (generated)

045102102.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102102.mol 045102102.PUBCHEM 045102102.mol (via Jmol)
045102103.b3lyp_6-31g(d).inp

045102103.b3lyp_6-31g(d).qchem.inp (generated)

045102103.b3lyp_6-31g(d).gjf (generated)

045102103.b3lyp_6-31g(d).firefly.inp (generated)

045102103.b3lyp_6-31g(d).smash.inp (generated)

045102103.b3lyp_6-31g(d).nwchem.inp (generated) 045102103.b3lyp_6-31g(d).log.xz 045102103.mol 045102103.PUBCHEM 045102103.mol (via Jmol)
045102104.b3lyp_6-31g(d).inp

045102104.b3lyp_6-31g(d).qchem.inp (generated)

045102104.b3lyp_6-31g(d).gjf (generated)

045102104.b3lyp_6-31g(d).firefly.inp (generated)

045102104.b3lyp_6-31g(d).smash.inp (generated)

045102104.b3lyp_6-31g(d).nwchem.inp (generated) 045102104.b3lyp_6-31g(d).log.xz 045102104.td-b3lyp_6-31g+(d).inp 045102104.td-b3lyp_6-31g+(d).log.xz

045102104.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102104.td-b3lyp_6-31+g(d).gjf (generated)

045102104.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102104.mol 045102104.PUBCHEM 045102104.mol (via Jmol)
045102105.b3lyp_6-31g(d).inp

045102105.b3lyp_6-31g(d).qchem.inp (generated)

045102105.b3lyp_6-31g(d).gjf (generated)

045102105.b3lyp_6-31g(d).firefly.inp (generated)

045102105.b3lyp_6-31g(d).smash.inp (generated)

045102105.b3lyp_6-31g(d).nwchem.inp (generated) 045102105.b3lyp_6-31g(d).log.xz 045102105.td-b3lyp_6-31g+(d).inp 045102105.td-b3lyp_6-31g+(d).log.xz

045102105.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102105.td-b3lyp_6-31+g(d).gjf (generated)

045102105.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102105.mol 045102105.PUBCHEM 045102105.mol (via Jmol)
045102141.b3lyp_6-31g(d).inp

045102141.b3lyp_6-31g(d).qchem.inp (generated)

045102141.b3lyp_6-31g(d).gjf (generated)

045102141.b3lyp_6-31g(d).firefly.inp (generated)

045102141.b3lyp_6-31g(d).smash.inp (generated)

045102141.b3lyp_6-31g(d).nwchem.inp (generated) 045102141.b3lyp_6-31g(d).log.xz 045102141.td-b3lyp_6-31g+(d).inp 045102141.td-b3lyp_6-31g+(d).log.xz

045102141.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102141.td-b3lyp_6-31+g(d).gjf (generated)

045102141.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102141.mol 045102141.PUBCHEM 045102141.mol (via Jmol)
045102143.b3lyp_6-31g(d).inp

045102143.b3lyp_6-31g(d).qchem.inp (generated)

045102143.b3lyp_6-31g(d).gjf (generated)

045102143.b3lyp_6-31g(d).firefly.inp (generated)

045102143.b3lyp_6-31g(d).smash.inp (generated)

045102143.b3lyp_6-31g(d).nwchem.inp (generated) 045102143.b3lyp_6-31g(d).log.xz 045102143.td-b3lyp_6-31g+(d).inp 045102143.td-b3lyp_6-31g+(d).log.xz

045102143.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102143.td-b3lyp_6-31+g(d).gjf (generated)

045102143.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102143.mol 045102143.PUBCHEM 045102143.mol (via Jmol)
045102145.b3lyp_6-31g(d).inp

045102145.b3lyp_6-31g(d).qchem.inp (generated)

045102145.b3lyp_6-31g(d).gjf (generated)

045102145.b3lyp_6-31g(d).firefly.inp (generated)

045102145.b3lyp_6-31g(d).smash.inp (generated)

045102145.b3lyp_6-31g(d).nwchem.inp (generated) 045102145.b3lyp_6-31g(d).log.xz 045102145.td-b3lyp_6-31g+(d).inp 045102145.td-b3lyp_6-31g+(d).log.xz

045102145.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102145.td-b3lyp_6-31+g(d).gjf (generated)

045102145.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102145.mol 045102145.PUBCHEM 045102145.mol (via Jmol)
045102171.b3lyp_6-31g(d).inp

045102171.b3lyp_6-31g(d).qchem.inp (generated)

045102171.b3lyp_6-31g(d).gjf (generated)

045102171.b3lyp_6-31g(d).firefly.inp (generated)

045102171.b3lyp_6-31g(d).smash.inp (generated)

045102171.b3lyp_6-31g(d).nwchem.inp (generated) 045102171.b3lyp_6-31g(d).log.xz 045102171.td-b3lyp_6-31g+(d).inp 045102171.td-b3lyp_6-31g+(d).log.xz

045102171.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102171.td-b3lyp_6-31+g(d).gjf (generated)

045102171.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102171.mol 045102171.PUBCHEM 045102171.mol (via Jmol)
045102173.b3lyp_6-31g(d).inp

045102173.b3lyp_6-31g(d).qchem.inp (generated)

045102173.b3lyp_6-31g(d).gjf (generated)

045102173.b3lyp_6-31g(d).firefly.inp (generated)

045102173.b3lyp_6-31g(d).smash.inp (generated)

045102173.b3lyp_6-31g(d).nwchem.inp (generated) 045102173.b3lyp_6-31g(d).log.xz 045102173.mol 045102173.PUBCHEM 045102173.mol (via Jmol)
045102174.b3lyp_6-31g(d).inp

045102174.b3lyp_6-31g(d).qchem.inp (generated)

045102174.b3lyp_6-31g(d).gjf (generated)

045102174.b3lyp_6-31g(d).firefly.inp (generated)

045102174.b3lyp_6-31g(d).smash.inp (generated)

045102174.b3lyp_6-31g(d).nwchem.inp (generated) 045102174.b3lyp_6-31g(d).log.xz 045102174.mol 045102174.PUBCHEM 045102174.mol (via Jmol)
045102175.b3lyp_6-31g(d).inp

045102175.b3lyp_6-31g(d).qchem.inp (generated)

045102175.b3lyp_6-31g(d).gjf (generated)

045102175.b3lyp_6-31g(d).firefly.inp (generated)

045102175.b3lyp_6-31g(d).smash.inp (generated)

045102175.b3lyp_6-31g(d).nwchem.inp (generated) 045102175.b3lyp_6-31g(d).log.xz 045102175.td-b3lyp_6-31g+(d).inp 045102175.td-b3lyp_6-31g+(d).log.xz

045102175.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102175.td-b3lyp_6-31+g(d).gjf (generated)

045102175.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102175.mol 045102175.PUBCHEM 045102175.mol (via Jmol)
045102196.b3lyp_6-31g(d).inp

045102196.b3lyp_6-31g(d).qchem.inp (generated)

045102196.b3lyp_6-31g(d).gjf (generated)

045102196.b3lyp_6-31g(d).firefly.inp (generated)

045102196.b3lyp_6-31g(d).smash.inp (generated)

045102196.b3lyp_6-31g(d).nwchem.inp (generated) 045102196.b3lyp_6-31g(d).log.xz 045102196.td-b3lyp_6-31g+(d).inp 045102196.td-b3lyp_6-31g+(d).log.xz

045102196.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102196.td-b3lyp_6-31+g(d).gjf (generated)

045102196.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102196.mol 045102196.PUBCHEM 045102196.mol (via Jmol)
045102231.b3lyp_6-31g(d).inp

045102231.b3lyp_6-31g(d).qchem.inp (generated)

045102231.b3lyp_6-31g(d).gjf (generated)

045102231.b3lyp_6-31g(d).firefly.inp (generated)

045102231.b3lyp_6-31g(d).smash.inp (generated)

045102231.b3lyp_6-31g(d).nwchem.inp (generated) 045102231.b3lyp_6-31g(d).log.xz 045102231.mol 045102231.PUBCHEM 045102231.mol (via Jmol)
045102232.b3lyp_6-31g(d).inp

045102232.b3lyp_6-31g(d).qchem.inp (generated)

045102232.b3lyp_6-31g(d).gjf (generated)

045102232.b3lyp_6-31g(d).firefly.inp (generated)

045102232.b3lyp_6-31g(d).smash.inp (generated)

045102232.b3lyp_6-31g(d).nwchem.inp (generated) 045102232.b3lyp_6-31g(d).log.xz 045102232.td-b3lyp_6-31g+(d).inp 045102232.td-b3lyp_6-31g+(d).log.xz

045102232.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102232.td-b3lyp_6-31+g(d).gjf (generated)

045102232.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102232.mol 045102232.PUBCHEM 045102232.mol (via Jmol)
045102234.b3lyp_6-31g(d).inp

045102234.b3lyp_6-31g(d).qchem.inp (generated)

045102234.b3lyp_6-31g(d).gjf (generated)

045102234.b3lyp_6-31g(d).firefly.inp (generated)

045102234.b3lyp_6-31g(d).smash.inp (generated)

045102234.b3lyp_6-31g(d).nwchem.inp (generated) 045102234.b3lyp_6-31g(d).log.xz 045102234.td-b3lyp_6-31g+(d).inp 045102234.td-b3lyp_6-31g+(d).log.xz

045102234.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102234.td-b3lyp_6-31+g(d).gjf (generated)

045102234.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102234.mol 045102234.PUBCHEM 045102234.mol (via Jmol)
045102303.b3lyp_6-31g(d).inp

045102303.b3lyp_6-31g(d).qchem.inp (generated)

045102303.b3lyp_6-31g(d).gjf (generated)

045102303.b3lyp_6-31g(d).firefly.inp (generated)

045102303.b3lyp_6-31g(d).smash.inp (generated)

045102303.b3lyp_6-31g(d).nwchem.inp (generated) 045102303.b3lyp_6-31g(d).log.xz 045102303.td-b3lyp_6-31g+(d).inp 045102303.td-b3lyp_6-31g+(d).log.xz

045102303.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102303.td-b3lyp_6-31+g(d).gjf (generated)

045102303.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102303.mol 045102303.PUBCHEM 045102303.mol (via Jmol)
045102309.b3lyp_6-31g(d).inp

045102309.b3lyp_6-31g(d).qchem.inp (generated)

045102309.b3lyp_6-31g(d).gjf (generated)

045102309.b3lyp_6-31g(d).firefly.inp (generated)

045102309.b3lyp_6-31g(d).smash.inp (generated)

045102309.b3lyp_6-31g(d).nwchem.inp (generated) 045102309.b3lyp_6-31g(d).log.xz 045102309.td-b3lyp_6-31g+(d).inp 045102309.td-b3lyp_6-31g+(d).log.xz

045102309.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102309.td-b3lyp_6-31+g(d).gjf (generated)

045102309.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102309.mol 045102309.PUBCHEM 045102309.mol (via Jmol)
045102311.b3lyp_6-31g(d).inp

045102311.b3lyp_6-31g(d).qchem.inp (generated)

045102311.b3lyp_6-31g(d).gjf (generated)

045102311.b3lyp_6-31g(d).firefly.inp (generated)

045102311.b3lyp_6-31g(d).smash.inp (generated)

045102311.b3lyp_6-31g(d).nwchem.inp (generated) 045102311.b3lyp_6-31g(d).log.xz 045102311.mol 045102311.PUBCHEM 045102311.mol (via Jmol)
045102339.b3lyp_6-31g(d).inp

045102339.b3lyp_6-31g(d).qchem.inp (generated)

045102339.b3lyp_6-31g(d).gjf (generated)

045102339.b3lyp_6-31g(d).firefly.inp (generated)

045102339.b3lyp_6-31g(d).smash.inp (generated)

045102339.b3lyp_6-31g(d).nwchem.inp (generated) 045102339.b3lyp_6-31g(d).log.xz 045102339.td-b3lyp_6-31g+(d).inp 045102339.td-b3lyp_6-31g+(d).log.xz

045102339.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102339.td-b3lyp_6-31+g(d).gjf (generated)

045102339.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102339.mol 045102339.PUBCHEM 045102339.mol (via Jmol)
045102397.b3lyp_6-31g(d).inp

045102397.b3lyp_6-31g(d).qchem.inp (generated)

045102397.b3lyp_6-31g(d).gjf (generated)

045102397.b3lyp_6-31g(d).firefly.inp (generated)

045102397.b3lyp_6-31g(d).smash.inp (generated)

045102397.b3lyp_6-31g(d).nwchem.inp (generated) 045102397.b3lyp_6-31g(d).log.xz 045102397.td-b3lyp_6-31g+(d).inp 045102397.td-b3lyp_6-31g+(d).log.xz

045102397.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102397.td-b3lyp_6-31+g(d).gjf (generated)

045102397.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102397.mol 045102397.PUBCHEM 045102397.mol (via Jmol)
045102444.b3lyp_6-31g(d).inp

045102444.b3lyp_6-31g(d).qchem.inp (generated)

045102444.b3lyp_6-31g(d).gjf (generated)

045102444.b3lyp_6-31g(d).firefly.inp (generated)

045102444.b3lyp_6-31g(d).smash.inp (generated)

045102444.b3lyp_6-31g(d).nwchem.inp (generated) 045102444.b3lyp_6-31g(d).log.xz 045102444.td-b3lyp_6-31g+(d).inp 045102444.td-b3lyp_6-31g+(d).log.xz

045102444.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102444.td-b3lyp_6-31+g(d).gjf (generated)

045102444.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102444.mol 045102444.PUBCHEM 045102444.mol (via Jmol)
045102445.b3lyp_6-31g(d).inp

045102445.b3lyp_6-31g(d).qchem.inp (generated)

045102445.b3lyp_6-31g(d).gjf (generated)

045102445.b3lyp_6-31g(d).firefly.inp (generated)

045102445.b3lyp_6-31g(d).smash.inp (generated)

045102445.b3lyp_6-31g(d).nwchem.inp (generated) 045102445.b3lyp_6-31g(d).log.xz 045102445.td-b3lyp_6-31g+(d).inp 045102445.td-b3lyp_6-31g+(d).log.xz

045102445.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102445.td-b3lyp_6-31+g(d).gjf (generated)

045102445.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102445.mol 045102445.PUBCHEM 045102445.mol (via Jmol)
045102516.b3lyp_6-31g(d).inp

045102516.b3lyp_6-31g(d).qchem.inp (generated)

045102516.b3lyp_6-31g(d).gjf (generated)

045102516.b3lyp_6-31g(d).firefly.inp (generated)

045102516.b3lyp_6-31g(d).smash.inp (generated)

045102516.b3lyp_6-31g(d).nwchem.inp (generated) 045102516.b3lyp_6-31g(d).log.xz 045102516.mol 045102516.PUBCHEM 045102516.mol (via Jmol)
045102518.b3lyp_6-31g(d).inp

045102518.b3lyp_6-31g(d).qchem.inp (generated)

045102518.b3lyp_6-31g(d).gjf (generated)

045102518.b3lyp_6-31g(d).firefly.inp (generated)

045102518.b3lyp_6-31g(d).smash.inp (generated)

045102518.b3lyp_6-31g(d).nwchem.inp (generated) 045102518.b3lyp_6-31g(d).log.xz 045102518.td-b3lyp_6-31g+(d).inp 045102518.td-b3lyp_6-31g+(d).log.xz

045102518.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102518.td-b3lyp_6-31+g(d).gjf (generated)

045102518.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102518.mol 045102518.PUBCHEM 045102518.mol (via Jmol)
045102520.b3lyp_6-31g(d).inp

045102520.b3lyp_6-31g(d).qchem.inp (generated)

045102520.b3lyp_6-31g(d).gjf (generated)

045102520.b3lyp_6-31g(d).firefly.inp (generated)

045102520.b3lyp_6-31g(d).smash.inp (generated)

045102520.b3lyp_6-31g(d).nwchem.inp (generated) 045102520.b3lyp_6-31g(d).log.xz 045102520.td-b3lyp_6-31g+(d).inp 045102520.td-b3lyp_6-31g+(d).log.xz

045102520.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102520.td-b3lyp_6-31+g(d).gjf (generated)

045102520.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102520.mol 045102520.PUBCHEM 045102520.mol (via Jmol)
045102616.b3lyp_6-31g(d).inp

045102616.b3lyp_6-31g(d).qchem.inp (generated)

045102616.b3lyp_6-31g(d).gjf (generated)

045102616.b3lyp_6-31g(d).firefly.inp (generated)

045102616.b3lyp_6-31g(d).smash.inp (generated)

045102616.b3lyp_6-31g(d).nwchem.inp (generated) 045102616.b3lyp_6-31g(d).log.xz 045102616.mol 045102616.PUBCHEM 045102616.mol (via Jmol)
045102631.b3lyp_6-31g(d).inp

045102631.b3lyp_6-31g(d).qchem.inp (generated)

045102631.b3lyp_6-31g(d).gjf (generated)

045102631.b3lyp_6-31g(d).firefly.inp (generated)

045102631.b3lyp_6-31g(d).smash.inp (generated)

045102631.b3lyp_6-31g(d).nwchem.inp (generated) 045102631.b3lyp_6-31g(d).log.xz 045102631.td-b3lyp_6-31g+(d).inp 045102631.td-b3lyp_6-31g+(d).log.xz

045102631.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102631.td-b3lyp_6-31+g(d).gjf (generated)

045102631.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102631.mol 045102631.PUBCHEM 045102631.mol (via Jmol)
045102648.b3lyp_6-31g(d).inp

045102648.b3lyp_6-31g(d).qchem.inp (generated)

045102648.b3lyp_6-31g(d).gjf (generated)

045102648.b3lyp_6-31g(d).firefly.inp (generated)

045102648.b3lyp_6-31g(d).smash.inp (generated)

045102648.b3lyp_6-31g(d).nwchem.inp (generated) 045102648.b3lyp_6-31g(d).log.xz 045102648.td-b3lyp_6-31g+(d).inp 045102648.td-b3lyp_6-31g+(d).log.xz

045102648.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102648.td-b3lyp_6-31+g(d).gjf (generated)

045102648.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102648.mol 045102648.PUBCHEM 045102648.mol (via Jmol)
045102790.b3lyp_6-31g(d).inp

045102790.b3lyp_6-31g(d).qchem.inp (generated)

045102790.b3lyp_6-31g(d).gjf (generated)

045102790.b3lyp_6-31g(d).firefly.inp (generated)

045102790.b3lyp_6-31g(d).smash.inp (generated)

045102790.b3lyp_6-31g(d).nwchem.inp (generated) 045102790.b3lyp_6-31g(d).log.xz 045102790.td-b3lyp_6-31g+(d).inp 045102790.td-b3lyp_6-31g+(d).log.xz

045102790.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102790.td-b3lyp_6-31+g(d).gjf (generated)

045102790.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102790.mol 045102790.PUBCHEM 045102790.mol (via Jmol)
045102794.b3lyp_6-31g(d).inp

045102794.b3lyp_6-31g(d).qchem.inp (generated)

045102794.b3lyp_6-31g(d).gjf (generated)

045102794.b3lyp_6-31g(d).firefly.inp (generated)

045102794.b3lyp_6-31g(d).smash.inp (generated)

045102794.b3lyp_6-31g(d).nwchem.inp (generated) 045102794.b3lyp_6-31g(d).log.xz 045102794.td-b3lyp_6-31g+(d).inp 045102794.td-b3lyp_6-31g+(d).log.xz

045102794.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102794.td-b3lyp_6-31+g(d).gjf (generated)

045102794.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102794.mol 045102794.PUBCHEM 045102794.mol (via Jmol)
045102839.b3lyp_6-31g(d).inp

045102839.b3lyp_6-31g(d).qchem.inp (generated)

045102839.b3lyp_6-31g(d).gjf (generated)

045102839.b3lyp_6-31g(d).firefly.inp (generated)

045102839.b3lyp_6-31g(d).smash.inp (generated)

045102839.b3lyp_6-31g(d).nwchem.inp (generated) 045102839.b3lyp_6-31g(d).log.xz 045102839.td-b3lyp_6-31g+(d).inp 045102839.td-b3lyp_6-31g+(d).log.xz

045102839.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102839.td-b3lyp_6-31+g(d).gjf (generated)

045102839.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102839.mol 045102839.PUBCHEM 045102839.mol (via Jmol)
045102862.b3lyp_6-31g(d).inp

045102862.b3lyp_6-31g(d).qchem.inp (generated)

045102862.b3lyp_6-31g(d).gjf (generated)

045102862.b3lyp_6-31g(d).firefly.inp (generated)

045102862.b3lyp_6-31g(d).smash.inp (generated)

045102862.b3lyp_6-31g(d).nwchem.inp (generated) 045102862.b3lyp_6-31g(d).log.xz 045102862.td-b3lyp_6-31g+(d).inp 045102862.td-b3lyp_6-31g+(d).log.xz

045102862.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102862.td-b3lyp_6-31+g(d).gjf (generated)

045102862.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102862.mol 045102862.PUBCHEM 045102862.mol (via Jmol)
045102877.b3lyp_6-31g(d).inp

045102877.b3lyp_6-31g(d).qchem.inp (generated)

045102877.b3lyp_6-31g(d).gjf (generated)

045102877.b3lyp_6-31g(d).firefly.inp (generated)

045102877.b3lyp_6-31g(d).smash.inp (generated)

045102877.b3lyp_6-31g(d).nwchem.inp (generated) 045102877.b3lyp_6-31g(d).log.xz 045102877.mol 045102877.PUBCHEM 045102877.mol (via Jmol)
045102906.b3lyp_6-31g(d).inp

045102906.b3lyp_6-31g(d).qchem.inp (generated)

045102906.b3lyp_6-31g(d).gjf (generated)

045102906.b3lyp_6-31g(d).firefly.inp (generated)

045102906.b3lyp_6-31g(d).smash.inp (generated)

045102906.b3lyp_6-31g(d).nwchem.inp (generated) 045102906.b3lyp_6-31g(d).log.xz 045102906.td-b3lyp_6-31g+(d).inp 045102906.td-b3lyp_6-31g+(d).log.xz

045102906.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102906.td-b3lyp_6-31+g(d).gjf (generated)

045102906.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102906.mol 045102906.PUBCHEM 045102906.mol (via Jmol)
045102907.b3lyp_6-31g(d).inp

045102907.b3lyp_6-31g(d).qchem.inp (generated)

045102907.b3lyp_6-31g(d).gjf (generated)

045102907.b3lyp_6-31g(d).firefly.inp (generated)

045102907.b3lyp_6-31g(d).smash.inp (generated)

045102907.b3lyp_6-31g(d).nwchem.inp (generated) 045102907.b3lyp_6-31g(d).log.xz 045102907.td-b3lyp_6-31g+(d).inp 045102907.td-b3lyp_6-31g+(d).log.xz

045102907.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102907.td-b3lyp_6-31+g(d).gjf (generated)

045102907.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102907.mol 045102907.PUBCHEM 045102907.mol (via Jmol)
045102908.b3lyp_6-31g(d).inp

045102908.b3lyp_6-31g(d).qchem.inp (generated)

045102908.b3lyp_6-31g(d).gjf (generated)

045102908.b3lyp_6-31g(d).firefly.inp (generated)

045102908.b3lyp_6-31g(d).smash.inp (generated)

045102908.b3lyp_6-31g(d).nwchem.inp (generated) 045102908.b3lyp_6-31g(d).log.xz 045102908.td-b3lyp_6-31g+(d).inp 045102908.td-b3lyp_6-31g+(d).log.xz

045102908.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102908.td-b3lyp_6-31+g(d).gjf (generated)

045102908.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102908.mol 045102908.PUBCHEM 045102908.mol (via Jmol)
045102923.b3lyp_6-31g(d).inp

045102923.b3lyp_6-31g(d).qchem.inp (generated)

045102923.b3lyp_6-31g(d).gjf (generated)

045102923.b3lyp_6-31g(d).firefly.inp (generated)

045102923.b3lyp_6-31g(d).smash.inp (generated)

045102923.b3lyp_6-31g(d).nwchem.inp (generated) 045102923.b3lyp_6-31g(d).log.xz 045102923.td-b3lyp_6-31g+(d).inp 045102923.td-b3lyp_6-31g+(d).log.xz

045102923.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102923.td-b3lyp_6-31+g(d).gjf (generated)

045102923.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102923.mol 045102923.PUBCHEM 045102923.mol (via Jmol)
045102929.b3lyp_6-31g(d).inp

045102929.b3lyp_6-31g(d).qchem.inp (generated)

045102929.b3lyp_6-31g(d).gjf (generated)

045102929.b3lyp_6-31g(d).firefly.inp (generated)

045102929.b3lyp_6-31g(d).smash.inp (generated)

045102929.b3lyp_6-31g(d).nwchem.inp (generated) 045102929.b3lyp_6-31g(d).log.xz 045102929.td-b3lyp_6-31g+(d).inp 045102929.td-b3lyp_6-31g+(d).log.xz

045102929.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102929.td-b3lyp_6-31+g(d).gjf (generated)

045102929.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102929.mol 045102929.PUBCHEM 045102929.mol (via Jmol)
045102944.b3lyp_6-31g(d).inp

045102944.b3lyp_6-31g(d).qchem.inp (generated)

045102944.b3lyp_6-31g(d).gjf (generated)

045102944.b3lyp_6-31g(d).firefly.inp (generated)

045102944.b3lyp_6-31g(d).smash.inp (generated)

045102944.b3lyp_6-31g(d).nwchem.inp (generated) 045102944.b3lyp_6-31g(d).log.xz 045102944.td-b3lyp_6-31g+(d).inp 045102944.td-b3lyp_6-31g+(d).log.xz

045102944.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102944.td-b3lyp_6-31+g(d).gjf (generated)

045102944.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102944.mol 045102944.PUBCHEM 045102944.mol (via Jmol)
045102946.b3lyp_6-31g(d).inp

045102946.b3lyp_6-31g(d).qchem.inp (generated)

045102946.b3lyp_6-31g(d).gjf (generated)

045102946.b3lyp_6-31g(d).firefly.inp (generated)

045102946.b3lyp_6-31g(d).smash.inp (generated)

045102946.b3lyp_6-31g(d).nwchem.inp (generated) 045102946.b3lyp_6-31g(d).log.xz 045102946.td-b3lyp_6-31g+(d).inp 045102946.td-b3lyp_6-31g+(d).log.xz

045102946.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102946.td-b3lyp_6-31+g(d).gjf (generated)

045102946.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102946.mol 045102946.PUBCHEM 045102946.mol (via Jmol)
045102947.b3lyp_6-31g(d).inp

045102947.b3lyp_6-31g(d).qchem.inp (generated)

045102947.b3lyp_6-31g(d).gjf (generated)

045102947.b3lyp_6-31g(d).firefly.inp (generated)

045102947.b3lyp_6-31g(d).smash.inp (generated)

045102947.b3lyp_6-31g(d).nwchem.inp (generated) 045102947.b3lyp_6-31g(d).log.xz 045102947.td-b3lyp_6-31g+(d).inp 045102947.td-b3lyp_6-31g+(d).log.xz

045102947.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102947.td-b3lyp_6-31+g(d).gjf (generated)

045102947.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102947.mol 045102947.PUBCHEM 045102947.mol (via Jmol)
045102949.b3lyp_6-31g(d).inp

045102949.b3lyp_6-31g(d).qchem.inp (generated)

045102949.b3lyp_6-31g(d).gjf (generated)

045102949.b3lyp_6-31g(d).firefly.inp (generated)

045102949.b3lyp_6-31g(d).smash.inp (generated)

045102949.b3lyp_6-31g(d).nwchem.inp (generated) 045102949.b3lyp_6-31g(d).log.xz 045102949.td-b3lyp_6-31g+(d).inp 045102949.td-b3lyp_6-31g+(d).log.xz

045102949.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102949.td-b3lyp_6-31+g(d).gjf (generated)

045102949.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102949.mol 045102949.PUBCHEM 045102949.mol (via Jmol)
045102972.b3lyp_6-31g(d).inp

045102972.b3lyp_6-31g(d).qchem.inp (generated)

045102972.b3lyp_6-31g(d).gjf (generated)

045102972.b3lyp_6-31g(d).firefly.inp (generated)

045102972.b3lyp_6-31g(d).smash.inp (generated)

045102972.b3lyp_6-31g(d).nwchem.inp (generated) 045102972.b3lyp_6-31g(d).log.xz 045102972.td-b3lyp_6-31g+(d).inp 045102972.td-b3lyp_6-31g+(d).log.xz

045102972.td-b3lyp_6-31+g(d).qchem.inp (generated)

045102972.td-b3lyp_6-31+g(d).gjf (generated)

045102972.td-b3lyp_6-31+g(d).firefly.inp (generated)

045102972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045102972.mol 045102972.PUBCHEM 045102972.mol (via Jmol)
045103011.b3lyp_6-31g(d).inp

045103011.b3lyp_6-31g(d).qchem.inp (generated)

045103011.b3lyp_6-31g(d).gjf (generated)

045103011.b3lyp_6-31g(d).firefly.inp (generated)

045103011.b3lyp_6-31g(d).smash.inp (generated)

045103011.b3lyp_6-31g(d).nwchem.inp (generated) 045103011.b3lyp_6-31g(d).log.xz 045103011.td-b3lyp_6-31g+(d).inp 045103011.td-b3lyp_6-31g+(d).log.xz

045103011.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103011.td-b3lyp_6-31+g(d).gjf (generated)

045103011.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103011.mol 045103011.PUBCHEM 045103011.mol (via Jmol)
045103018.b3lyp_6-31g(d).inp

045103018.b3lyp_6-31g(d).qchem.inp (generated)

045103018.b3lyp_6-31g(d).gjf (generated)

045103018.b3lyp_6-31g(d).firefly.inp (generated)

045103018.b3lyp_6-31g(d).smash.inp (generated)

045103018.b3lyp_6-31g(d).nwchem.inp (generated) 045103018.b3lyp_6-31g(d).log.xz 045103018.td-b3lyp_6-31g+(d).inp 045103018.td-b3lyp_6-31g+(d).log.xz

045103018.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103018.td-b3lyp_6-31+g(d).gjf (generated)

045103018.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103018.mol 045103018.PUBCHEM 045103018.mol (via Jmol)
045103038.b3lyp_6-31g(d).inp

045103038.b3lyp_6-31g(d).qchem.inp (generated)

045103038.b3lyp_6-31g(d).gjf (generated)

045103038.b3lyp_6-31g(d).firefly.inp (generated)

045103038.b3lyp_6-31g(d).smash.inp (generated)

045103038.b3lyp_6-31g(d).nwchem.inp (generated) 045103038.b3lyp_6-31g(d).log.xz 045103038.td-b3lyp_6-31g+(d).inp 045103038.td-b3lyp_6-31g+(d).log.xz

045103038.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103038.td-b3lyp_6-31+g(d).gjf (generated)

045103038.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103038.mol 045103038.PUBCHEM 045103038.mol (via Jmol)
045103039.b3lyp_6-31g(d).inp

045103039.b3lyp_6-31g(d).qchem.inp (generated)

045103039.b3lyp_6-31g(d).gjf (generated)

045103039.b3lyp_6-31g(d).firefly.inp (generated)

045103039.b3lyp_6-31g(d).smash.inp (generated)

045103039.b3lyp_6-31g(d).nwchem.inp (generated) 045103039.b3lyp_6-31g(d).log.xz 045103039.td-b3lyp_6-31g+(d).inp 045103039.td-b3lyp_6-31g+(d).log.xz

045103039.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103039.td-b3lyp_6-31+g(d).gjf (generated)

045103039.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103039.mol 045103039.PUBCHEM 045103039.mol (via Jmol)
045103040.b3lyp_6-31g(d).inp

045103040.b3lyp_6-31g(d).qchem.inp (generated)

045103040.b3lyp_6-31g(d).gjf (generated)

045103040.b3lyp_6-31g(d).firefly.inp (generated)

045103040.b3lyp_6-31g(d).smash.inp (generated)

045103040.b3lyp_6-31g(d).nwchem.inp (generated) 045103040.b3lyp_6-31g(d).log.xz 045103040.td-b3lyp_6-31g+(d).inp 045103040.td-b3lyp_6-31g+(d).log.xz

045103040.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103040.td-b3lyp_6-31+g(d).gjf (generated)

045103040.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103040.mol 045103040.PUBCHEM 045103040.mol (via Jmol)
045103041.b3lyp_6-31g(d).inp

045103041.b3lyp_6-31g(d).qchem.inp (generated)

045103041.b3lyp_6-31g(d).gjf (generated)

045103041.b3lyp_6-31g(d).firefly.inp (generated)

045103041.b3lyp_6-31g(d).smash.inp (generated)

045103041.b3lyp_6-31g(d).nwchem.inp (generated) 045103041.b3lyp_6-31g(d).log.xz 045103041.td-b3lyp_6-31g+(d).inp 045103041.td-b3lyp_6-31g+(d).log.xz

045103041.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103041.td-b3lyp_6-31+g(d).gjf (generated)

045103041.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103041.mol 045103041.PUBCHEM 045103041.mol (via Jmol)
045103042.b3lyp_6-31g(d).inp

045103042.b3lyp_6-31g(d).qchem.inp (generated)

045103042.b3lyp_6-31g(d).gjf (generated)

045103042.b3lyp_6-31g(d).firefly.inp (generated)

045103042.b3lyp_6-31g(d).smash.inp (generated)

045103042.b3lyp_6-31g(d).nwchem.inp (generated) 045103042.b3lyp_6-31g(d).log.xz 045103042.mol 045103042.PUBCHEM 045103042.mol (via Jmol)
045103048.b3lyp_6-31g(d).inp

045103048.b3lyp_6-31g(d).qchem.inp (generated)

045103048.b3lyp_6-31g(d).gjf (generated)

045103048.b3lyp_6-31g(d).firefly.inp (generated)

045103048.b3lyp_6-31g(d).smash.inp (generated)

045103048.b3lyp_6-31g(d).nwchem.inp (generated) 045103048.b3lyp_6-31g(d).log.xz 045103048.td-b3lyp_6-31g+(d).inp 045103048.td-b3lyp_6-31g+(d).log.xz

045103048.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103048.td-b3lyp_6-31+g(d).gjf (generated)

045103048.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103048.mol 045103048.PUBCHEM 045103048.mol (via Jmol)
045103105.b3lyp_6-31g(d).inp

045103105.b3lyp_6-31g(d).qchem.inp (generated)

045103105.b3lyp_6-31g(d).gjf (generated)

045103105.b3lyp_6-31g(d).firefly.inp (generated)

045103105.b3lyp_6-31g(d).smash.inp (generated)

045103105.b3lyp_6-31g(d).nwchem.inp (generated) 045103105.b3lyp_6-31g(d).log.xz 045103105.td-b3lyp_6-31g+(d).inp 045103105.td-b3lyp_6-31g+(d).log.xz

045103105.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103105.td-b3lyp_6-31+g(d).gjf (generated)

045103105.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103105.mol 045103105.PUBCHEM 045103105.mol (via Jmol)
045103107.b3lyp_6-31g(d).inp

045103107.b3lyp_6-31g(d).qchem.inp (generated)

045103107.b3lyp_6-31g(d).gjf (generated)

045103107.b3lyp_6-31g(d).firefly.inp (generated)

045103107.b3lyp_6-31g(d).smash.inp (generated)

045103107.b3lyp_6-31g(d).nwchem.inp (generated) 045103107.b3lyp_6-31g(d).log.xz 045103107.mol 045103107.PUBCHEM 045103107.mol (via Jmol)
045103108.b3lyp_6-31g(d).inp

045103108.b3lyp_6-31g(d).qchem.inp (generated)

045103108.b3lyp_6-31g(d).gjf (generated)

045103108.b3lyp_6-31g(d).firefly.inp (generated)

045103108.b3lyp_6-31g(d).smash.inp (generated)

045103108.b3lyp_6-31g(d).nwchem.inp (generated) 045103108.b3lyp_6-31g(d).log.xz 045103108.td-b3lyp_6-31g+(d).inp 045103108.td-b3lyp_6-31g+(d).log.xz

045103108.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103108.td-b3lyp_6-31+g(d).gjf (generated)

045103108.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103108.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103108.mol 045103108.PUBCHEM 045103108.mol (via Jmol)
045103110.b3lyp_6-31g(d).inp

045103110.b3lyp_6-31g(d).qchem.inp (generated)

045103110.b3lyp_6-31g(d).gjf (generated)

045103110.b3lyp_6-31g(d).firefly.inp (generated)

045103110.b3lyp_6-31g(d).smash.inp (generated)

045103110.b3lyp_6-31g(d).nwchem.inp (generated) 045103110.b3lyp_6-31g(d).log.xz 045103110.td-b3lyp_6-31g+(d).inp 045103110.td-b3lyp_6-31g+(d).log.xz

045103110.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103110.td-b3lyp_6-31+g(d).gjf (generated)

045103110.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103110.mol 045103110.PUBCHEM 045103110.mol (via Jmol)
045103120.b3lyp_6-31g(d).inp

045103120.b3lyp_6-31g(d).qchem.inp (generated)

045103120.b3lyp_6-31g(d).gjf (generated)

045103120.b3lyp_6-31g(d).firefly.inp (generated)

045103120.b3lyp_6-31g(d).smash.inp (generated)

045103120.b3lyp_6-31g(d).nwchem.inp (generated) 045103120.b3lyp_6-31g(d).log.xz 045103120.td-b3lyp_6-31g+(d).inp 045103120.td-b3lyp_6-31g+(d).log.xz

045103120.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103120.td-b3lyp_6-31+g(d).gjf (generated)

045103120.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103120.mol 045103120.PUBCHEM 045103120.mol (via Jmol)
045103121.b3lyp_6-31g(d).inp

045103121.b3lyp_6-31g(d).qchem.inp (generated)

045103121.b3lyp_6-31g(d).gjf (generated)

045103121.b3lyp_6-31g(d).firefly.inp (generated)

045103121.b3lyp_6-31g(d).smash.inp (generated)

045103121.b3lyp_6-31g(d).nwchem.inp (generated) 045103121.b3lyp_6-31g(d).log.xz 045103121.td-b3lyp_6-31g+(d).inp 045103121.td-b3lyp_6-31g+(d).log.xz

045103121.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103121.td-b3lyp_6-31+g(d).gjf (generated)

045103121.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103121.mol 045103121.PUBCHEM 045103121.mol (via Jmol)
045103156.b3lyp_6-31g(d).inp

045103156.b3lyp_6-31g(d).qchem.inp (generated)

045103156.b3lyp_6-31g(d).gjf (generated)

045103156.b3lyp_6-31g(d).firefly.inp (generated)

045103156.b3lyp_6-31g(d).smash.inp (generated)

045103156.b3lyp_6-31g(d).nwchem.inp (generated) 045103156.b3lyp_6-31g(d).log.xz 045103156.td-b3lyp_6-31g+(d).inp 045103156.td-b3lyp_6-31g+(d).log.xz

045103156.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103156.td-b3lyp_6-31+g(d).gjf (generated)

045103156.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103156.mol 045103156.PUBCHEM 045103156.mol (via Jmol)
045103160.b3lyp_6-31g(d).inp

045103160.b3lyp_6-31g(d).qchem.inp (generated)

045103160.b3lyp_6-31g(d).gjf (generated)

045103160.b3lyp_6-31g(d).firefly.inp (generated)

045103160.b3lyp_6-31g(d).smash.inp (generated)

045103160.b3lyp_6-31g(d).nwchem.inp (generated) 045103160.b3lyp_6-31g(d).log.xz 045103160.td-b3lyp_6-31g+(d).inp 045103160.td-b3lyp_6-31g+(d).log.xz

045103160.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103160.td-b3lyp_6-31+g(d).gjf (generated)

045103160.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103160.mol 045103160.PUBCHEM 045103160.mol (via Jmol)
045103163.b3lyp_6-31g(d).inp

045103163.b3lyp_6-31g(d).qchem.inp (generated)

045103163.b3lyp_6-31g(d).gjf (generated)

045103163.b3lyp_6-31g(d).firefly.inp (generated)

045103163.b3lyp_6-31g(d).smash.inp (generated)

045103163.b3lyp_6-31g(d).nwchem.inp (generated) 045103163.b3lyp_6-31g(d).log.xz 045103163.td-b3lyp_6-31g+(d).inp 045103163.td-b3lyp_6-31g+(d).log.xz

045103163.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103163.td-b3lyp_6-31+g(d).gjf (generated)

045103163.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103163.mol 045103163.PUBCHEM 045103163.mol (via Jmol)
045103166.b3lyp_6-31g(d).inp

045103166.b3lyp_6-31g(d).qchem.inp (generated)

045103166.b3lyp_6-31g(d).gjf (generated)

045103166.b3lyp_6-31g(d).firefly.inp (generated)

045103166.b3lyp_6-31g(d).smash.inp (generated)

045103166.b3lyp_6-31g(d).nwchem.inp (generated) 045103166.b3lyp_6-31g(d).log.xz 045103166.td-b3lyp_6-31g+(d).inp 045103166.td-b3lyp_6-31g+(d).log.xz

045103166.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103166.td-b3lyp_6-31+g(d).gjf (generated)

045103166.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103166.mol 045103166.PUBCHEM 045103166.mol (via Jmol)
045103167.b3lyp_6-31g(d).inp

045103167.b3lyp_6-31g(d).qchem.inp (generated)

045103167.b3lyp_6-31g(d).gjf (generated)

045103167.b3lyp_6-31g(d).firefly.inp (generated)

045103167.b3lyp_6-31g(d).smash.inp (generated)

045103167.b3lyp_6-31g(d).nwchem.inp (generated) 045103167.b3lyp_6-31g(d).log.xz 045103167.td-b3lyp_6-31g+(d).inp 045103167.td-b3lyp_6-31g+(d).log.xz

045103167.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103167.td-b3lyp_6-31+g(d).gjf (generated)

045103167.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103167.mol 045103167.PUBCHEM 045103167.mol (via Jmol)
045103168.b3lyp_6-31g(d).inp

045103168.b3lyp_6-31g(d).qchem.inp (generated)

045103168.b3lyp_6-31g(d).gjf (generated)

045103168.b3lyp_6-31g(d).firefly.inp (generated)

045103168.b3lyp_6-31g(d).smash.inp (generated)

045103168.b3lyp_6-31g(d).nwchem.inp (generated) 045103168.b3lyp_6-31g(d).log.xz 045103168.mol 045103168.PUBCHEM 045103168.mol (via Jmol)
045103169.b3lyp_6-31g(d).inp

045103169.b3lyp_6-31g(d).qchem.inp (generated)

045103169.b3lyp_6-31g(d).gjf (generated)

045103169.b3lyp_6-31g(d).firefly.inp (generated)

045103169.b3lyp_6-31g(d).smash.inp (generated)

045103169.b3lyp_6-31g(d).nwchem.inp (generated) 045103169.b3lyp_6-31g(d).log.xz 045103169.td-b3lyp_6-31g+(d).inp 045103169.td-b3lyp_6-31g+(d).log.xz

045103169.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103169.td-b3lyp_6-31+g(d).gjf (generated)

045103169.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103169.mol 045103169.PUBCHEM 045103169.mol (via Jmol)
045103195.b3lyp_6-31g(d).inp

045103195.b3lyp_6-31g(d).qchem.inp (generated)

045103195.b3lyp_6-31g(d).gjf (generated)

045103195.b3lyp_6-31g(d).firefly.inp (generated)

045103195.b3lyp_6-31g(d).smash.inp (generated)

045103195.b3lyp_6-31g(d).nwchem.inp (generated) 045103195.b3lyp_6-31g(d).log.xz 045103195.td-b3lyp_6-31g+(d).inp 045103195.td-b3lyp_6-31g+(d).log.xz

045103195.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103195.td-b3lyp_6-31+g(d).gjf (generated)

045103195.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103195.mol 045103195.PUBCHEM 045103195.mol (via Jmol)
045103210.b3lyp_6-31g(d).inp

045103210.b3lyp_6-31g(d).qchem.inp (generated)

045103210.b3lyp_6-31g(d).gjf (generated)

045103210.b3lyp_6-31g(d).firefly.inp (generated)

045103210.b3lyp_6-31g(d).smash.inp (generated)

045103210.b3lyp_6-31g(d).nwchem.inp (generated) 045103210.b3lyp_6-31g(d).log.xz 045103210.mol 045103210.PUBCHEM 045103210.mol (via Jmol)
045103216.b3lyp_6-31g(d).inp

045103216.b3lyp_6-31g(d).qchem.inp (generated)

045103216.b3lyp_6-31g(d).gjf (generated)

045103216.b3lyp_6-31g(d).firefly.inp (generated)

045103216.b3lyp_6-31g(d).smash.inp (generated)

045103216.b3lyp_6-31g(d).nwchem.inp (generated) 045103216.b3lyp_6-31g(d).log.xz 045103216.td-b3lyp_6-31g+(d).inp 045103216.td-b3lyp_6-31g+(d).log.xz

045103216.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103216.td-b3lyp_6-31+g(d).gjf (generated)

045103216.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103216.mol 045103216.PUBCHEM 045103216.mol (via Jmol)
045103253.b3lyp_6-31g(d).inp

045103253.b3lyp_6-31g(d).qchem.inp (generated)

045103253.b3lyp_6-31g(d).gjf (generated)

045103253.b3lyp_6-31g(d).firefly.inp (generated)

045103253.b3lyp_6-31g(d).smash.inp (generated)

045103253.b3lyp_6-31g(d).nwchem.inp (generated) 045103253.b3lyp_6-31g(d).log.xz 045103253.td-b3lyp_6-31g+(d).inp 045103253.td-b3lyp_6-31g+(d).log.xz

045103253.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103253.td-b3lyp_6-31+g(d).gjf (generated)

045103253.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103253.mol 045103253.PUBCHEM 045103253.mol (via Jmol)
045103268.b3lyp_6-31g(d).inp

045103268.b3lyp_6-31g(d).qchem.inp (generated)

045103268.b3lyp_6-31g(d).gjf (generated)

045103268.b3lyp_6-31g(d).firefly.inp (generated)

045103268.b3lyp_6-31g(d).smash.inp (generated)

045103268.b3lyp_6-31g(d).nwchem.inp (generated) 045103268.b3lyp_6-31g(d).log.xz 045103268.td-b3lyp_6-31g+(d).inp 045103268.td-b3lyp_6-31g+(d).log.xz

045103268.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103268.td-b3lyp_6-31+g(d).gjf (generated)

045103268.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103268.mol 045103268.PUBCHEM 045103268.mol (via Jmol)
045103270.b3lyp_6-31g(d).inp

045103270.b3lyp_6-31g(d).qchem.inp (generated)

045103270.b3lyp_6-31g(d).gjf (generated)

045103270.b3lyp_6-31g(d).firefly.inp (generated)

045103270.b3lyp_6-31g(d).smash.inp (generated)

045103270.b3lyp_6-31g(d).nwchem.inp (generated) 045103270.b3lyp_6-31g(d).log.xz 045103270.td-b3lyp_6-31g+(d).inp 045103270.td-b3lyp_6-31g+(d).log.xz

045103270.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103270.td-b3lyp_6-31+g(d).gjf (generated)

045103270.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103270.mol 045103270.PUBCHEM 045103270.mol (via Jmol)
045103271.b3lyp_6-31g(d).inp

045103271.b3lyp_6-31g(d).qchem.inp (generated)

045103271.b3lyp_6-31g(d).gjf (generated)

045103271.b3lyp_6-31g(d).firefly.inp (generated)

045103271.b3lyp_6-31g(d).smash.inp (generated)

045103271.b3lyp_6-31g(d).nwchem.inp (generated) 045103271.b3lyp_6-31g(d).log.xz 045103271.td-b3lyp_6-31g+(d).inp 045103271.td-b3lyp_6-31g+(d).log.xz

045103271.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103271.td-b3lyp_6-31+g(d).gjf (generated)

045103271.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103271.mol 045103271.PUBCHEM 045103271.mol (via Jmol)
045103307.b3lyp_6-31g(d).inp

045103307.b3lyp_6-31g(d).qchem.inp (generated)

045103307.b3lyp_6-31g(d).gjf (generated)

045103307.b3lyp_6-31g(d).firefly.inp (generated)

045103307.b3lyp_6-31g(d).smash.inp (generated)

045103307.b3lyp_6-31g(d).nwchem.inp (generated) 045103307.b3lyp_6-31g(d).log.xz 045103307.td-b3lyp_6-31g+(d).inp 045103307.td-b3lyp_6-31g+(d).log.xz

045103307.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103307.td-b3lyp_6-31+g(d).gjf (generated)

045103307.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103307.mol 045103307.PUBCHEM 045103307.mol (via Jmol)
045103316.b3lyp_6-31g(d).inp

045103316.b3lyp_6-31g(d).qchem.inp (generated)

045103316.b3lyp_6-31g(d).gjf (generated)

045103316.b3lyp_6-31g(d).firefly.inp (generated)

045103316.b3lyp_6-31g(d).smash.inp (generated)

045103316.b3lyp_6-31g(d).nwchem.inp (generated) 045103316.b3lyp_6-31g(d).log.xz 045103316.mol 045103316.PUBCHEM 045103316.mol (via Jmol)
045103321.b3lyp_6-31g(d).inp

045103321.b3lyp_6-31g(d).qchem.inp (generated)

045103321.b3lyp_6-31g(d).gjf (generated)

045103321.b3lyp_6-31g(d).firefly.inp (generated)

045103321.b3lyp_6-31g(d).smash.inp (generated)

045103321.b3lyp_6-31g(d).nwchem.inp (generated) 045103321.b3lyp_6-31g(d).log.xz 045103321.td-b3lyp_6-31g+(d).inp 045103321.td-b3lyp_6-31g+(d).log.xz

045103321.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103321.td-b3lyp_6-31+g(d).gjf (generated)

045103321.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103321.mol 045103321.PUBCHEM 045103321.mol (via Jmol)
045103323.b3lyp_6-31g(d).inp

045103323.b3lyp_6-31g(d).qchem.inp (generated)

045103323.b3lyp_6-31g(d).gjf (generated)

045103323.b3lyp_6-31g(d).firefly.inp (generated)

045103323.b3lyp_6-31g(d).smash.inp (generated)

045103323.b3lyp_6-31g(d).nwchem.inp (generated) 045103323.b3lyp_6-31g(d).log.xz 045103323.td-b3lyp_6-31g+(d).inp 045103323.td-b3lyp_6-31g+(d).log.xz

045103323.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103323.td-b3lyp_6-31+g(d).gjf (generated)

045103323.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103323.mol 045103323.PUBCHEM 045103323.mol (via Jmol)
045103327.b3lyp_6-31g(d).inp

045103327.b3lyp_6-31g(d).qchem.inp (generated)

045103327.b3lyp_6-31g(d).gjf (generated)

045103327.b3lyp_6-31g(d).firefly.inp (generated)

045103327.b3lyp_6-31g(d).smash.inp (generated)

045103327.b3lyp_6-31g(d).nwchem.inp (generated) 045103327.b3lyp_6-31g(d).log.xz 045103327.td-b3lyp_6-31g+(d).inp 045103327.td-b3lyp_6-31g+(d).log.xz

045103327.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103327.td-b3lyp_6-31+g(d).gjf (generated)

045103327.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103327.mol 045103327.PUBCHEM 045103327.mol (via Jmol)
045103335.b3lyp_6-31g(d).inp

045103335.b3lyp_6-31g(d).qchem.inp (generated)

045103335.b3lyp_6-31g(d).gjf (generated)

045103335.b3lyp_6-31g(d).firefly.inp (generated)

045103335.b3lyp_6-31g(d).smash.inp (generated)

045103335.b3lyp_6-31g(d).nwchem.inp (generated) 045103335.b3lyp_6-31g(d).log.xz 045103335.td-b3lyp_6-31g+(d).inp 045103335.td-b3lyp_6-31g+(d).log.xz

045103335.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103335.td-b3lyp_6-31+g(d).gjf (generated)

045103335.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103335.mol 045103335.PUBCHEM 045103335.mol (via Jmol)
045103358.b3lyp_6-31g(d).inp

045103358.b3lyp_6-31g(d).qchem.inp (generated)

045103358.b3lyp_6-31g(d).gjf (generated)

045103358.b3lyp_6-31g(d).firefly.inp (generated)

045103358.b3lyp_6-31g(d).smash.inp (generated)

045103358.b3lyp_6-31g(d).nwchem.inp (generated) 045103358.b3lyp_6-31g(d).log.xz 045103358.td-b3lyp_6-31g+(d).inp 045103358.td-b3lyp_6-31g+(d).log.xz

045103358.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103358.td-b3lyp_6-31+g(d).gjf (generated)

045103358.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103358.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103358.mol 045103358.PUBCHEM 045103358.mol (via Jmol)
045103364.b3lyp_6-31g(d).inp

045103364.b3lyp_6-31g(d).qchem.inp (generated)

045103364.b3lyp_6-31g(d).gjf (generated)

045103364.b3lyp_6-31g(d).firefly.inp (generated)

045103364.b3lyp_6-31g(d).smash.inp (generated)

045103364.b3lyp_6-31g(d).nwchem.inp (generated) 045103364.b3lyp_6-31g(d).log.xz 045103364.td-b3lyp_6-31g+(d).inp 045103364.td-b3lyp_6-31g+(d).log.xz

045103364.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103364.td-b3lyp_6-31+g(d).gjf (generated)

045103364.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103364.mol 045103364.PUBCHEM 045103364.mol (via Jmol)
045103373.b3lyp_6-31g(d).inp

045103373.b3lyp_6-31g(d).qchem.inp (generated)

045103373.b3lyp_6-31g(d).gjf (generated)

045103373.b3lyp_6-31g(d).firefly.inp (generated)

045103373.b3lyp_6-31g(d).smash.inp (generated)

045103373.b3lyp_6-31g(d).nwchem.inp (generated) 045103373.b3lyp_6-31g(d).log.xz 045103373.td-b3lyp_6-31g+(d).inp 045103373.td-b3lyp_6-31g+(d).log.xz

045103373.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103373.td-b3lyp_6-31+g(d).gjf (generated)

045103373.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103373.mol 045103373.PUBCHEM 045103373.mol (via Jmol)
045103374.b3lyp_6-31g(d).inp

045103374.b3lyp_6-31g(d).qchem.inp (generated)

045103374.b3lyp_6-31g(d).gjf (generated)

045103374.b3lyp_6-31g(d).firefly.inp (generated)

045103374.b3lyp_6-31g(d).smash.inp (generated)

045103374.b3lyp_6-31g(d).nwchem.inp (generated) 045103374.b3lyp_6-31g(d).log.xz 045103374.td-b3lyp_6-31g+(d).inp 045103374.td-b3lyp_6-31g+(d).log.xz

045103374.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103374.td-b3lyp_6-31+g(d).gjf (generated)

045103374.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103374.mol 045103374.PUBCHEM 045103374.mol (via Jmol)
045103380.b3lyp_6-31g(d).inp

045103380.b3lyp_6-31g(d).qchem.inp (generated)

045103380.b3lyp_6-31g(d).gjf (generated)

045103380.b3lyp_6-31g(d).firefly.inp (generated)

045103380.b3lyp_6-31g(d).smash.inp (generated)

045103380.b3lyp_6-31g(d).nwchem.inp (generated) 045103380.b3lyp_6-31g(d).log.xz 045103380.td-b3lyp_6-31g+(d).inp 045103380.td-b3lyp_6-31g+(d).log.xz

045103380.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103380.td-b3lyp_6-31+g(d).gjf (generated)

045103380.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103380.mol 045103380.PUBCHEM 045103380.mol (via Jmol)
045103381.b3lyp_6-31g(d).inp

045103381.b3lyp_6-31g(d).qchem.inp (generated)

045103381.b3lyp_6-31g(d).gjf (generated)

045103381.b3lyp_6-31g(d).firefly.inp (generated)

045103381.b3lyp_6-31g(d).smash.inp (generated)

045103381.b3lyp_6-31g(d).nwchem.inp (generated) 045103381.b3lyp_6-31g(d).log.xz 045103381.td-b3lyp_6-31g+(d).inp 045103381.td-b3lyp_6-31g+(d).log.xz

045103381.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103381.td-b3lyp_6-31+g(d).gjf (generated)

045103381.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103381.mol 045103381.PUBCHEM 045103381.mol (via Jmol)
045103382.b3lyp_6-31g(d).inp

045103382.b3lyp_6-31g(d).qchem.inp (generated)

045103382.b3lyp_6-31g(d).gjf (generated)

045103382.b3lyp_6-31g(d).firefly.inp (generated)

045103382.b3lyp_6-31g(d).smash.inp (generated)

045103382.b3lyp_6-31g(d).nwchem.inp (generated) 045103382.b3lyp_6-31g(d).log.xz 045103382.td-b3lyp_6-31g+(d).inp 045103382.td-b3lyp_6-31g+(d).log.xz

045103382.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103382.td-b3lyp_6-31+g(d).gjf (generated)

045103382.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103382.mol 045103382.PUBCHEM 045103382.mol (via Jmol)
045103383.b3lyp_6-31g(d).inp

045103383.b3lyp_6-31g(d).qchem.inp (generated)

045103383.b3lyp_6-31g(d).gjf (generated)

045103383.b3lyp_6-31g(d).firefly.inp (generated)

045103383.b3lyp_6-31g(d).smash.inp (generated)

045103383.b3lyp_6-31g(d).nwchem.inp (generated) 045103383.b3lyp_6-31g(d).log.xz 045103383.td-b3lyp_6-31g+(d).inp 045103383.td-b3lyp_6-31g+(d).log.xz

045103383.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103383.td-b3lyp_6-31+g(d).gjf (generated)

045103383.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103383.mol 045103383.PUBCHEM 045103383.mol (via Jmol)
045103386.b3lyp_6-31g(d).inp

045103386.b3lyp_6-31g(d).qchem.inp (generated)

045103386.b3lyp_6-31g(d).gjf (generated)

045103386.b3lyp_6-31g(d).firefly.inp (generated)

045103386.b3lyp_6-31g(d).smash.inp (generated)

045103386.b3lyp_6-31g(d).nwchem.inp (generated) 045103386.b3lyp_6-31g(d).log.xz 045103386.td-b3lyp_6-31g+(d).inp 045103386.td-b3lyp_6-31g+(d).log.xz

045103386.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103386.td-b3lyp_6-31+g(d).gjf (generated)

045103386.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103386.mol 045103386.PUBCHEM 045103386.mol (via Jmol)
045103387.b3lyp_6-31g(d).inp

045103387.b3lyp_6-31g(d).qchem.inp (generated)

045103387.b3lyp_6-31g(d).gjf (generated)

045103387.b3lyp_6-31g(d).firefly.inp (generated)

045103387.b3lyp_6-31g(d).smash.inp (generated)

045103387.b3lyp_6-31g(d).nwchem.inp (generated) 045103387.b3lyp_6-31g(d).log.xz 045103387.td-b3lyp_6-31g+(d).inp 045103387.td-b3lyp_6-31g+(d).log.xz

045103387.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103387.td-b3lyp_6-31+g(d).gjf (generated)

045103387.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103387.mol 045103387.PUBCHEM 045103387.mol (via Jmol)
045103388.b3lyp_6-31g(d).inp

045103388.b3lyp_6-31g(d).qchem.inp (generated)

045103388.b3lyp_6-31g(d).gjf (generated)

045103388.b3lyp_6-31g(d).firefly.inp (generated)

045103388.b3lyp_6-31g(d).smash.inp (generated)

045103388.b3lyp_6-31g(d).nwchem.inp (generated) 045103388.b3lyp_6-31g(d).log.xz 045103388.td-b3lyp_6-31g+(d).inp 045103388.td-b3lyp_6-31g+(d).log.xz

045103388.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103388.td-b3lyp_6-31+g(d).gjf (generated)

045103388.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103388.mol 045103388.PUBCHEM 045103388.mol (via Jmol)
045103389.b3lyp_6-31g(d).inp

045103389.b3lyp_6-31g(d).qchem.inp (generated)

045103389.b3lyp_6-31g(d).gjf (generated)

045103389.b3lyp_6-31g(d).firefly.inp (generated)

045103389.b3lyp_6-31g(d).smash.inp (generated)

045103389.b3lyp_6-31g(d).nwchem.inp (generated) 045103389.b3lyp_6-31g(d).log.xz 045103389.td-b3lyp_6-31g+(d).inp 045103389.td-b3lyp_6-31g+(d).log.xz

045103389.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103389.td-b3lyp_6-31+g(d).gjf (generated)

045103389.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103389.mol 045103389.PUBCHEM 045103389.mol (via Jmol)
045103404.b3lyp_6-31g(d).inp

045103404.b3lyp_6-31g(d).qchem.inp (generated)

045103404.b3lyp_6-31g(d).gjf (generated)

045103404.b3lyp_6-31g(d).firefly.inp (generated)

045103404.b3lyp_6-31g(d).smash.inp (generated)

045103404.b3lyp_6-31g(d).nwchem.inp (generated) 045103404.b3lyp_6-31g(d).log.xz 045103404.mol 045103404.PUBCHEM 045103404.mol (via Jmol)
045103409.b3lyp_6-31g(d).inp

045103409.b3lyp_6-31g(d).qchem.inp (generated)

045103409.b3lyp_6-31g(d).gjf (generated)

045103409.b3lyp_6-31g(d).firefly.inp (generated)

045103409.b3lyp_6-31g(d).smash.inp (generated)

045103409.b3lyp_6-31g(d).nwchem.inp (generated) 045103409.b3lyp_6-31g(d).log.xz 045103409.td-b3lyp_6-31g+(d).inp 045103409.td-b3lyp_6-31g+(d).log.xz

045103409.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103409.td-b3lyp_6-31+g(d).gjf (generated)

045103409.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103409.mol 045103409.PUBCHEM 045103409.mol (via Jmol)
045103413.b3lyp_6-31g(d).inp

045103413.b3lyp_6-31g(d).qchem.inp (generated)

045103413.b3lyp_6-31g(d).gjf (generated)

045103413.b3lyp_6-31g(d).firefly.inp (generated)

045103413.b3lyp_6-31g(d).smash.inp (generated)

045103413.b3lyp_6-31g(d).nwchem.inp (generated) 045103413.b3lyp_6-31g(d).log.xz 045103413.td-b3lyp_6-31g+(d).inp 045103413.td-b3lyp_6-31g+(d).log.xz

045103413.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103413.td-b3lyp_6-31+g(d).gjf (generated)

045103413.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103413.mol 045103413.PUBCHEM 045103413.mol (via Jmol)
045103416.b3lyp_6-31g(d).inp

045103416.b3lyp_6-31g(d).qchem.inp (generated)

045103416.b3lyp_6-31g(d).gjf (generated)

045103416.b3lyp_6-31g(d).firefly.inp (generated)

045103416.b3lyp_6-31g(d).smash.inp (generated)

045103416.b3lyp_6-31g(d).nwchem.inp (generated) 045103416.b3lyp_6-31g(d).log.xz 045103416.td-b3lyp_6-31g+(d).inp 045103416.td-b3lyp_6-31g+(d).log.xz

045103416.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103416.td-b3lyp_6-31+g(d).gjf (generated)

045103416.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103416.mol 045103416.PUBCHEM 045103416.mol (via Jmol)
045103417.b3lyp_6-31g(d).inp

045103417.b3lyp_6-31g(d).qchem.inp (generated)

045103417.b3lyp_6-31g(d).gjf (generated)

045103417.b3lyp_6-31g(d).firefly.inp (generated)

045103417.b3lyp_6-31g(d).smash.inp (generated)

045103417.b3lyp_6-31g(d).nwchem.inp (generated) 045103417.b3lyp_6-31g(d).log.xz 045103417.td-b3lyp_6-31g+(d).inp 045103417.td-b3lyp_6-31g+(d).log.xz

045103417.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103417.td-b3lyp_6-31+g(d).gjf (generated)

045103417.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103417.mol 045103417.PUBCHEM 045103417.mol (via Jmol)
045103424.b3lyp_6-31g(d).inp

045103424.b3lyp_6-31g(d).qchem.inp (generated)

045103424.b3lyp_6-31g(d).gjf (generated)

045103424.b3lyp_6-31g(d).firefly.inp (generated)

045103424.b3lyp_6-31g(d).smash.inp (generated)

045103424.b3lyp_6-31g(d).nwchem.inp (generated) 045103424.b3lyp_6-31g(d).log.xz 045103424.td-b3lyp_6-31g+(d).inp 045103424.td-b3lyp_6-31g+(d).log.xz

045103424.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103424.td-b3lyp_6-31+g(d).gjf (generated)

045103424.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103424.mol 045103424.PUBCHEM 045103424.mol (via Jmol)
045103425.b3lyp_6-31g(d).inp

045103425.b3lyp_6-31g(d).qchem.inp (generated)

045103425.b3lyp_6-31g(d).gjf (generated)

045103425.b3lyp_6-31g(d).firefly.inp (generated)

045103425.b3lyp_6-31g(d).smash.inp (generated)

045103425.b3lyp_6-31g(d).nwchem.inp (generated) 045103425.b3lyp_6-31g(d).log.xz 045103425.td-b3lyp_6-31g+(d).inp 045103425.td-b3lyp_6-31g+(d).log.xz

045103425.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103425.td-b3lyp_6-31+g(d).gjf (generated)

045103425.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103425.mol 045103425.PUBCHEM 045103425.mol (via Jmol)
045103426.b3lyp_6-31g(d).inp

045103426.b3lyp_6-31g(d).qchem.inp (generated)

045103426.b3lyp_6-31g(d).gjf (generated)

045103426.b3lyp_6-31g(d).firefly.inp (generated)

045103426.b3lyp_6-31g(d).smash.inp (generated)

045103426.b3lyp_6-31g(d).nwchem.inp (generated) 045103426.b3lyp_6-31g(d).log.xz 045103426.td-b3lyp_6-31g+(d).inp 045103426.td-b3lyp_6-31g+(d).log.xz

045103426.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103426.td-b3lyp_6-31+g(d).gjf (generated)

045103426.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103426.mol 045103426.PUBCHEM 045103426.mol (via Jmol)
045103427.b3lyp_6-31g(d).inp

045103427.b3lyp_6-31g(d).qchem.inp (generated)

045103427.b3lyp_6-31g(d).gjf (generated)

045103427.b3lyp_6-31g(d).firefly.inp (generated)

045103427.b3lyp_6-31g(d).smash.inp (generated)

045103427.b3lyp_6-31g(d).nwchem.inp (generated) 045103427.b3lyp_6-31g(d).log.xz 045103427.td-b3lyp_6-31g+(d).inp 045103427.td-b3lyp_6-31g+(d).log.xz

045103427.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103427.td-b3lyp_6-31+g(d).gjf (generated)

045103427.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103427.mol 045103427.PUBCHEM 045103427.mol (via Jmol)
045103428.b3lyp_6-31g(d).inp

045103428.b3lyp_6-31g(d).qchem.inp (generated)

045103428.b3lyp_6-31g(d).gjf (generated)

045103428.b3lyp_6-31g(d).firefly.inp (generated)

045103428.b3lyp_6-31g(d).smash.inp (generated)

045103428.b3lyp_6-31g(d).nwchem.inp (generated) 045103428.b3lyp_6-31g(d).log.xz 045103428.td-b3lyp_6-31g+(d).inp 045103428.td-b3lyp_6-31g+(d).log.xz

045103428.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103428.td-b3lyp_6-31+g(d).gjf (generated)

045103428.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103428.mol 045103428.PUBCHEM 045103428.mol (via Jmol)
045103434.b3lyp_6-31g(d).inp

045103434.b3lyp_6-31g(d).qchem.inp (generated)

045103434.b3lyp_6-31g(d).gjf (generated)

045103434.b3lyp_6-31g(d).firefly.inp (generated)

045103434.b3lyp_6-31g(d).smash.inp (generated)

045103434.b3lyp_6-31g(d).nwchem.inp (generated) 045103434.b3lyp_6-31g(d).log.xz 045103434.td-b3lyp_6-31g+(d).inp 045103434.td-b3lyp_6-31g+(d).log.xz

045103434.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103434.td-b3lyp_6-31+g(d).gjf (generated)

045103434.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103434.mol 045103434.PUBCHEM 045103434.mol (via Jmol)
045103436.b3lyp_6-31g(d).inp

045103436.b3lyp_6-31g(d).qchem.inp (generated)

045103436.b3lyp_6-31g(d).gjf (generated)

045103436.b3lyp_6-31g(d).firefly.inp (generated)

045103436.b3lyp_6-31g(d).smash.inp (generated)

045103436.b3lyp_6-31g(d).nwchem.inp (generated) 045103436.b3lyp_6-31g(d).log.xz 045103436.td-b3lyp_6-31g+(d).inp 045103436.td-b3lyp_6-31g+(d).log.xz

045103436.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103436.td-b3lyp_6-31+g(d).gjf (generated)

045103436.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103436.mol 045103436.PUBCHEM 045103436.mol (via Jmol)
045103456.b3lyp_6-31g(d).inp

045103456.b3lyp_6-31g(d).qchem.inp (generated)

045103456.b3lyp_6-31g(d).gjf (generated)

045103456.b3lyp_6-31g(d).firefly.inp (generated)

045103456.b3lyp_6-31g(d).smash.inp (generated)

045103456.b3lyp_6-31g(d).nwchem.inp (generated) 045103456.b3lyp_6-31g(d).log.xz 045103456.td-b3lyp_6-31g+(d).inp 045103456.td-b3lyp_6-31g+(d).log.xz

045103456.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103456.td-b3lyp_6-31+g(d).gjf (generated)

045103456.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103456.mol 045103456.PUBCHEM 045103456.mol (via Jmol)
045103457.b3lyp_6-31g(d).inp

045103457.b3lyp_6-31g(d).qchem.inp (generated)

045103457.b3lyp_6-31g(d).gjf (generated)

045103457.b3lyp_6-31g(d).firefly.inp (generated)

045103457.b3lyp_6-31g(d).smash.inp (generated)

045103457.b3lyp_6-31g(d).nwchem.inp (generated) 045103457.b3lyp_6-31g(d).log.xz 045103457.td-b3lyp_6-31g+(d).inp 045103457.td-b3lyp_6-31g+(d).log.xz

045103457.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103457.td-b3lyp_6-31+g(d).gjf (generated)

045103457.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103457.mol 045103457.PUBCHEM 045103457.mol (via Jmol)
045103460.b3lyp_6-31g(d).inp

045103460.b3lyp_6-31g(d).qchem.inp (generated)

045103460.b3lyp_6-31g(d).gjf (generated)

045103460.b3lyp_6-31g(d).firefly.inp (generated)

045103460.b3lyp_6-31g(d).smash.inp (generated)

045103460.b3lyp_6-31g(d).nwchem.inp (generated) 045103460.b3lyp_6-31g(d).log.xz 045103460.td-b3lyp_6-31g+(d).inp 045103460.td-b3lyp_6-31g+(d).log.xz

045103460.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103460.td-b3lyp_6-31+g(d).gjf (generated)

045103460.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103460.mol 045103460.PUBCHEM 045103460.mol (via Jmol)
045103557.b3lyp_6-31g(d).inp

045103557.b3lyp_6-31g(d).qchem.inp (generated)

045103557.b3lyp_6-31g(d).gjf (generated)

045103557.b3lyp_6-31g(d).firefly.inp (generated)

045103557.b3lyp_6-31g(d).smash.inp (generated)

045103557.b3lyp_6-31g(d).nwchem.inp (generated) 045103557.b3lyp_6-31g(d).log.xz 045103557.td-b3lyp_6-31g+(d).inp 045103557.td-b3lyp_6-31g+(d).log.xz

045103557.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103557.td-b3lyp_6-31+g(d).gjf (generated)

045103557.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103557.mol 045103557.PUBCHEM 045103557.mol (via Jmol)
045103558.b3lyp_6-31g(d).inp

045103558.b3lyp_6-31g(d).qchem.inp (generated)

045103558.b3lyp_6-31g(d).gjf (generated)

045103558.b3lyp_6-31g(d).firefly.inp (generated)

045103558.b3lyp_6-31g(d).smash.inp (generated)

045103558.b3lyp_6-31g(d).nwchem.inp (generated) 045103558.b3lyp_6-31g(d).log.xz 045103558.td-b3lyp_6-31g+(d).inp 045103558.td-b3lyp_6-31g+(d).log.xz

045103558.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103558.td-b3lyp_6-31+g(d).gjf (generated)

045103558.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103558.mol 045103558.PUBCHEM 045103558.mol (via Jmol)
045103559.b3lyp_6-31g(d).inp

045103559.b3lyp_6-31g(d).qchem.inp (generated)

045103559.b3lyp_6-31g(d).gjf (generated)

045103559.b3lyp_6-31g(d).firefly.inp (generated)

045103559.b3lyp_6-31g(d).smash.inp (generated)

045103559.b3lyp_6-31g(d).nwchem.inp (generated) 045103559.b3lyp_6-31g(d).log.xz 045103559.td-b3lyp_6-31g+(d).inp 045103559.td-b3lyp_6-31g+(d).log.xz

045103559.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103559.td-b3lyp_6-31+g(d).gjf (generated)

045103559.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103559.mol 045103559.PUBCHEM 045103559.mol (via Jmol)
045103576.b3lyp_6-31g(d).inp

045103576.b3lyp_6-31g(d).qchem.inp (generated)

045103576.b3lyp_6-31g(d).gjf (generated)

045103576.b3lyp_6-31g(d).firefly.inp (generated)

045103576.b3lyp_6-31g(d).smash.inp (generated)

045103576.b3lyp_6-31g(d).nwchem.inp (generated) 045103576.b3lyp_6-31g(d).log.xz 045103576.td-b3lyp_6-31g+(d).inp 045103576.td-b3lyp_6-31g+(d).log.xz

045103576.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103576.td-b3lyp_6-31+g(d).gjf (generated)

045103576.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103576.mol 045103576.PUBCHEM 045103576.mol (via Jmol)
045103578.b3lyp_6-31g(d).inp

045103578.b3lyp_6-31g(d).qchem.inp (generated)

045103578.b3lyp_6-31g(d).gjf (generated)

045103578.b3lyp_6-31g(d).firefly.inp (generated)

045103578.b3lyp_6-31g(d).smash.inp (generated)

045103578.b3lyp_6-31g(d).nwchem.inp (generated) 045103578.b3lyp_6-31g(d).log.xz 045103578.td-b3lyp_6-31g+(d).inp 045103578.td-b3lyp_6-31g+(d).log.xz

045103578.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103578.td-b3lyp_6-31+g(d).gjf (generated)

045103578.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103578.mol 045103578.PUBCHEM 045103578.mol (via Jmol)
045103805.b3lyp_6-31g(d).inp

045103805.b3lyp_6-31g(d).qchem.inp (generated)

045103805.b3lyp_6-31g(d).gjf (generated)

045103805.b3lyp_6-31g(d).firefly.inp (generated)

045103805.b3lyp_6-31g(d).smash.inp (generated)

045103805.b3lyp_6-31g(d).nwchem.inp (generated) 045103805.b3lyp_6-31g(d).log.xz 045103805.td-b3lyp_6-31g+(d).inp 045103805.td-b3lyp_6-31g+(d).log.xz

045103805.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103805.td-b3lyp_6-31+g(d).gjf (generated)

045103805.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103805.mol 045103805.PUBCHEM 045103805.mol (via Jmol)
045103845.b3lyp_6-31g(d).inp

045103845.b3lyp_6-31g(d).qchem.inp (generated)

045103845.b3lyp_6-31g(d).gjf (generated)

045103845.b3lyp_6-31g(d).firefly.inp (generated)

045103845.b3lyp_6-31g(d).smash.inp (generated)

045103845.b3lyp_6-31g(d).nwchem.inp (generated) 045103845.b3lyp_6-31g(d).log.xz 045103845.td-b3lyp_6-31g+(d).inp 045103845.td-b3lyp_6-31g+(d).log.xz

045103845.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103845.td-b3lyp_6-31+g(d).gjf (generated)

045103845.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103845.mol 045103845.PUBCHEM 045103845.mol (via Jmol)
045103884.b3lyp_6-31g(d).inp

045103884.b3lyp_6-31g(d).qchem.inp (generated)

045103884.b3lyp_6-31g(d).gjf (generated)

045103884.b3lyp_6-31g(d).firefly.inp (generated)

045103884.b3lyp_6-31g(d).smash.inp (generated)

045103884.b3lyp_6-31g(d).nwchem.inp (generated) 045103884.b3lyp_6-31g(d).log.xz 045103884.td-b3lyp_6-31g+(d).inp 045103884.td-b3lyp_6-31g+(d).log.xz

045103884.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103884.td-b3lyp_6-31+g(d).gjf (generated)

045103884.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103884.mol 045103884.PUBCHEM 045103884.mol (via Jmol)
045103885.b3lyp_6-31g(d).inp

045103885.b3lyp_6-31g(d).qchem.inp (generated)

045103885.b3lyp_6-31g(d).gjf (generated)

045103885.b3lyp_6-31g(d).firefly.inp (generated)

045103885.b3lyp_6-31g(d).smash.inp (generated)

045103885.b3lyp_6-31g(d).nwchem.inp (generated) 045103885.b3lyp_6-31g(d).log.xz 045103885.td-b3lyp_6-31g+(d).inp 045103885.td-b3lyp_6-31g+(d).log.xz

045103885.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103885.td-b3lyp_6-31+g(d).gjf (generated)

045103885.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103885.mol 045103885.PUBCHEM 045103885.mol (via Jmol)
045103886.b3lyp_6-31g(d).inp

045103886.b3lyp_6-31g(d).qchem.inp (generated)

045103886.b3lyp_6-31g(d).gjf (generated)

045103886.b3lyp_6-31g(d).firefly.inp (generated)

045103886.b3lyp_6-31g(d).smash.inp (generated)

045103886.b3lyp_6-31g(d).nwchem.inp (generated) 045103886.b3lyp_6-31g(d).log.xz 045103886.td-b3lyp_6-31g+(d).inp 045103886.td-b3lyp_6-31g+(d).log.xz

045103886.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103886.td-b3lyp_6-31+g(d).gjf (generated)

045103886.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103886.mol 045103886.PUBCHEM 045103886.mol (via Jmol)
045103887.b3lyp_6-31g(d).inp

045103887.b3lyp_6-31g(d).qchem.inp (generated)

045103887.b3lyp_6-31g(d).gjf (generated)

045103887.b3lyp_6-31g(d).firefly.inp (generated)

045103887.b3lyp_6-31g(d).smash.inp (generated)

045103887.b3lyp_6-31g(d).nwchem.inp (generated) 045103887.b3lyp_6-31g(d).log.xz 045103887.td-b3lyp_6-31g+(d).inp 045103887.td-b3lyp_6-31g+(d).log.xz

045103887.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103887.td-b3lyp_6-31+g(d).gjf (generated)

045103887.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103887.mol 045103887.PUBCHEM 045103887.mol (via Jmol)
045103888.b3lyp_6-31g(d).inp

045103888.b3lyp_6-31g(d).qchem.inp (generated)

045103888.b3lyp_6-31g(d).gjf (generated)

045103888.b3lyp_6-31g(d).firefly.inp (generated)

045103888.b3lyp_6-31g(d).smash.inp (generated)

045103888.b3lyp_6-31g(d).nwchem.inp (generated) 045103888.b3lyp_6-31g(d).log.xz 045103888.td-b3lyp_6-31g+(d).inp 045103888.td-b3lyp_6-31g+(d).log.xz

045103888.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103888.td-b3lyp_6-31+g(d).gjf (generated)

045103888.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103888.mol 045103888.PUBCHEM 045103888.mol (via Jmol)
045103894.b3lyp_6-31g(d).inp

045103894.b3lyp_6-31g(d).qchem.inp (generated)

045103894.b3lyp_6-31g(d).gjf (generated)

045103894.b3lyp_6-31g(d).firefly.inp (generated)

045103894.b3lyp_6-31g(d).smash.inp (generated)

045103894.b3lyp_6-31g(d).nwchem.inp (generated) 045103894.b3lyp_6-31g(d).log.xz 045103894.td-b3lyp_6-31g+(d).inp 045103894.td-b3lyp_6-31g+(d).log.xz

045103894.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103894.td-b3lyp_6-31+g(d).gjf (generated)

045103894.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103894.mol 045103894.PUBCHEM 045103894.mol (via Jmol)
045103948.b3lyp_6-31g(d).inp

045103948.b3lyp_6-31g(d).qchem.inp (generated)

045103948.b3lyp_6-31g(d).gjf (generated)

045103948.b3lyp_6-31g(d).firefly.inp (generated)

045103948.b3lyp_6-31g(d).smash.inp (generated)

045103948.b3lyp_6-31g(d).nwchem.inp (generated) 045103948.b3lyp_6-31g(d).log.xz 045103948.td-b3lyp_6-31g+(d).inp 045103948.td-b3lyp_6-31g+(d).log.xz

045103948.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103948.td-b3lyp_6-31+g(d).gjf (generated)

045103948.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103948.mol 045103948.PUBCHEM 045103948.mol (via Jmol)
045103949.b3lyp_6-31g(d).inp

045103949.b3lyp_6-31g(d).qchem.inp (generated)

045103949.b3lyp_6-31g(d).gjf (generated)

045103949.b3lyp_6-31g(d).firefly.inp (generated)

045103949.b3lyp_6-31g(d).smash.inp (generated)

045103949.b3lyp_6-31g(d).nwchem.inp (generated) 045103949.b3lyp_6-31g(d).log.xz 045103949.td-b3lyp_6-31g+(d).inp 045103949.td-b3lyp_6-31g+(d).log.xz

045103949.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103949.td-b3lyp_6-31+g(d).gjf (generated)

045103949.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103949.mol 045103949.PUBCHEM 045103949.mol (via Jmol)
045103996.b3lyp_6-31g(d).inp

045103996.b3lyp_6-31g(d).qchem.inp (generated)

045103996.b3lyp_6-31g(d).gjf (generated)

045103996.b3lyp_6-31g(d).firefly.inp (generated)

045103996.b3lyp_6-31g(d).smash.inp (generated)

045103996.b3lyp_6-31g(d).nwchem.inp (generated) 045103996.b3lyp_6-31g(d).log.xz 045103996.td-b3lyp_6-31g+(d).inp 045103996.td-b3lyp_6-31g+(d).log.xz

045103996.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103996.td-b3lyp_6-31+g(d).gjf (generated)

045103996.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103996.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103996.mol 045103996.PUBCHEM 045103996.mol (via Jmol)
045103999.b3lyp_6-31g(d).inp

045103999.b3lyp_6-31g(d).qchem.inp (generated)

045103999.b3lyp_6-31g(d).gjf (generated)

045103999.b3lyp_6-31g(d).firefly.inp (generated)

045103999.b3lyp_6-31g(d).smash.inp (generated)

045103999.b3lyp_6-31g(d).nwchem.inp (generated) 045103999.b3lyp_6-31g(d).log.xz 045103999.td-b3lyp_6-31g+(d).inp 045103999.td-b3lyp_6-31g+(d).log.xz

045103999.td-b3lyp_6-31+g(d).qchem.inp (generated)

045103999.td-b3lyp_6-31+g(d).gjf (generated)

045103999.td-b3lyp_6-31+g(d).firefly.inp (generated)

045103999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045103999.mol 045103999.PUBCHEM 045103999.mol (via Jmol)
045104071.b3lyp_6-31g(d).inp

045104071.b3lyp_6-31g(d).qchem.inp (generated)

045104071.b3lyp_6-31g(d).gjf (generated)

045104071.b3lyp_6-31g(d).firefly.inp (generated)

045104071.b3lyp_6-31g(d).smash.inp (generated)

045104071.b3lyp_6-31g(d).nwchem.inp (generated) 045104071.b3lyp_6-31g(d).log.xz 045104071.td-b3lyp_6-31g+(d).inp 045104071.td-b3lyp_6-31g+(d).log.xz

045104071.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104071.td-b3lyp_6-31+g(d).gjf (generated)

045104071.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104071.mol 045104071.PUBCHEM 045104071.mol (via Jmol)
045104074.b3lyp_6-31g(d).inp

045104074.b3lyp_6-31g(d).qchem.inp (generated)

045104074.b3lyp_6-31g(d).gjf (generated)

045104074.b3lyp_6-31g(d).firefly.inp (generated)

045104074.b3lyp_6-31g(d).smash.inp (generated)

045104074.b3lyp_6-31g(d).nwchem.inp (generated) 045104074.b3lyp_6-31g(d).log.xz 045104074.td-b3lyp_6-31g+(d).inp 045104074.td-b3lyp_6-31g+(d).log.xz

045104074.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104074.td-b3lyp_6-31+g(d).gjf (generated)

045104074.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104074.mol 045104074.PUBCHEM 045104074.mol (via Jmol)
045104112.b3lyp_6-31g(d).inp

045104112.b3lyp_6-31g(d).qchem.inp (generated)

045104112.b3lyp_6-31g(d).gjf (generated)

045104112.b3lyp_6-31g(d).firefly.inp (generated)

045104112.b3lyp_6-31g(d).smash.inp (generated)

045104112.b3lyp_6-31g(d).nwchem.inp (generated) 045104112.b3lyp_6-31g(d).log.xz 045104112.td-b3lyp_6-31g+(d).inp 045104112.td-b3lyp_6-31g+(d).log.xz

045104112.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104112.td-b3lyp_6-31+g(d).gjf (generated)

045104112.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104112.mol 045104112.PUBCHEM 045104112.mol (via Jmol)
045104113.b3lyp_6-31g(d).inp

045104113.b3lyp_6-31g(d).qchem.inp (generated)

045104113.b3lyp_6-31g(d).gjf (generated)

045104113.b3lyp_6-31g(d).firefly.inp (generated)

045104113.b3lyp_6-31g(d).smash.inp (generated)

045104113.b3lyp_6-31g(d).nwchem.inp (generated) 045104113.b3lyp_6-31g(d).log.xz 045104113.mol 045104113.PUBCHEM 045104113.mol (via Jmol)
045104115.b3lyp_6-31g(d).inp

045104115.b3lyp_6-31g(d).qchem.inp (generated)

045104115.b3lyp_6-31g(d).gjf (generated)

045104115.b3lyp_6-31g(d).firefly.inp (generated)

045104115.b3lyp_6-31g(d).smash.inp (generated)

045104115.b3lyp_6-31g(d).nwchem.inp (generated) 045104115.b3lyp_6-31g(d).log.xz 045104115.td-b3lyp_6-31g+(d).inp 045104115.td-b3lyp_6-31g+(d).log.xz

045104115.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104115.td-b3lyp_6-31+g(d).gjf (generated)

045104115.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104115.mol 045104115.PUBCHEM 045104115.mol (via Jmol)
045104139.b3lyp_6-31g(d).inp

045104139.b3lyp_6-31g(d).qchem.inp (generated)

045104139.b3lyp_6-31g(d).gjf (generated)

045104139.b3lyp_6-31g(d).firefly.inp (generated)

045104139.b3lyp_6-31g(d).smash.inp (generated)

045104139.b3lyp_6-31g(d).nwchem.inp (generated) 045104139.b3lyp_6-31g(d).log.xz 045104139.td-b3lyp_6-31g+(d).inp 045104139.td-b3lyp_6-31g+(d).log.xz

045104139.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104139.td-b3lyp_6-31+g(d).gjf (generated)

045104139.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104139.mol 045104139.PUBCHEM 045104139.mol (via Jmol)
045104174.b3lyp_6-31g(d).inp

045104174.b3lyp_6-31g(d).qchem.inp (generated)

045104174.b3lyp_6-31g(d).gjf (generated)

045104174.b3lyp_6-31g(d).firefly.inp (generated)

045104174.b3lyp_6-31g(d).smash.inp (generated)

045104174.b3lyp_6-31g(d).nwchem.inp (generated) 045104174.b3lyp_6-31g(d).log.xz 045104174.td-b3lyp_6-31g+(d).inp 045104174.td-b3lyp_6-31g+(d).log.xz

045104174.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104174.td-b3lyp_6-31+g(d).gjf (generated)

045104174.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104174.mol 045104174.PUBCHEM 045104174.mol (via Jmol)
045104219.b3lyp_6-31g(d).inp

045104219.b3lyp_6-31g(d).qchem.inp (generated)

045104219.b3lyp_6-31g(d).gjf (generated)

045104219.b3lyp_6-31g(d).firefly.inp (generated)

045104219.b3lyp_6-31g(d).smash.inp (generated)

045104219.b3lyp_6-31g(d).nwchem.inp (generated) 045104219.b3lyp_6-31g(d).log.xz 045104219.td-b3lyp_6-31g+(d).inp 045104219.td-b3lyp_6-31g+(d).log.xz

045104219.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104219.td-b3lyp_6-31+g(d).gjf (generated)

045104219.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104219.mol 045104219.PUBCHEM 045104219.mol (via Jmol)
045104233.b3lyp_6-31g(d).inp

045104233.b3lyp_6-31g(d).qchem.inp (generated)

045104233.b3lyp_6-31g(d).gjf (generated)

045104233.b3lyp_6-31g(d).firefly.inp (generated)

045104233.b3lyp_6-31g(d).smash.inp (generated)

045104233.b3lyp_6-31g(d).nwchem.inp (generated) 045104233.b3lyp_6-31g(d).log.xz 045104233.td-b3lyp_6-31g+(d).inp 045104233.td-b3lyp_6-31g+(d).log.xz

045104233.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104233.td-b3lyp_6-31+g(d).gjf (generated)

045104233.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104233.mol 045104233.PUBCHEM 045104233.mol (via Jmol)
045104239.b3lyp_6-31g(d).inp

045104239.b3lyp_6-31g(d).qchem.inp (generated)

045104239.b3lyp_6-31g(d).gjf (generated)

045104239.b3lyp_6-31g(d).firefly.inp (generated)

045104239.b3lyp_6-31g(d).smash.inp (generated)

045104239.b3lyp_6-31g(d).nwchem.inp (generated) 045104239.b3lyp_6-31g(d).log.xz 045104239.td-b3lyp_6-31g+(d).inp 045104239.td-b3lyp_6-31g+(d).log.xz

045104239.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104239.td-b3lyp_6-31+g(d).gjf (generated)

045104239.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104239.mol 045104239.PUBCHEM 045104239.mol (via Jmol)
045104255.b3lyp_6-31g(d).inp

045104255.b3lyp_6-31g(d).qchem.inp (generated)

045104255.b3lyp_6-31g(d).gjf (generated)

045104255.b3lyp_6-31g(d).firefly.inp (generated)

045104255.b3lyp_6-31g(d).smash.inp (generated)

045104255.b3lyp_6-31g(d).nwchem.inp (generated) 045104255.b3lyp_6-31g(d).log.xz 045104255.td-b3lyp_6-31g+(d).inp 045104255.td-b3lyp_6-31g+(d).log.xz

045104255.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104255.td-b3lyp_6-31+g(d).gjf (generated)

045104255.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104255.mol 045104255.PUBCHEM 045104255.mol (via Jmol)
045104257.b3lyp_6-31g(d).inp

045104257.b3lyp_6-31g(d).qchem.inp (generated)

045104257.b3lyp_6-31g(d).gjf (generated)

045104257.b3lyp_6-31g(d).firefly.inp (generated)

045104257.b3lyp_6-31g(d).smash.inp (generated)

045104257.b3lyp_6-31g(d).nwchem.inp (generated) 045104257.b3lyp_6-31g(d).log.xz 045104257.td-b3lyp_6-31g+(d).inp 045104257.td-b3lyp_6-31g+(d).log.xz

045104257.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104257.td-b3lyp_6-31+g(d).gjf (generated)

045104257.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104257.mol 045104257.PUBCHEM 045104257.mol (via Jmol)
045104276.b3lyp_6-31g(d).inp

045104276.b3lyp_6-31g(d).qchem.inp (generated)

045104276.b3lyp_6-31g(d).gjf (generated)

045104276.b3lyp_6-31g(d).firefly.inp (generated)

045104276.b3lyp_6-31g(d).smash.inp (generated)

045104276.b3lyp_6-31g(d).nwchem.inp (generated) 045104276.b3lyp_6-31g(d).log.xz 045104276.td-b3lyp_6-31g+(d).inp 045104276.td-b3lyp_6-31g+(d).log.xz

045104276.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104276.td-b3lyp_6-31+g(d).gjf (generated)

045104276.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104276.mol 045104276.PUBCHEM 045104276.mol (via Jmol)
045104337.b3lyp_6-31g(d).inp

045104337.b3lyp_6-31g(d).qchem.inp (generated)

045104337.b3lyp_6-31g(d).gjf (generated)

045104337.b3lyp_6-31g(d).firefly.inp (generated)

045104337.b3lyp_6-31g(d).smash.inp (generated)

045104337.b3lyp_6-31g(d).nwchem.inp (generated) 045104337.b3lyp_6-31g(d).log.xz 045104337.td-b3lyp_6-31g+(d).inp 045104337.td-b3lyp_6-31g+(d).log.xz

045104337.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104337.td-b3lyp_6-31+g(d).gjf (generated)

045104337.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104337.mol 045104337.PUBCHEM 045104337.mol (via Jmol)
045104352.b3lyp_6-31g(d).inp

045104352.b3lyp_6-31g(d).qchem.inp (generated)

045104352.b3lyp_6-31g(d).gjf (generated)

045104352.b3lyp_6-31g(d).firefly.inp (generated)

045104352.b3lyp_6-31g(d).smash.inp (generated)

045104352.b3lyp_6-31g(d).nwchem.inp (generated) 045104352.b3lyp_6-31g(d).log.xz 045104352.td-b3lyp_6-31g+(d).inp 045104352.td-b3lyp_6-31g+(d).log.xz

045104352.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104352.td-b3lyp_6-31+g(d).gjf (generated)

045104352.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104352.mol 045104352.PUBCHEM 045104352.mol (via Jmol)
045104354.b3lyp_6-31g(d).inp

045104354.b3lyp_6-31g(d).qchem.inp (generated)

045104354.b3lyp_6-31g(d).gjf (generated)

045104354.b3lyp_6-31g(d).firefly.inp (generated)

045104354.b3lyp_6-31g(d).smash.inp (generated)

045104354.b3lyp_6-31g(d).nwchem.inp (generated) 045104354.b3lyp_6-31g(d).log.xz 045104354.td-b3lyp_6-31g+(d).inp 045104354.td-b3lyp_6-31g+(d).log.xz

045104354.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104354.td-b3lyp_6-31+g(d).gjf (generated)

045104354.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104354.mol 045104354.PUBCHEM 045104354.mol (via Jmol)
045104371.b3lyp_6-31g(d).inp

045104371.b3lyp_6-31g(d).qchem.inp (generated)

045104371.b3lyp_6-31g(d).gjf (generated)

045104371.b3lyp_6-31g(d).firefly.inp (generated)

045104371.b3lyp_6-31g(d).smash.inp (generated)

045104371.b3lyp_6-31g(d).nwchem.inp (generated) 045104371.b3lyp_6-31g(d).log.xz 045104371.mol 045104371.PUBCHEM 045104371.mol (via Jmol)
045104372.b3lyp_6-31g(d).inp

045104372.b3lyp_6-31g(d).qchem.inp (generated)

045104372.b3lyp_6-31g(d).gjf (generated)

045104372.b3lyp_6-31g(d).firefly.inp (generated)

045104372.b3lyp_6-31g(d).smash.inp (generated)

045104372.b3lyp_6-31g(d).nwchem.inp (generated) 045104372.b3lyp_6-31g(d).log.xz 045104372.td-b3lyp_6-31g+(d).inp 045104372.td-b3lyp_6-31g+(d).log.xz

045104372.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104372.td-b3lyp_6-31+g(d).gjf (generated)

045104372.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104372.mol 045104372.PUBCHEM 045104372.mol (via Jmol)
045104454.b3lyp_6-31g(d).inp

045104454.b3lyp_6-31g(d).qchem.inp (generated)

045104454.b3lyp_6-31g(d).gjf (generated)

045104454.b3lyp_6-31g(d).firefly.inp (generated)

045104454.b3lyp_6-31g(d).smash.inp (generated)

045104454.b3lyp_6-31g(d).nwchem.inp (generated) 045104454.b3lyp_6-31g(d).log.xz 045104454.td-b3lyp_6-31g+(d).inp 045104454.td-b3lyp_6-31g+(d).log.xz

045104454.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104454.td-b3lyp_6-31+g(d).gjf (generated)

045104454.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104454.mol 045104454.PUBCHEM 045104454.mol (via Jmol)
045104455.b3lyp_6-31g(d).inp

045104455.b3lyp_6-31g(d).qchem.inp (generated)

045104455.b3lyp_6-31g(d).gjf (generated)

045104455.b3lyp_6-31g(d).firefly.inp (generated)

045104455.b3lyp_6-31g(d).smash.inp (generated)

045104455.b3lyp_6-31g(d).nwchem.inp (generated) 045104455.b3lyp_6-31g(d).log.xz 045104455.td-b3lyp_6-31g+(d).inp 045104455.td-b3lyp_6-31g+(d).log.xz

045104455.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104455.td-b3lyp_6-31+g(d).gjf (generated)

045104455.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104455.mol 045104455.PUBCHEM 045104455.mol (via Jmol)
045104456.b3lyp_6-31g(d).inp

045104456.b3lyp_6-31g(d).qchem.inp (generated)

045104456.b3lyp_6-31g(d).gjf (generated)

045104456.b3lyp_6-31g(d).firefly.inp (generated)

045104456.b3lyp_6-31g(d).smash.inp (generated)

045104456.b3lyp_6-31g(d).nwchem.inp (generated) 045104456.b3lyp_6-31g(d).log.xz 045104456.td-b3lyp_6-31g+(d).inp 045104456.td-b3lyp_6-31g+(d).log.xz

045104456.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104456.td-b3lyp_6-31+g(d).gjf (generated)

045104456.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104456.mol 045104456.PUBCHEM 045104456.mol (via Jmol)
045104457.b3lyp_6-31g(d).inp

045104457.b3lyp_6-31g(d).qchem.inp (generated)

045104457.b3lyp_6-31g(d).gjf (generated)

045104457.b3lyp_6-31g(d).firefly.inp (generated)

045104457.b3lyp_6-31g(d).smash.inp (generated)

045104457.b3lyp_6-31g(d).nwchem.inp (generated) 045104457.b3lyp_6-31g(d).log.xz 045104457.td-b3lyp_6-31g+(d).inp 045104457.td-b3lyp_6-31g+(d).log.xz

045104457.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104457.td-b3lyp_6-31+g(d).gjf (generated)

045104457.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104457.mol 045104457.PUBCHEM 045104457.mol (via Jmol)
045104458.b3lyp_6-31g(d).inp

045104458.b3lyp_6-31g(d).qchem.inp (generated)

045104458.b3lyp_6-31g(d).gjf (generated)

045104458.b3lyp_6-31g(d).firefly.inp (generated)

045104458.b3lyp_6-31g(d).smash.inp (generated)

045104458.b3lyp_6-31g(d).nwchem.inp (generated) 045104458.b3lyp_6-31g(d).log.xz 045104458.td-b3lyp_6-31g+(d).inp 045104458.td-b3lyp_6-31g+(d).log.xz

045104458.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104458.td-b3lyp_6-31+g(d).gjf (generated)

045104458.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104458.mol 045104458.PUBCHEM 045104458.mol (via Jmol)
045104541.b3lyp_6-31g(d).inp

045104541.b3lyp_6-31g(d).qchem.inp (generated)

045104541.b3lyp_6-31g(d).gjf (generated)

045104541.b3lyp_6-31g(d).firefly.inp (generated)

045104541.b3lyp_6-31g(d).smash.inp (generated)

045104541.b3lyp_6-31g(d).nwchem.inp (generated) 045104541.b3lyp_6-31g(d).log.xz 045104541.td-b3lyp_6-31g+(d).inp 045104541.td-b3lyp_6-31g+(d).log.xz

045104541.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104541.td-b3lyp_6-31+g(d).gjf (generated)

045104541.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104541.mol 045104541.PUBCHEM 045104541.mol (via Jmol)
045104542.b3lyp_6-31g(d).inp

045104542.b3lyp_6-31g(d).qchem.inp (generated)

045104542.b3lyp_6-31g(d).gjf (generated)

045104542.b3lyp_6-31g(d).firefly.inp (generated)

045104542.b3lyp_6-31g(d).smash.inp (generated)

045104542.b3lyp_6-31g(d).nwchem.inp (generated) 045104542.b3lyp_6-31g(d).log.xz 045104542.td-b3lyp_6-31g+(d).inp 045104542.td-b3lyp_6-31g+(d).log.xz

045104542.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104542.td-b3lyp_6-31+g(d).gjf (generated)

045104542.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104542.mol 045104542.PUBCHEM 045104542.mol (via Jmol)
045104543.b3lyp_6-31g(d).inp

045104543.b3lyp_6-31g(d).qchem.inp (generated)

045104543.b3lyp_6-31g(d).gjf (generated)

045104543.b3lyp_6-31g(d).firefly.inp (generated)

045104543.b3lyp_6-31g(d).smash.inp (generated)

045104543.b3lyp_6-31g(d).nwchem.inp (generated) 045104543.b3lyp_6-31g(d).log.xz 045104543.td-b3lyp_6-31g+(d).inp 045104543.td-b3lyp_6-31g+(d).log.xz

045104543.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104543.td-b3lyp_6-31+g(d).gjf (generated)

045104543.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104543.mol 045104543.PUBCHEM 045104543.mol (via Jmol)
045104544.b3lyp_6-31g(d).inp

045104544.b3lyp_6-31g(d).qchem.inp (generated)

045104544.b3lyp_6-31g(d).gjf (generated)

045104544.b3lyp_6-31g(d).firefly.inp (generated)

045104544.b3lyp_6-31g(d).smash.inp (generated)

045104544.b3lyp_6-31g(d).nwchem.inp (generated) 045104544.b3lyp_6-31g(d).log.xz 045104544.td-b3lyp_6-31g+(d).inp 045104544.td-b3lyp_6-31g+(d).log.xz

045104544.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104544.td-b3lyp_6-31+g(d).gjf (generated)

045104544.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104544.mol 045104544.PUBCHEM 045104544.mol (via Jmol)
045104594.b3lyp_6-31g(d).inp

045104594.b3lyp_6-31g(d).qchem.inp (generated)

045104594.b3lyp_6-31g(d).gjf (generated)

045104594.b3lyp_6-31g(d).firefly.inp (generated)

045104594.b3lyp_6-31g(d).smash.inp (generated)

045104594.b3lyp_6-31g(d).nwchem.inp (generated) 045104594.b3lyp_6-31g(d).log.xz 045104594.td-b3lyp_6-31g+(d).inp 045104594.td-b3lyp_6-31g+(d).log.xz

045104594.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104594.td-b3lyp_6-31+g(d).gjf (generated)

045104594.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104594.mol 045104594.PUBCHEM 045104594.mol (via Jmol)
045104666.b3lyp_6-31g(d).inp

045104666.b3lyp_6-31g(d).qchem.inp (generated)

045104666.b3lyp_6-31g(d).gjf (generated)

045104666.b3lyp_6-31g(d).firefly.inp (generated)

045104666.b3lyp_6-31g(d).smash.inp (generated)

045104666.b3lyp_6-31g(d).nwchem.inp (generated) 045104666.b3lyp_6-31g(d).log.xz 045104666.td-b3lyp_6-31g+(d).inp 045104666.td-b3lyp_6-31g+(d).log.xz

045104666.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104666.td-b3lyp_6-31+g(d).gjf (generated)

045104666.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104666.mol 045104666.PUBCHEM 045104666.mol (via Jmol)
045104696.b3lyp_6-31g(d).inp

045104696.b3lyp_6-31g(d).qchem.inp (generated)

045104696.b3lyp_6-31g(d).gjf (generated)

045104696.b3lyp_6-31g(d).firefly.inp (generated)

045104696.b3lyp_6-31g(d).smash.inp (generated)

045104696.b3lyp_6-31g(d).nwchem.inp (generated) 045104696.b3lyp_6-31g(d).log.xz 045104696.mol 045104696.PUBCHEM 045104696.mol (via Jmol)
045104698.b3lyp_6-31g(d).inp

045104698.b3lyp_6-31g(d).qchem.inp (generated)

045104698.b3lyp_6-31g(d).gjf (generated)

045104698.b3lyp_6-31g(d).firefly.inp (generated)

045104698.b3lyp_6-31g(d).smash.inp (generated)

045104698.b3lyp_6-31g(d).nwchem.inp (generated) 045104698.b3lyp_6-31g(d).log.xz 045104698.td-b3lyp_6-31g+(d).inp 045104698.td-b3lyp_6-31g+(d).log.xz

045104698.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104698.td-b3lyp_6-31+g(d).gjf (generated)

045104698.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104698.mol 045104698.PUBCHEM 045104698.mol (via Jmol)
045104699.b3lyp_6-31g(d).inp

045104699.b3lyp_6-31g(d).qchem.inp (generated)

045104699.b3lyp_6-31g(d).gjf (generated)

045104699.b3lyp_6-31g(d).firefly.inp (generated)

045104699.b3lyp_6-31g(d).smash.inp (generated)

045104699.b3lyp_6-31g(d).nwchem.inp (generated) 045104699.b3lyp_6-31g(d).log.xz 045104699.td-b3lyp_6-31g+(d).inp 045104699.td-b3lyp_6-31g+(d).log.xz

045104699.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104699.td-b3lyp_6-31+g(d).gjf (generated)

045104699.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104699.mol 045104699.PUBCHEM 045104699.mol (via Jmol)
045104700.b3lyp_6-31g(d).inp

045104700.b3lyp_6-31g(d).qchem.inp (generated)

045104700.b3lyp_6-31g(d).gjf (generated)

045104700.b3lyp_6-31g(d).firefly.inp (generated)

045104700.b3lyp_6-31g(d).smash.inp (generated)

045104700.b3lyp_6-31g(d).nwchem.inp (generated) 045104700.b3lyp_6-31g(d).log.xz 045104700.td-b3lyp_6-31g+(d).inp 045104700.td-b3lyp_6-31g+(d).log.xz

045104700.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104700.td-b3lyp_6-31+g(d).gjf (generated)

045104700.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104700.mol 045104700.PUBCHEM 045104700.mol (via Jmol)
045104702.b3lyp_6-31g(d).inp

045104702.b3lyp_6-31g(d).qchem.inp (generated)

045104702.b3lyp_6-31g(d).gjf (generated)

045104702.b3lyp_6-31g(d).firefly.inp (generated)

045104702.b3lyp_6-31g(d).smash.inp (generated)

045104702.b3lyp_6-31g(d).nwchem.inp (generated) 045104702.b3lyp_6-31g(d).log.xz 045104702.td-b3lyp_6-31g+(d).inp 045104702.td-b3lyp_6-31g+(d).log.xz

045104702.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104702.td-b3lyp_6-31+g(d).gjf (generated)

045104702.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104702.mol 045104702.PUBCHEM 045104702.mol (via Jmol)
045104797.b3lyp_6-31g(d).inp

045104797.b3lyp_6-31g(d).qchem.inp (generated)

045104797.b3lyp_6-31g(d).gjf (generated)

045104797.b3lyp_6-31g(d).firefly.inp (generated)

045104797.b3lyp_6-31g(d).smash.inp (generated)

045104797.b3lyp_6-31g(d).nwchem.inp (generated) 045104797.b3lyp_6-31g(d).log.xz 045104797.mol 045104797.PUBCHEM 045104797.mol (via Jmol)
045104798.b3lyp_6-31g(d).inp

045104798.b3lyp_6-31g(d).qchem.inp (generated)

045104798.b3lyp_6-31g(d).gjf (generated)

045104798.b3lyp_6-31g(d).firefly.inp (generated)

045104798.b3lyp_6-31g(d).smash.inp (generated)

045104798.b3lyp_6-31g(d).nwchem.inp (generated) 045104798.b3lyp_6-31g(d).log.xz 045104798.mol 045104798.PUBCHEM 045104798.mol (via Jmol)
045104799.b3lyp_6-31g(d).inp

045104799.b3lyp_6-31g(d).qchem.inp (generated)

045104799.b3lyp_6-31g(d).gjf (generated)

045104799.b3lyp_6-31g(d).firefly.inp (generated)

045104799.b3lyp_6-31g(d).smash.inp (generated)

045104799.b3lyp_6-31g(d).nwchem.inp (generated) 045104799.b3lyp_6-31g(d).log.xz 045104799.td-b3lyp_6-31g+(d).inp 045104799.td-b3lyp_6-31g+(d).log.xz

045104799.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104799.td-b3lyp_6-31+g(d).gjf (generated)

045104799.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104799.mol 045104799.PUBCHEM 045104799.mol (via Jmol)
045104800.b3lyp_6-31g(d).inp

045104800.b3lyp_6-31g(d).qchem.inp (generated)

045104800.b3lyp_6-31g(d).gjf (generated)

045104800.b3lyp_6-31g(d).firefly.inp (generated)

045104800.b3lyp_6-31g(d).smash.inp (generated)

045104800.b3lyp_6-31g(d).nwchem.inp (generated) 045104800.b3lyp_6-31g(d).log.xz 045104800.td-b3lyp_6-31g+(d).inp 045104800.td-b3lyp_6-31g+(d).log.xz

045104800.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104800.td-b3lyp_6-31+g(d).gjf (generated)

045104800.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104800.mol 045104800.PUBCHEM 045104800.mol (via Jmol)
045104801.b3lyp_6-31g(d).inp

045104801.b3lyp_6-31g(d).qchem.inp (generated)

045104801.b3lyp_6-31g(d).gjf (generated)

045104801.b3lyp_6-31g(d).firefly.inp (generated)

045104801.b3lyp_6-31g(d).smash.inp (generated)

045104801.b3lyp_6-31g(d).nwchem.inp (generated) 045104801.b3lyp_6-31g(d).log.xz 045104801.td-b3lyp_6-31g+(d).inp 045104801.td-b3lyp_6-31g+(d).log.xz

045104801.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104801.td-b3lyp_6-31+g(d).gjf (generated)

045104801.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104801.mol 045104801.PUBCHEM 045104801.mol (via Jmol)
045104802.b3lyp_6-31g(d).inp

045104802.b3lyp_6-31g(d).qchem.inp (generated)

045104802.b3lyp_6-31g(d).gjf (generated)

045104802.b3lyp_6-31g(d).firefly.inp (generated)

045104802.b3lyp_6-31g(d).smash.inp (generated)

045104802.b3lyp_6-31g(d).nwchem.inp (generated) 045104802.b3lyp_6-31g(d).log.xz 045104802.td-b3lyp_6-31g+(d).inp 045104802.td-b3lyp_6-31g+(d).log.xz

045104802.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104802.td-b3lyp_6-31+g(d).gjf (generated)

045104802.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104802.mol 045104802.PUBCHEM 045104802.mol (via Jmol)
045104803.b3lyp_6-31g(d).inp

045104803.b3lyp_6-31g(d).qchem.inp (generated)

045104803.b3lyp_6-31g(d).gjf (generated)

045104803.b3lyp_6-31g(d).firefly.inp (generated)

045104803.b3lyp_6-31g(d).smash.inp (generated)

045104803.b3lyp_6-31g(d).nwchem.inp (generated) 045104803.b3lyp_6-31g(d).log.xz 045104803.mol 045104803.PUBCHEM 045104803.mol (via Jmol)
045104864.b3lyp_6-31g(d).inp

045104864.b3lyp_6-31g(d).qchem.inp (generated)

045104864.b3lyp_6-31g(d).gjf (generated)

045104864.b3lyp_6-31g(d).firefly.inp (generated)

045104864.b3lyp_6-31g(d).smash.inp (generated)

045104864.b3lyp_6-31g(d).nwchem.inp (generated) 045104864.b3lyp_6-31g(d).log.xz 045104864.td-b3lyp_6-31g+(d).inp 045104864.td-b3lyp_6-31g+(d).log.xz

045104864.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104864.td-b3lyp_6-31+g(d).gjf (generated)

045104864.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104864.mol 045104864.PUBCHEM 045104864.mol (via Jmol)
045104865.b3lyp_6-31g(d).inp

045104865.b3lyp_6-31g(d).qchem.inp (generated)

045104865.b3lyp_6-31g(d).gjf (generated)

045104865.b3lyp_6-31g(d).firefly.inp (generated)

045104865.b3lyp_6-31g(d).smash.inp (generated)

045104865.b3lyp_6-31g(d).nwchem.inp (generated) 045104865.b3lyp_6-31g(d).log.xz 045104865.td-b3lyp_6-31g+(d).inp 045104865.td-b3lyp_6-31g+(d).log.xz

045104865.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104865.td-b3lyp_6-31+g(d).gjf (generated)

045104865.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104865.mol 045104865.PUBCHEM 045104865.mol (via Jmol)
045104894.b3lyp_6-31g(d).inp

045104894.b3lyp_6-31g(d).qchem.inp (generated)

045104894.b3lyp_6-31g(d).gjf (generated)

045104894.b3lyp_6-31g(d).firefly.inp (generated)

045104894.b3lyp_6-31g(d).smash.inp (generated)

045104894.b3lyp_6-31g(d).nwchem.inp (generated) 045104894.b3lyp_6-31g(d).log.xz 045104894.mol 045104894.PUBCHEM 045104894.mol (via Jmol)
045104895.b3lyp_6-31g(d).inp

045104895.b3lyp_6-31g(d).qchem.inp (generated)

045104895.b3lyp_6-31g(d).gjf (generated)

045104895.b3lyp_6-31g(d).firefly.inp (generated)

045104895.b3lyp_6-31g(d).smash.inp (generated)

045104895.b3lyp_6-31g(d).nwchem.inp (generated) 045104895.b3lyp_6-31g(d).log.xz 045104895.td-b3lyp_6-31g+(d).inp 045104895.td-b3lyp_6-31g+(d).log.xz

045104895.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104895.td-b3lyp_6-31+g(d).gjf (generated)

045104895.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104895.mol 045104895.PUBCHEM 045104895.mol (via Jmol)
045104896.b3lyp_6-31g(d).inp

045104896.b3lyp_6-31g(d).qchem.inp (generated)

045104896.b3lyp_6-31g(d).gjf (generated)

045104896.b3lyp_6-31g(d).firefly.inp (generated)

045104896.b3lyp_6-31g(d).smash.inp (generated)

045104896.b3lyp_6-31g(d).nwchem.inp (generated) 045104896.b3lyp_6-31g(d).log.xz 045104896.td-b3lyp_6-31g+(d).inp 045104896.td-b3lyp_6-31g+(d).log.xz

045104896.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104896.td-b3lyp_6-31+g(d).gjf (generated)

045104896.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104896.mol 045104896.PUBCHEM 045104896.mol (via Jmol)
045104897.b3lyp_6-31g(d).inp

045104897.b3lyp_6-31g(d).qchem.inp (generated)

045104897.b3lyp_6-31g(d).gjf (generated)

045104897.b3lyp_6-31g(d).firefly.inp (generated)

045104897.b3lyp_6-31g(d).smash.inp (generated)

045104897.b3lyp_6-31g(d).nwchem.inp (generated) 045104897.b3lyp_6-31g(d).log.xz 045104897.td-b3lyp_6-31g+(d).inp 045104897.td-b3lyp_6-31g+(d).log.xz

045104897.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104897.td-b3lyp_6-31+g(d).gjf (generated)

045104897.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104897.mol 045104897.PUBCHEM 045104897.mol (via Jmol)
045104899.b3lyp_6-31g(d).inp

045104899.b3lyp_6-31g(d).qchem.inp (generated)

045104899.b3lyp_6-31g(d).gjf (generated)

045104899.b3lyp_6-31g(d).firefly.inp (generated)

045104899.b3lyp_6-31g(d).smash.inp (generated)

045104899.b3lyp_6-31g(d).nwchem.inp (generated) 045104899.b3lyp_6-31g(d).log.xz 045104899.td-b3lyp_6-31g+(d).inp 045104899.td-b3lyp_6-31g+(d).log.xz

045104899.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104899.td-b3lyp_6-31+g(d).gjf (generated)

045104899.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104899.mol 045104899.PUBCHEM 045104899.mol (via Jmol)
045104900.b3lyp_6-31g(d).inp

045104900.b3lyp_6-31g(d).qchem.inp (generated)

045104900.b3lyp_6-31g(d).gjf (generated)

045104900.b3lyp_6-31g(d).firefly.inp (generated)

045104900.b3lyp_6-31g(d).smash.inp (generated)

045104900.b3lyp_6-31g(d).nwchem.inp (generated) 045104900.b3lyp_6-31g(d).log.xz 045104900.td-b3lyp_6-31g+(d).inp 045104900.td-b3lyp_6-31g+(d).log.xz

045104900.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104900.td-b3lyp_6-31+g(d).gjf (generated)

045104900.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104900.mol 045104900.PUBCHEM 045104900.mol (via Jmol)
045104901.b3lyp_6-31g(d).inp

045104901.b3lyp_6-31g(d).qchem.inp (generated)

045104901.b3lyp_6-31g(d).gjf (generated)

045104901.b3lyp_6-31g(d).firefly.inp (generated)

045104901.b3lyp_6-31g(d).smash.inp (generated)

045104901.b3lyp_6-31g(d).nwchem.inp (generated) 045104901.b3lyp_6-31g(d).log.xz 045104901.td-b3lyp_6-31g+(d).inp 045104901.td-b3lyp_6-31g+(d).log.xz

045104901.td-b3lyp_6-31+g(d).qchem.inp (generated)

045104901.td-b3lyp_6-31+g(d).gjf (generated)

045104901.td-b3lyp_6-31+g(d).firefly.inp (generated)

045104901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045104901.mol 045104901.PUBCHEM 045104901.mol (via Jmol)
045105012.b3lyp_6-31g(d).inp

045105012.b3lyp_6-31g(d).qchem.inp (generated)

045105012.b3lyp_6-31g(d).gjf (generated)

045105012.b3lyp_6-31g(d).firefly.inp (generated)

045105012.b3lyp_6-31g(d).smash.inp (generated)

045105012.b3lyp_6-31g(d).nwchem.inp (generated) 045105012.b3lyp_6-31g(d).log.xz 045105012.td-b3lyp_6-31g+(d).inp 045105012.td-b3lyp_6-31g+(d).log.xz

045105012.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105012.td-b3lyp_6-31+g(d).gjf (generated)

045105012.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105012.mol 045105012.PUBCHEM 045105012.mol (via Jmol)
045105013.b3lyp_6-31g(d).inp

045105013.b3lyp_6-31g(d).qchem.inp (generated)

045105013.b3lyp_6-31g(d).gjf (generated)

045105013.b3lyp_6-31g(d).firefly.inp (generated)

045105013.b3lyp_6-31g(d).smash.inp (generated)

045105013.b3lyp_6-31g(d).nwchem.inp (generated) 045105013.b3lyp_6-31g(d).log.xz 045105013.td-b3lyp_6-31g+(d).inp 045105013.td-b3lyp_6-31g+(d).log.xz

045105013.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105013.td-b3lyp_6-31+g(d).gjf (generated)

045105013.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105013.mol 045105013.PUBCHEM 045105013.mol (via Jmol)
045105294.b3lyp_6-31g(d).inp

045105294.b3lyp_6-31g(d).qchem.inp (generated)

045105294.b3lyp_6-31g(d).gjf (generated)

045105294.b3lyp_6-31g(d).firefly.inp (generated)

045105294.b3lyp_6-31g(d).smash.inp (generated)

045105294.b3lyp_6-31g(d).nwchem.inp (generated) 045105294.b3lyp_6-31g(d).log.xz 045105294.td-b3lyp_6-31g+(d).inp 045105294.td-b3lyp_6-31g+(d).log.xz

045105294.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105294.td-b3lyp_6-31+g(d).gjf (generated)

045105294.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105294.mol 045105294.PUBCHEM 045105294.mol (via Jmol)
045105870.b3lyp_6-31g(d).inp

045105870.b3lyp_6-31g(d).qchem.inp (generated)

045105870.b3lyp_6-31g(d).gjf (generated)

045105870.b3lyp_6-31g(d).firefly.inp (generated)

045105870.b3lyp_6-31g(d).smash.inp (generated)

045105870.b3lyp_6-31g(d).nwchem.inp (generated) 045105870.b3lyp_6-31g(d).log.xz 045105870.td-b3lyp_6-31g+(d).inp 045105870.td-b3lyp_6-31g+(d).log.xz

045105870.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105870.td-b3lyp_6-31+g(d).gjf (generated)

045105870.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105870.mol 045105870.PUBCHEM 045105870.mol (via Jmol)
045105888.b3lyp_6-31g(d).inp

045105888.b3lyp_6-31g(d).qchem.inp (generated)

045105888.b3lyp_6-31g(d).gjf (generated)

045105888.b3lyp_6-31g(d).firefly.inp (generated)

045105888.b3lyp_6-31g(d).smash.inp (generated)

045105888.b3lyp_6-31g(d).nwchem.inp (generated) 045105888.b3lyp_6-31g(d).log.xz 045105888.td-b3lyp_6-31g+(d).inp 045105888.td-b3lyp_6-31g+(d).log.xz

045105888.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105888.td-b3lyp_6-31+g(d).gjf (generated)

045105888.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105888.mol 045105888.PUBCHEM 045105888.mol (via Jmol)
045105912.b3lyp_6-31g(d).inp

045105912.b3lyp_6-31g(d).qchem.inp (generated)

045105912.b3lyp_6-31g(d).gjf (generated)

045105912.b3lyp_6-31g(d).firefly.inp (generated)

045105912.b3lyp_6-31g(d).smash.inp (generated)

045105912.b3lyp_6-31g(d).nwchem.inp (generated) 045105912.b3lyp_6-31g(d).log.xz 045105912.td-b3lyp_6-31g+(d).inp 045105912.td-b3lyp_6-31g+(d).log.xz

045105912.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105912.td-b3lyp_6-31+g(d).gjf (generated)

045105912.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105912.mol 045105912.PUBCHEM 045105912.mol (via Jmol)
045105932.b3lyp_6-31g(d).inp

045105932.b3lyp_6-31g(d).qchem.inp (generated)

045105932.b3lyp_6-31g(d).gjf (generated)

045105932.b3lyp_6-31g(d).firefly.inp (generated)

045105932.b3lyp_6-31g(d).smash.inp (generated)

045105932.b3lyp_6-31g(d).nwchem.inp (generated) 045105932.b3lyp_6-31g(d).log.xz 045105932.mol 045105932.PUBCHEM 045105932.mol (via Jmol)
045105953.b3lyp_6-31g(d).inp

045105953.b3lyp_6-31g(d).qchem.inp (generated)

045105953.b3lyp_6-31g(d).gjf (generated)

045105953.b3lyp_6-31g(d).firefly.inp (generated)

045105953.b3lyp_6-31g(d).smash.inp (generated)

045105953.b3lyp_6-31g(d).nwchem.inp (generated) 045105953.b3lyp_6-31g(d).log.xz 045105953.td-b3lyp_6-31g+(d).inp 045105953.td-b3lyp_6-31g+(d).log.xz

045105953.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105953.td-b3lyp_6-31+g(d).gjf (generated)

045105953.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105953.mol 045105953.PUBCHEM 045105953.mol (via Jmol)
045105968.b3lyp_6-31g(d).inp

045105968.b3lyp_6-31g(d).qchem.inp (generated)

045105968.b3lyp_6-31g(d).gjf (generated)

045105968.b3lyp_6-31g(d).firefly.inp (generated)

045105968.b3lyp_6-31g(d).smash.inp (generated)

045105968.b3lyp_6-31g(d).nwchem.inp (generated) 045105968.b3lyp_6-31g(d).log.xz 045105968.td-b3lyp_6-31g+(d).inp 045105968.td-b3lyp_6-31g+(d).log.xz

045105968.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105968.td-b3lyp_6-31+g(d).gjf (generated)

045105968.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105968.mol 045105968.PUBCHEM 045105968.mol (via Jmol)
045105974.b3lyp_6-31g(d).inp

045105974.b3lyp_6-31g(d).qchem.inp (generated)

045105974.b3lyp_6-31g(d).gjf (generated)

045105974.b3lyp_6-31g(d).firefly.inp (generated)

045105974.b3lyp_6-31g(d).smash.inp (generated)

045105974.b3lyp_6-31g(d).nwchem.inp (generated) 045105974.b3lyp_6-31g(d).log.xz 045105974.td-b3lyp_6-31g+(d).inp 045105974.td-b3lyp_6-31g+(d).log.xz

045105974.td-b3lyp_6-31+g(d).qchem.inp (generated)

045105974.td-b3lyp_6-31+g(d).gjf (generated)

045105974.td-b3lyp_6-31+g(d).firefly.inp (generated)

045105974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045105974.mol 045105974.PUBCHEM 045105974.mol (via Jmol)
045106007.b3lyp_6-31g(d).inp

045106007.b3lyp_6-31g(d).qchem.inp (generated)

045106007.b3lyp_6-31g(d).gjf (generated)

045106007.b3lyp_6-31g(d).firefly.inp (generated)

045106007.b3lyp_6-31g(d).smash.inp (generated)

045106007.b3lyp_6-31g(d).nwchem.inp (generated) 045106007.b3lyp_6-31g(d).log.xz 045106007.mol 045106007.PUBCHEM 045106007.mol (via Jmol)
045106009.b3lyp_6-31g(d).inp

045106009.b3lyp_6-31g(d).qchem.inp (generated)

045106009.b3lyp_6-31g(d).gjf (generated)

045106009.b3lyp_6-31g(d).firefly.inp (generated)

045106009.b3lyp_6-31g(d).smash.inp (generated)

045106009.b3lyp_6-31g(d).nwchem.inp (generated) 045106009.b3lyp_6-31g(d).log.xz 045106009.td-b3lyp_6-31g+(d).inp 045106009.td-b3lyp_6-31g+(d).log.xz

045106009.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106009.td-b3lyp_6-31+g(d).gjf (generated)

045106009.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106009.mol 045106009.PUBCHEM 045106009.mol (via Jmol)
045106010.b3lyp_6-31g(d).inp

045106010.b3lyp_6-31g(d).qchem.inp (generated)

045106010.b3lyp_6-31g(d).gjf (generated)

045106010.b3lyp_6-31g(d).firefly.inp (generated)

045106010.b3lyp_6-31g(d).smash.inp (generated)

045106010.b3lyp_6-31g(d).nwchem.inp (generated) 045106010.b3lyp_6-31g(d).log.xz 045106010.td-b3lyp_6-31g+(d).inp 045106010.td-b3lyp_6-31g+(d).log.xz

045106010.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106010.td-b3lyp_6-31+g(d).gjf (generated)

045106010.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106010.mol 045106010.PUBCHEM 045106010.mol (via Jmol)
045106070.b3lyp_6-31g(d).inp

045106070.b3lyp_6-31g(d).qchem.inp (generated)

045106070.b3lyp_6-31g(d).gjf (generated)

045106070.b3lyp_6-31g(d).firefly.inp (generated)

045106070.b3lyp_6-31g(d).smash.inp (generated)

045106070.b3lyp_6-31g(d).nwchem.inp (generated) 045106070.b3lyp_6-31g(d).log.xz 045106070.td-b3lyp_6-31g+(d).inp 045106070.td-b3lyp_6-31g+(d).log.xz

045106070.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106070.td-b3lyp_6-31+g(d).gjf (generated)

045106070.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106070.mol 045106070.PUBCHEM 045106070.mol (via Jmol)
045106185.b3lyp_6-31g(d).inp

045106185.b3lyp_6-31g(d).qchem.inp (generated)

045106185.b3lyp_6-31g(d).gjf (generated)

045106185.b3lyp_6-31g(d).firefly.inp (generated)

045106185.b3lyp_6-31g(d).smash.inp (generated)

045106185.b3lyp_6-31g(d).nwchem.inp (generated) 045106185.b3lyp_6-31g(d).log.xz 045106185.td-b3lyp_6-31g+(d).inp 045106185.td-b3lyp_6-31g+(d).log.xz

045106185.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106185.td-b3lyp_6-31+g(d).gjf (generated)

045106185.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106185.mol 045106185.PUBCHEM 045106185.mol (via Jmol)
045106198.b3lyp_6-31g(d).inp

045106198.b3lyp_6-31g(d).qchem.inp (generated)

045106198.b3lyp_6-31g(d).gjf (generated)

045106198.b3lyp_6-31g(d).firefly.inp (generated)

045106198.b3lyp_6-31g(d).smash.inp (generated)

045106198.b3lyp_6-31g(d).nwchem.inp (generated) 045106198.b3lyp_6-31g(d).log.xz 045106198.td-b3lyp_6-31g+(d).inp 045106198.td-b3lyp_6-31g+(d).log.xz

045106198.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106198.td-b3lyp_6-31+g(d).gjf (generated)

045106198.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106198.mol 045106198.PUBCHEM 045106198.mol (via Jmol)
045106207.b3lyp_6-31g(d).inp

045106207.b3lyp_6-31g(d).qchem.inp (generated)

045106207.b3lyp_6-31g(d).gjf (generated)

045106207.b3lyp_6-31g(d).firefly.inp (generated)

045106207.b3lyp_6-31g(d).smash.inp (generated)

045106207.b3lyp_6-31g(d).nwchem.inp (generated) 045106207.b3lyp_6-31g(d).log.xz 045106207.td-b3lyp_6-31g+(d).inp 045106207.td-b3lyp_6-31g+(d).log.xz

045106207.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106207.td-b3lyp_6-31+g(d).gjf (generated)

045106207.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106207.mol 045106207.PUBCHEM 045106207.mol (via Jmol)
045106250.b3lyp_6-31g(d).inp

045106250.b3lyp_6-31g(d).qchem.inp (generated)

045106250.b3lyp_6-31g(d).gjf (generated)

045106250.b3lyp_6-31g(d).firefly.inp (generated)

045106250.b3lyp_6-31g(d).smash.inp (generated)

045106250.b3lyp_6-31g(d).nwchem.inp (generated) 045106250.b3lyp_6-31g(d).log.xz 045106250.td-b3lyp_6-31g+(d).inp 045106250.td-b3lyp_6-31g+(d).log.xz

045106250.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106250.td-b3lyp_6-31+g(d).gjf (generated)

045106250.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106250.mol 045106250.PUBCHEM 045106250.mol (via Jmol)
045106258.b3lyp_6-31g(d).inp

045106258.b3lyp_6-31g(d).qchem.inp (generated)

045106258.b3lyp_6-31g(d).gjf (generated)

045106258.b3lyp_6-31g(d).firefly.inp (generated)

045106258.b3lyp_6-31g(d).smash.inp (generated)

045106258.b3lyp_6-31g(d).nwchem.inp (generated) 045106258.b3lyp_6-31g(d).log.xz 045106258.td-b3lyp_6-31g+(d).inp 045106258.td-b3lyp_6-31g+(d).log.xz

045106258.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106258.td-b3lyp_6-31+g(d).gjf (generated)

045106258.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106258.mol 045106258.PUBCHEM 045106258.mol (via Jmol)
045106379.b3lyp_6-31g(d).inp

045106379.b3lyp_6-31g(d).qchem.inp (generated)

045106379.b3lyp_6-31g(d).gjf (generated)

045106379.b3lyp_6-31g(d).firefly.inp (generated)

045106379.b3lyp_6-31g(d).smash.inp (generated)

045106379.b3lyp_6-31g(d).nwchem.inp (generated) 045106379.b3lyp_6-31g(d).log.xz 045106379.td-b3lyp_6-31g+(d).inp 045106379.td-b3lyp_6-31g+(d).log.xz

045106379.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106379.td-b3lyp_6-31+g(d).gjf (generated)

045106379.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106379.mol 045106379.PUBCHEM 045106379.mol (via Jmol)
045106433.b3lyp_6-31g(d).inp

045106433.b3lyp_6-31g(d).qchem.inp (generated)

045106433.b3lyp_6-31g(d).gjf (generated)

045106433.b3lyp_6-31g(d).firefly.inp (generated)

045106433.b3lyp_6-31g(d).smash.inp (generated)

045106433.b3lyp_6-31g(d).nwchem.inp (generated) 045106433.b3lyp_6-31g(d).log.xz 045106433.td-b3lyp_6-31g+(d).inp 045106433.td-b3lyp_6-31g+(d).log.xz

045106433.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106433.td-b3lyp_6-31+g(d).gjf (generated)

045106433.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106433.mol 045106433.PUBCHEM 045106433.mol (via Jmol)
045106445.b3lyp_6-31g(d).inp

045106445.b3lyp_6-31g(d).qchem.inp (generated)

045106445.b3lyp_6-31g(d).gjf (generated)

045106445.b3lyp_6-31g(d).firefly.inp (generated)

045106445.b3lyp_6-31g(d).smash.inp (generated)

045106445.b3lyp_6-31g(d).nwchem.inp (generated) 045106445.b3lyp_6-31g(d).log.xz 045106445.td-b3lyp_6-31g+(d).inp 045106445.td-b3lyp_6-31g+(d).log.xz

045106445.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106445.td-b3lyp_6-31+g(d).gjf (generated)

045106445.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106445.mol 045106445.PUBCHEM 045106445.mol (via Jmol)
045106452.b3lyp_6-31g(d).inp

045106452.b3lyp_6-31g(d).qchem.inp (generated)

045106452.b3lyp_6-31g(d).gjf (generated)

045106452.b3lyp_6-31g(d).firefly.inp (generated)

045106452.b3lyp_6-31g(d).smash.inp (generated)

045106452.b3lyp_6-31g(d).nwchem.inp (generated) 045106452.b3lyp_6-31g(d).log.xz 045106452.td-b3lyp_6-31g+(d).inp 045106452.td-b3lyp_6-31g+(d).log.xz

045106452.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106452.td-b3lyp_6-31+g(d).gjf (generated)

045106452.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106452.mol 045106452.PUBCHEM 045106452.mol (via Jmol)
045106461.b3lyp_6-31g(d).inp

045106461.b3lyp_6-31g(d).qchem.inp (generated)

045106461.b3lyp_6-31g(d).gjf (generated)

045106461.b3lyp_6-31g(d).firefly.inp (generated)

045106461.b3lyp_6-31g(d).smash.inp (generated)

045106461.b3lyp_6-31g(d).nwchem.inp (generated) 045106461.b3lyp_6-31g(d).log.xz 045106461.mol 045106461.PUBCHEM 045106461.mol (via Jmol)
045106463.b3lyp_6-31g(d).inp

045106463.b3lyp_6-31g(d).qchem.inp (generated)

045106463.b3lyp_6-31g(d).gjf (generated)

045106463.b3lyp_6-31g(d).firefly.inp (generated)

045106463.b3lyp_6-31g(d).smash.inp (generated)

045106463.b3lyp_6-31g(d).nwchem.inp (generated) 045106463.b3lyp_6-31g(d).log.xz 045106463.mol 045106463.PUBCHEM 045106463.mol (via Jmol)
045106475.b3lyp_6-31g(d).inp

045106475.b3lyp_6-31g(d).qchem.inp (generated)

045106475.b3lyp_6-31g(d).gjf (generated)

045106475.b3lyp_6-31g(d).firefly.inp (generated)

045106475.b3lyp_6-31g(d).smash.inp (generated)

045106475.b3lyp_6-31g(d).nwchem.inp (generated) 045106475.b3lyp_6-31g(d).log.xz 045106475.mol 045106475.PUBCHEM 045106475.mol (via Jmol)
045106515.b3lyp_6-31g(d).inp

045106515.b3lyp_6-31g(d).qchem.inp (generated)

045106515.b3lyp_6-31g(d).gjf (generated)

045106515.b3lyp_6-31g(d).firefly.inp (generated)

045106515.b3lyp_6-31g(d).smash.inp (generated)

045106515.b3lyp_6-31g(d).nwchem.inp (generated) 045106515.b3lyp_6-31g(d).log.xz 045106515.td-b3lyp_6-31g+(d).inp 045106515.td-b3lyp_6-31g+(d).log.xz

045106515.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106515.td-b3lyp_6-31+g(d).gjf (generated)

045106515.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106515.mol 045106515.PUBCHEM 045106515.mol (via Jmol)
045106539.b3lyp_6-31g(d).inp

045106539.b3lyp_6-31g(d).qchem.inp (generated)

045106539.b3lyp_6-31g(d).gjf (generated)

045106539.b3lyp_6-31g(d).firefly.inp (generated)

045106539.b3lyp_6-31g(d).smash.inp (generated)

045106539.b3lyp_6-31g(d).nwchem.inp (generated) 045106539.b3lyp_6-31g(d).log.xz 045106539.td-b3lyp_6-31g+(d).inp 045106539.td-b3lyp_6-31g+(d).log.xz

045106539.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106539.td-b3lyp_6-31+g(d).gjf (generated)

045106539.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106539.mol 045106539.PUBCHEM 045106539.mol (via Jmol)
045106547.b3lyp_6-31g(d).inp

045106547.b3lyp_6-31g(d).qchem.inp (generated)

045106547.b3lyp_6-31g(d).gjf (generated)

045106547.b3lyp_6-31g(d).firefly.inp (generated)

045106547.b3lyp_6-31g(d).smash.inp (generated)

045106547.b3lyp_6-31g(d).nwchem.inp (generated) 045106547.b3lyp_6-31g(d).log.xz 045106547.td-b3lyp_6-31g+(d).inp 045106547.td-b3lyp_6-31g+(d).log.xz

045106547.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106547.td-b3lyp_6-31+g(d).gjf (generated)

045106547.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106547.mol 045106547.PUBCHEM 045106547.mol (via Jmol)
045106573.b3lyp_6-31g(d).inp

045106573.b3lyp_6-31g(d).qchem.inp (generated)

045106573.b3lyp_6-31g(d).gjf (generated)

045106573.b3lyp_6-31g(d).firefly.inp (generated)

045106573.b3lyp_6-31g(d).smash.inp (generated)

045106573.b3lyp_6-31g(d).nwchem.inp (generated) 045106573.b3lyp_6-31g(d).log.xz 045106573.mol 045106573.PUBCHEM 045106573.mol (via Jmol)
045106650.b3lyp_6-31g(d).inp

045106650.b3lyp_6-31g(d).qchem.inp (generated)

045106650.b3lyp_6-31g(d).gjf (generated)

045106650.b3lyp_6-31g(d).firefly.inp (generated)

045106650.b3lyp_6-31g(d).smash.inp (generated)

045106650.b3lyp_6-31g(d).nwchem.inp (generated) 045106650.b3lyp_6-31g(d).log.xz 045106650.td-b3lyp_6-31g+(d).inp 045106650.td-b3lyp_6-31g+(d).log.xz

045106650.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106650.td-b3lyp_6-31+g(d).gjf (generated)

045106650.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106650.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106650.mol 045106650.PUBCHEM 045106650.mol (via Jmol)
045106661.b3lyp_6-31g(d).inp

045106661.b3lyp_6-31g(d).qchem.inp (generated)

045106661.b3lyp_6-31g(d).gjf (generated)

045106661.b3lyp_6-31g(d).firefly.inp (generated)

045106661.b3lyp_6-31g(d).smash.inp (generated)

045106661.b3lyp_6-31g(d).nwchem.inp (generated) 045106661.b3lyp_6-31g(d).log.xz 045106661.td-b3lyp_6-31g+(d).inp 045106661.td-b3lyp_6-31g+(d).log.xz

045106661.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106661.td-b3lyp_6-31+g(d).gjf (generated)

045106661.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106661.mol 045106661.PUBCHEM 045106661.mol (via Jmol)
045106685.b3lyp_6-31g(d).inp

045106685.b3lyp_6-31g(d).qchem.inp (generated)

045106685.b3lyp_6-31g(d).gjf (generated)

045106685.b3lyp_6-31g(d).firefly.inp (generated)

045106685.b3lyp_6-31g(d).smash.inp (generated)

045106685.b3lyp_6-31g(d).nwchem.inp (generated) 045106685.b3lyp_6-31g(d).log.xz 045106685.td-b3lyp_6-31g+(d).inp 045106685.td-b3lyp_6-31g+(d).log.xz

045106685.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106685.td-b3lyp_6-31+g(d).gjf (generated)

045106685.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106685.mol 045106685.PUBCHEM 045106685.mol (via Jmol)
045106697.b3lyp_6-31g(d).inp

045106697.b3lyp_6-31g(d).qchem.inp (generated)

045106697.b3lyp_6-31g(d).gjf (generated)

045106697.b3lyp_6-31g(d).firefly.inp (generated)

045106697.b3lyp_6-31g(d).smash.inp (generated)

045106697.b3lyp_6-31g(d).nwchem.inp (generated) 045106697.b3lyp_6-31g(d).log.xz 045106697.mol 045106697.PUBCHEM 045106697.mol (via Jmol)
045106807.b3lyp_6-31g(d).inp

045106807.b3lyp_6-31g(d).qchem.inp (generated)

045106807.b3lyp_6-31g(d).gjf (generated)

045106807.b3lyp_6-31g(d).firefly.inp (generated)

045106807.b3lyp_6-31g(d).smash.inp (generated)

045106807.b3lyp_6-31g(d).nwchem.inp (generated) 045106807.b3lyp_6-31g(d).log.xz 045106807.td-b3lyp_6-31g+(d).inp 045106807.td-b3lyp_6-31g+(d).log.xz

045106807.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106807.td-b3lyp_6-31+g(d).gjf (generated)

045106807.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106807.mol 045106807.PUBCHEM 045106807.mol (via Jmol)
045106808.b3lyp_6-31g(d).inp

045106808.b3lyp_6-31g(d).qchem.inp (generated)

045106808.b3lyp_6-31g(d).gjf (generated)

045106808.b3lyp_6-31g(d).firefly.inp (generated)

045106808.b3lyp_6-31g(d).smash.inp (generated)

045106808.b3lyp_6-31g(d).nwchem.inp (generated) 045106808.b3lyp_6-31g(d).log.xz 045106808.mol 045106808.PUBCHEM 045106808.mol (via Jmol)
045106875.b3lyp_6-31g(d).inp

045106875.b3lyp_6-31g(d).qchem.inp (generated)

045106875.b3lyp_6-31g(d).gjf (generated)

045106875.b3lyp_6-31g(d).firefly.inp (generated)

045106875.b3lyp_6-31g(d).smash.inp (generated)

045106875.b3lyp_6-31g(d).nwchem.inp (generated) 045106875.b3lyp_6-31g(d).log.xz 045106875.td-b3lyp_6-31g+(d).inp 045106875.td-b3lyp_6-31g+(d).log.xz

045106875.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106875.td-b3lyp_6-31+g(d).gjf (generated)

045106875.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106875.mol 045106875.PUBCHEM 045106875.mol (via Jmol)
045106916.b3lyp_6-31g(d).inp

045106916.b3lyp_6-31g(d).qchem.inp (generated)

045106916.b3lyp_6-31g(d).gjf (generated)

045106916.b3lyp_6-31g(d).firefly.inp (generated)

045106916.b3lyp_6-31g(d).smash.inp (generated)

045106916.b3lyp_6-31g(d).nwchem.inp (generated) 045106916.b3lyp_6-31g(d).log.xz 045106916.td-b3lyp_6-31g+(d).inp 045106916.td-b3lyp_6-31g+(d).log.xz

045106916.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106916.td-b3lyp_6-31+g(d).gjf (generated)

045106916.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106916.mol 045106916.PUBCHEM 045106916.mol (via Jmol)
045106935.b3lyp_6-31g(d).inp

045106935.b3lyp_6-31g(d).qchem.inp (generated)

045106935.b3lyp_6-31g(d).gjf (generated)

045106935.b3lyp_6-31g(d).firefly.inp (generated)

045106935.b3lyp_6-31g(d).smash.inp (generated)

045106935.b3lyp_6-31g(d).nwchem.inp (generated) 045106935.b3lyp_6-31g(d).log.xz 045106935.td-b3lyp_6-31g+(d).inp 045106935.td-b3lyp_6-31g+(d).log.xz

045106935.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106935.td-b3lyp_6-31+g(d).gjf (generated)

045106935.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106935.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106935.mol 045106935.PUBCHEM 045106935.mol (via Jmol)
045106970.b3lyp_6-31g(d).inp

045106970.b3lyp_6-31g(d).qchem.inp (generated)

045106970.b3lyp_6-31g(d).gjf (generated)

045106970.b3lyp_6-31g(d).firefly.inp (generated)

045106970.b3lyp_6-31g(d).smash.inp (generated)

045106970.b3lyp_6-31g(d).nwchem.inp (generated) 045106970.b3lyp_6-31g(d).log.xz 045106970.td-b3lyp_6-31g+(d).inp 045106970.td-b3lyp_6-31g+(d).log.xz

045106970.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106970.td-b3lyp_6-31+g(d).gjf (generated)

045106970.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106970.mol 045106970.PUBCHEM 045106970.mol (via Jmol)
045106979.b3lyp_6-31g(d).inp

045106979.b3lyp_6-31g(d).qchem.inp (generated)

045106979.b3lyp_6-31g(d).gjf (generated)

045106979.b3lyp_6-31g(d).firefly.inp (generated)

045106979.b3lyp_6-31g(d).smash.inp (generated)

045106979.b3lyp_6-31g(d).nwchem.inp (generated) 045106979.b3lyp_6-31g(d).log.xz 045106979.td-b3lyp_6-31g+(d).inp 045106979.td-b3lyp_6-31g+(d).log.xz

045106979.td-b3lyp_6-31+g(d).qchem.inp (generated)

045106979.td-b3lyp_6-31+g(d).gjf (generated)

045106979.td-b3lyp_6-31+g(d).firefly.inp (generated)

045106979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045106979.mol 045106979.PUBCHEM 045106979.mol (via Jmol)
045106990.b3lyp_6-31g(d).inp

045106990.b3lyp_6-31g(d).qchem.inp (generated)

045106990.b3lyp_6-31g(d).gjf (generated)

045106990.b3lyp_6-31g(d).firefly.inp (generated)

045106990.b3lyp_6-31g(d).smash.inp (generated)

045106990.b3lyp_6-31g(d).nwchem.inp (generated) 045106990.b3lyp_6-31g(d).log.xz 045106990.mol 045106990.PUBCHEM 045106990.mol (via Jmol)
045107026.b3lyp_6-31g(d).inp

045107026.b3lyp_6-31g(d).qchem.inp (generated)

045107026.b3lyp_6-31g(d).gjf (generated)

045107026.b3lyp_6-31g(d).firefly.inp (generated)

045107026.b3lyp_6-31g(d).smash.inp (generated)

045107026.b3lyp_6-31g(d).nwchem.inp (generated) 045107026.b3lyp_6-31g(d).log.xz 045107026.td-b3lyp_6-31g+(d).inp 045107026.td-b3lyp_6-31g+(d).log.xz

045107026.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107026.td-b3lyp_6-31+g(d).gjf (generated)

045107026.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107026.mol 045107026.PUBCHEM 045107026.mol (via Jmol)
045107119.b3lyp_6-31g(d).inp

045107119.b3lyp_6-31g(d).qchem.inp (generated)

045107119.b3lyp_6-31g(d).gjf (generated)

045107119.b3lyp_6-31g(d).firefly.inp (generated)

045107119.b3lyp_6-31g(d).smash.inp (generated)

045107119.b3lyp_6-31g(d).nwchem.inp (generated) 045107119.b3lyp_6-31g(d).log.xz 045107119.td-b3lyp_6-31g+(d).inp 045107119.td-b3lyp_6-31g+(d).log.xz

045107119.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107119.td-b3lyp_6-31+g(d).gjf (generated)

045107119.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107119.mol 045107119.PUBCHEM 045107119.mol (via Jmol)
045107124.b3lyp_6-31g(d).inp

045107124.b3lyp_6-31g(d).qchem.inp (generated)

045107124.b3lyp_6-31g(d).gjf (generated)

045107124.b3lyp_6-31g(d).firefly.inp (generated)

045107124.b3lyp_6-31g(d).smash.inp (generated)

045107124.b3lyp_6-31g(d).nwchem.inp (generated) 045107124.b3lyp_6-31g(d).log.xz 045107124.mol 045107124.PUBCHEM 045107124.mol (via Jmol)
045107125.b3lyp_6-31g(d).inp

045107125.b3lyp_6-31g(d).qchem.inp (generated)

045107125.b3lyp_6-31g(d).gjf (generated)

045107125.b3lyp_6-31g(d).firefly.inp (generated)

045107125.b3lyp_6-31g(d).smash.inp (generated)

045107125.b3lyp_6-31g(d).nwchem.inp (generated) 045107125.b3lyp_6-31g(d).log.xz 045107125.td-b3lyp_6-31g+(d).inp 045107125.td-b3lyp_6-31g+(d).log.xz

045107125.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107125.td-b3lyp_6-31+g(d).gjf (generated)

045107125.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107125.mol 045107125.PUBCHEM 045107125.mol (via Jmol)
045107126.b3lyp_6-31g(d).inp

045107126.b3lyp_6-31g(d).qchem.inp (generated)

045107126.b3lyp_6-31g(d).gjf (generated)

045107126.b3lyp_6-31g(d).firefly.inp (generated)

045107126.b3lyp_6-31g(d).smash.inp (generated)

045107126.b3lyp_6-31g(d).nwchem.inp (generated) 045107126.b3lyp_6-31g(d).log.xz 045107126.td-b3lyp_6-31g+(d).inp 045107126.td-b3lyp_6-31g+(d).log.xz

045107126.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107126.td-b3lyp_6-31+g(d).gjf (generated)

045107126.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107126.mol 045107126.PUBCHEM 045107126.mol (via Jmol)
045107129.b3lyp_6-31g(d).inp

045107129.b3lyp_6-31g(d).qchem.inp (generated)

045107129.b3lyp_6-31g(d).gjf (generated)

045107129.b3lyp_6-31g(d).firefly.inp (generated)

045107129.b3lyp_6-31g(d).smash.inp (generated)

045107129.b3lyp_6-31g(d).nwchem.inp (generated) 045107129.b3lyp_6-31g(d).log.xz 045107129.td-b3lyp_6-31g+(d).inp 045107129.td-b3lyp_6-31g+(d).log.xz

045107129.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107129.td-b3lyp_6-31+g(d).gjf (generated)

045107129.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107129.mol 045107129.PUBCHEM 045107129.mol (via Jmol)
045107139.b3lyp_6-31g(d).inp

045107139.b3lyp_6-31g(d).qchem.inp (generated)

045107139.b3lyp_6-31g(d).gjf (generated)

045107139.b3lyp_6-31g(d).firefly.inp (generated)

045107139.b3lyp_6-31g(d).smash.inp (generated)

045107139.b3lyp_6-31g(d).nwchem.inp (generated) 045107139.b3lyp_6-31g(d).log.xz 045107139.td-b3lyp_6-31g+(d).inp 045107139.td-b3lyp_6-31g+(d).log.xz

045107139.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107139.td-b3lyp_6-31+g(d).gjf (generated)

045107139.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107139.mol 045107139.PUBCHEM 045107139.mol (via Jmol)
045107141.b3lyp_6-31g(d).inp

045107141.b3lyp_6-31g(d).qchem.inp (generated)

045107141.b3lyp_6-31g(d).gjf (generated)

045107141.b3lyp_6-31g(d).firefly.inp (generated)

045107141.b3lyp_6-31g(d).smash.inp (generated)

045107141.b3lyp_6-31g(d).nwchem.inp (generated) 045107141.b3lyp_6-31g(d).log.xz 045107141.td-b3lyp_6-31g+(d).inp 045107141.td-b3lyp_6-31g+(d).log.xz

045107141.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107141.td-b3lyp_6-31+g(d).gjf (generated)

045107141.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107141.mol 045107141.PUBCHEM 045107141.mol (via Jmol)
045107180.b3lyp_6-31g(d).inp

045107180.b3lyp_6-31g(d).qchem.inp (generated)

045107180.b3lyp_6-31g(d).gjf (generated)

045107180.b3lyp_6-31g(d).firefly.inp (generated)

045107180.b3lyp_6-31g(d).smash.inp (generated)

045107180.b3lyp_6-31g(d).nwchem.inp (generated) 045107180.b3lyp_6-31g(d).log.xz 045107180.td-b3lyp_6-31g+(d).inp 045107180.td-b3lyp_6-31g+(d).log.xz

045107180.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107180.td-b3lyp_6-31+g(d).gjf (generated)

045107180.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107180.mol 045107180.PUBCHEM 045107180.mol (via Jmol)
045107271.b3lyp_6-31g(d).inp

045107271.b3lyp_6-31g(d).qchem.inp (generated)

045107271.b3lyp_6-31g(d).gjf (generated)

045107271.b3lyp_6-31g(d).firefly.inp (generated)

045107271.b3lyp_6-31g(d).smash.inp (generated)

045107271.b3lyp_6-31g(d).nwchem.inp (generated) 045107271.b3lyp_6-31g(d).log.xz 045107271.td-b3lyp_6-31g+(d).inp 045107271.td-b3lyp_6-31g+(d).log.xz

045107271.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107271.td-b3lyp_6-31+g(d).gjf (generated)

045107271.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107271.mol 045107271.PUBCHEM 045107271.mol (via Jmol)
045107421.b3lyp_6-31g(d).inp

045107421.b3lyp_6-31g(d).qchem.inp (generated)

045107421.b3lyp_6-31g(d).gjf (generated)

045107421.b3lyp_6-31g(d).firefly.inp (generated)

045107421.b3lyp_6-31g(d).smash.inp (generated)

045107421.b3lyp_6-31g(d).nwchem.inp (generated) 045107421.b3lyp_6-31g(d).log.xz 045107421.td-b3lyp_6-31g+(d).inp 045107421.td-b3lyp_6-31g+(d).log.xz

045107421.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107421.td-b3lyp_6-31+g(d).gjf (generated)

045107421.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107421.mol 045107421.PUBCHEM 045107421.mol (via Jmol)
045107422.b3lyp_6-31g(d).inp

045107422.b3lyp_6-31g(d).qchem.inp (generated)

045107422.b3lyp_6-31g(d).gjf (generated)

045107422.b3lyp_6-31g(d).firefly.inp (generated)

045107422.b3lyp_6-31g(d).smash.inp (generated)

045107422.b3lyp_6-31g(d).nwchem.inp (generated) 045107422.b3lyp_6-31g(d).log.xz 045107422.td-b3lyp_6-31g+(d).inp 045107422.td-b3lyp_6-31g+(d).log.xz

045107422.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107422.td-b3lyp_6-31+g(d).gjf (generated)

045107422.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107422.mol 045107422.PUBCHEM 045107422.mol (via Jmol)
045107678.b3lyp_6-31g(d).inp

045107678.b3lyp_6-31g(d).qchem.inp (generated)

045107678.b3lyp_6-31g(d).gjf (generated)

045107678.b3lyp_6-31g(d).firefly.inp (generated)

045107678.b3lyp_6-31g(d).smash.inp (generated)

045107678.b3lyp_6-31g(d).nwchem.inp (generated) 045107678.b3lyp_6-31g(d).log.xz 045107678.td-b3lyp_6-31g+(d).inp 045107678.td-b3lyp_6-31g+(d).log.xz

045107678.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107678.td-b3lyp_6-31+g(d).gjf (generated)

045107678.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107678.mol 045107678.PUBCHEM 045107678.mol (via Jmol)
045107777.b3lyp_6-31g(d).inp

045107777.b3lyp_6-31g(d).qchem.inp (generated)

045107777.b3lyp_6-31g(d).gjf (generated)

045107777.b3lyp_6-31g(d).firefly.inp (generated)

045107777.b3lyp_6-31g(d).smash.inp (generated)

045107777.b3lyp_6-31g(d).nwchem.inp (generated) 045107777.b3lyp_6-31g(d).log.xz 045107777.td-b3lyp_6-31g+(d).inp 045107777.td-b3lyp_6-31g+(d).log.xz

045107777.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107777.td-b3lyp_6-31+g(d).gjf (generated)

045107777.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107777.mol 045107777.PUBCHEM 045107777.mol (via Jmol)
045107971.b3lyp_6-31g(d).inp

045107971.b3lyp_6-31g(d).qchem.inp (generated)

045107971.b3lyp_6-31g(d).gjf (generated)

045107971.b3lyp_6-31g(d).firefly.inp (generated)

045107971.b3lyp_6-31g(d).smash.inp (generated)

045107971.b3lyp_6-31g(d).nwchem.inp (generated) 045107971.b3lyp_6-31g(d).log.xz 045107971.td-b3lyp_6-31g+(d).inp 045107971.td-b3lyp_6-31g+(d).log.xz

045107971.td-b3lyp_6-31+g(d).qchem.inp (generated)

045107971.td-b3lyp_6-31+g(d).gjf (generated)

045107971.td-b3lyp_6-31+g(d).firefly.inp (generated)

045107971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045107971.mol 045107971.PUBCHEM 045107971.mol (via Jmol)
045108157.b3lyp_6-31g(d).inp

045108157.b3lyp_6-31g(d).qchem.inp (generated)

045108157.b3lyp_6-31g(d).gjf (generated)

045108157.b3lyp_6-31g(d).firefly.inp (generated)

045108157.b3lyp_6-31g(d).smash.inp (generated)

045108157.b3lyp_6-31g(d).nwchem.inp (generated) 045108157.b3lyp_6-31g(d).log.xz 045108157.td-b3lyp_6-31g+(d).inp 045108157.td-b3lyp_6-31g+(d).log.xz

045108157.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108157.td-b3lyp_6-31+g(d).gjf (generated)

045108157.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108157.mol 045108157.PUBCHEM 045108157.mol (via Jmol)
045108163.b3lyp_6-31g(d).inp

045108163.b3lyp_6-31g(d).qchem.inp (generated)

045108163.b3lyp_6-31g(d).gjf (generated)

045108163.b3lyp_6-31g(d).firefly.inp (generated)

045108163.b3lyp_6-31g(d).smash.inp (generated)

045108163.b3lyp_6-31g(d).nwchem.inp (generated) 045108163.b3lyp_6-31g(d).log.xz 045108163.mol 045108163.PUBCHEM 045108163.mol (via Jmol)
045108165.b3lyp_6-31g(d).inp

045108165.b3lyp_6-31g(d).qchem.inp (generated)

045108165.b3lyp_6-31g(d).gjf (generated)

045108165.b3lyp_6-31g(d).firefly.inp (generated)

045108165.b3lyp_6-31g(d).smash.inp (generated)

045108165.b3lyp_6-31g(d).nwchem.inp (generated) 045108165.b3lyp_6-31g(d).log.xz 045108165.td-b3lyp_6-31g+(d).inp 045108165.td-b3lyp_6-31g+(d).log.xz

045108165.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108165.td-b3lyp_6-31+g(d).gjf (generated)

045108165.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108165.mol 045108165.PUBCHEM 045108165.mol (via Jmol)
045108168.b3lyp_6-31g(d).inp

045108168.b3lyp_6-31g(d).qchem.inp (generated)

045108168.b3lyp_6-31g(d).gjf (generated)

045108168.b3lyp_6-31g(d).firefly.inp (generated)

045108168.b3lyp_6-31g(d).smash.inp (generated)

045108168.b3lyp_6-31g(d).nwchem.inp (generated) 045108168.b3lyp_6-31g(d).log.xz 045108168.td-b3lyp_6-31g+(d).inp 045108168.td-b3lyp_6-31g+(d).log.xz

045108168.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108168.td-b3lyp_6-31+g(d).gjf (generated)

045108168.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108168.mol 045108168.PUBCHEM 045108168.mol (via Jmol)
045108171.b3lyp_6-31g(d).inp

045108171.b3lyp_6-31g(d).qchem.inp (generated)

045108171.b3lyp_6-31g(d).gjf (generated)

045108171.b3lyp_6-31g(d).firefly.inp (generated)

045108171.b3lyp_6-31g(d).smash.inp (generated)

045108171.b3lyp_6-31g(d).nwchem.inp (generated) 045108171.b3lyp_6-31g(d).log.xz 045108171.td-b3lyp_6-31g+(d).inp 045108171.td-b3lyp_6-31g+(d).log.xz

045108171.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108171.td-b3lyp_6-31+g(d).gjf (generated)

045108171.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108171.mol 045108171.PUBCHEM 045108171.mol (via Jmol)
045108179.b3lyp_6-31g(d).inp

045108179.b3lyp_6-31g(d).qchem.inp (generated)

045108179.b3lyp_6-31g(d).gjf (generated)

045108179.b3lyp_6-31g(d).firefly.inp (generated)

045108179.b3lyp_6-31g(d).smash.inp (generated)

045108179.b3lyp_6-31g(d).nwchem.inp (generated) 045108179.b3lyp_6-31g(d).log.xz 045108179.td-b3lyp_6-31g+(d).inp 045108179.td-b3lyp_6-31g+(d).log.xz

045108179.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108179.td-b3lyp_6-31+g(d).gjf (generated)

045108179.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108179.mol 045108179.PUBCHEM 045108179.mol (via Jmol)
045108181.b3lyp_6-31g(d).inp

045108181.b3lyp_6-31g(d).qchem.inp (generated)

045108181.b3lyp_6-31g(d).gjf (generated)

045108181.b3lyp_6-31g(d).firefly.inp (generated)

045108181.b3lyp_6-31g(d).smash.inp (generated)

045108181.b3lyp_6-31g(d).nwchem.inp (generated) 045108181.b3lyp_6-31g(d).log.xz 045108181.td-b3lyp_6-31g+(d).inp 045108181.td-b3lyp_6-31g+(d).log.xz

045108181.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108181.td-b3lyp_6-31+g(d).gjf (generated)

045108181.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108181.mol 045108181.PUBCHEM 045108181.mol (via Jmol)
045108182.b3lyp_6-31g(d).inp

045108182.b3lyp_6-31g(d).qchem.inp (generated)

045108182.b3lyp_6-31g(d).gjf (generated)

045108182.b3lyp_6-31g(d).firefly.inp (generated)

045108182.b3lyp_6-31g(d).smash.inp (generated)

045108182.b3lyp_6-31g(d).nwchem.inp (generated) 045108182.b3lyp_6-31g(d).log.xz 045108182.td-b3lyp_6-31g+(d).inp 045108182.td-b3lyp_6-31g+(d).log.xz

045108182.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108182.td-b3lyp_6-31+g(d).gjf (generated)

045108182.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108182.mol 045108182.PUBCHEM 045108182.mol (via Jmol)
045108184.b3lyp_6-31g(d).inp

045108184.b3lyp_6-31g(d).qchem.inp (generated)

045108184.b3lyp_6-31g(d).gjf (generated)

045108184.b3lyp_6-31g(d).firefly.inp (generated)

045108184.b3lyp_6-31g(d).smash.inp (generated)

045108184.b3lyp_6-31g(d).nwchem.inp (generated) 045108184.b3lyp_6-31g(d).log.xz 045108184.mol 045108184.PUBCHEM 045108184.mol (via Jmol)
045108186.b3lyp_6-31g(d).inp

045108186.b3lyp_6-31g(d).qchem.inp (generated)

045108186.b3lyp_6-31g(d).gjf (generated)

045108186.b3lyp_6-31g(d).firefly.inp (generated)

045108186.b3lyp_6-31g(d).smash.inp (generated)

045108186.b3lyp_6-31g(d).nwchem.inp (generated) 045108186.b3lyp_6-31g(d).log.xz 045108186.td-b3lyp_6-31g+(d).inp 045108186.td-b3lyp_6-31g+(d).log.xz

045108186.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108186.td-b3lyp_6-31+g(d).gjf (generated)

045108186.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108186.mol 045108186.PUBCHEM 045108186.mol (via Jmol)
045108187.b3lyp_6-31g(d).inp

045108187.b3lyp_6-31g(d).qchem.inp (generated)

045108187.b3lyp_6-31g(d).gjf (generated)

045108187.b3lyp_6-31g(d).firefly.inp (generated)

045108187.b3lyp_6-31g(d).smash.inp (generated)

045108187.b3lyp_6-31g(d).nwchem.inp (generated) 045108187.b3lyp_6-31g(d).log.xz 045108187.td-b3lyp_6-31g+(d).inp 045108187.td-b3lyp_6-31g+(d).log.xz

045108187.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108187.td-b3lyp_6-31+g(d).gjf (generated)

045108187.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108187.mol 045108187.PUBCHEM 045108187.mol (via Jmol)
045108188.b3lyp_6-31g(d).inp

045108188.b3lyp_6-31g(d).qchem.inp (generated)

045108188.b3lyp_6-31g(d).gjf (generated)

045108188.b3lyp_6-31g(d).firefly.inp (generated)

045108188.b3lyp_6-31g(d).smash.inp (generated)

045108188.b3lyp_6-31g(d).nwchem.inp (generated) 045108188.b3lyp_6-31g(d).log.xz 045108188.td-b3lyp_6-31g+(d).inp 045108188.td-b3lyp_6-31g+(d).log.xz

045108188.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108188.td-b3lyp_6-31+g(d).gjf (generated)

045108188.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108188.mol 045108188.PUBCHEM 045108188.mol (via Jmol)
045108189.b3lyp_6-31g(d).inp

045108189.b3lyp_6-31g(d).qchem.inp (generated)

045108189.b3lyp_6-31g(d).gjf (generated)

045108189.b3lyp_6-31g(d).firefly.inp (generated)

045108189.b3lyp_6-31g(d).smash.inp (generated)

045108189.b3lyp_6-31g(d).nwchem.inp (generated) 045108189.b3lyp_6-31g(d).log.xz 045108189.td-b3lyp_6-31g+(d).inp 045108189.td-b3lyp_6-31g+(d).log.xz

045108189.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108189.td-b3lyp_6-31+g(d).gjf (generated)

045108189.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108189.mol 045108189.PUBCHEM 045108189.mol (via Jmol)
045108190.b3lyp_6-31g(d).inp

045108190.b3lyp_6-31g(d).qchem.inp (generated)

045108190.b3lyp_6-31g(d).gjf (generated)

045108190.b3lyp_6-31g(d).firefly.inp (generated)

045108190.b3lyp_6-31g(d).smash.inp (generated)

045108190.b3lyp_6-31g(d).nwchem.inp (generated) 045108190.b3lyp_6-31g(d).log.xz 045108190.td-b3lyp_6-31g+(d).inp 045108190.td-b3lyp_6-31g+(d).log.xz

045108190.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108190.td-b3lyp_6-31+g(d).gjf (generated)

045108190.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108190.mol 045108190.PUBCHEM 045108190.mol (via Jmol)
045108191.b3lyp_6-31g(d).inp

045108191.b3lyp_6-31g(d).qchem.inp (generated)

045108191.b3lyp_6-31g(d).gjf (generated)

045108191.b3lyp_6-31g(d).firefly.inp (generated)

045108191.b3lyp_6-31g(d).smash.inp (generated)

045108191.b3lyp_6-31g(d).nwchem.inp (generated) 045108191.b3lyp_6-31g(d).log.xz 045108191.td-b3lyp_6-31g+(d).inp 045108191.td-b3lyp_6-31g+(d).log.xz

045108191.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108191.td-b3lyp_6-31+g(d).gjf (generated)

045108191.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108191.mol 045108191.PUBCHEM 045108191.mol (via Jmol)
045108193.b3lyp_6-31g(d).inp

045108193.b3lyp_6-31g(d).qchem.inp (generated)

045108193.b3lyp_6-31g(d).gjf (generated)

045108193.b3lyp_6-31g(d).firefly.inp (generated)

045108193.b3lyp_6-31g(d).smash.inp (generated)

045108193.b3lyp_6-31g(d).nwchem.inp (generated) 045108193.b3lyp_6-31g(d).log.xz 045108193.td-b3lyp_6-31g+(d).inp 045108193.td-b3lyp_6-31g+(d).log.xz

045108193.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108193.td-b3lyp_6-31+g(d).gjf (generated)

045108193.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108193.mol 045108193.PUBCHEM 045108193.mol (via Jmol)
045108194.b3lyp_6-31g(d).inp

045108194.b3lyp_6-31g(d).qchem.inp (generated)

045108194.b3lyp_6-31g(d).gjf (generated)

045108194.b3lyp_6-31g(d).firefly.inp (generated)

045108194.b3lyp_6-31g(d).smash.inp (generated)

045108194.b3lyp_6-31g(d).nwchem.inp (generated) 045108194.b3lyp_6-31g(d).log.xz 045108194.td-b3lyp_6-31g+(d).inp 045108194.td-b3lyp_6-31g+(d).log.xz

045108194.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108194.td-b3lyp_6-31+g(d).gjf (generated)

045108194.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108194.mol 045108194.PUBCHEM 045108194.mol (via Jmol)
045108195.b3lyp_6-31g(d).inp

045108195.b3lyp_6-31g(d).qchem.inp (generated)

045108195.b3lyp_6-31g(d).gjf (generated)

045108195.b3lyp_6-31g(d).firefly.inp (generated)

045108195.b3lyp_6-31g(d).smash.inp (generated)

045108195.b3lyp_6-31g(d).nwchem.inp (generated) 045108195.b3lyp_6-31g(d).log.xz 045108195.td-b3lyp_6-31g+(d).inp 045108195.td-b3lyp_6-31g+(d).log.xz

045108195.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108195.td-b3lyp_6-31+g(d).gjf (generated)

045108195.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108195.mol 045108195.PUBCHEM 045108195.mol (via Jmol)
045108196.b3lyp_6-31g(d).inp

045108196.b3lyp_6-31g(d).qchem.inp (generated)

045108196.b3lyp_6-31g(d).gjf (generated)

045108196.b3lyp_6-31g(d).firefly.inp (generated)

045108196.b3lyp_6-31g(d).smash.inp (generated)

045108196.b3lyp_6-31g(d).nwchem.inp (generated) 045108196.b3lyp_6-31g(d).log.xz 045108196.td-b3lyp_6-31g+(d).inp 045108196.td-b3lyp_6-31g+(d).log.xz

045108196.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108196.td-b3lyp_6-31+g(d).gjf (generated)

045108196.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108196.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108196.mol 045108196.PUBCHEM 045108196.mol (via Jmol)
045108200.b3lyp_6-31g(d).inp

045108200.b3lyp_6-31g(d).qchem.inp (generated)

045108200.b3lyp_6-31g(d).gjf (generated)

045108200.b3lyp_6-31g(d).firefly.inp (generated)

045108200.b3lyp_6-31g(d).smash.inp (generated)

045108200.b3lyp_6-31g(d).nwchem.inp (generated) 045108200.b3lyp_6-31g(d).log.xz 045108200.td-b3lyp_6-31g+(d).inp 045108200.td-b3lyp_6-31g+(d).log.xz

045108200.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108200.td-b3lyp_6-31+g(d).gjf (generated)

045108200.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108200.mol 045108200.PUBCHEM 045108200.mol (via Jmol)
045108201.b3lyp_6-31g(d).inp

045108201.b3lyp_6-31g(d).qchem.inp (generated)

045108201.b3lyp_6-31g(d).gjf (generated)

045108201.b3lyp_6-31g(d).firefly.inp (generated)

045108201.b3lyp_6-31g(d).smash.inp (generated)

045108201.b3lyp_6-31g(d).nwchem.inp (generated) 045108201.b3lyp_6-31g(d).log.xz 045108201.td-b3lyp_6-31g+(d).inp 045108201.td-b3lyp_6-31g+(d).log.xz

045108201.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108201.td-b3lyp_6-31+g(d).gjf (generated)

045108201.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108201.mol 045108201.PUBCHEM 045108201.mol (via Jmol)
045108205.b3lyp_6-31g(d).inp

045108205.b3lyp_6-31g(d).qchem.inp (generated)

045108205.b3lyp_6-31g(d).gjf (generated)

045108205.b3lyp_6-31g(d).firefly.inp (generated)

045108205.b3lyp_6-31g(d).smash.inp (generated)

045108205.b3lyp_6-31g(d).nwchem.inp (generated) 045108205.b3lyp_6-31g(d).log.xz 045108205.td-b3lyp_6-31g+(d).inp 045108205.td-b3lyp_6-31g+(d).log.xz

045108205.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108205.td-b3lyp_6-31+g(d).gjf (generated)

045108205.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108205.mol 045108205.PUBCHEM 045108205.mol (via Jmol)
045108208.b3lyp_6-31g(d).inp

045108208.b3lyp_6-31g(d).qchem.inp (generated)

045108208.b3lyp_6-31g(d).gjf (generated)

045108208.b3lyp_6-31g(d).firefly.inp (generated)

045108208.b3lyp_6-31g(d).smash.inp (generated)

045108208.b3lyp_6-31g(d).nwchem.inp (generated) 045108208.b3lyp_6-31g(d).log.xz 045108208.td-b3lyp_6-31g+(d).inp 045108208.td-b3lyp_6-31g+(d).log.xz

045108208.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108208.td-b3lyp_6-31+g(d).gjf (generated)

045108208.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108208.mol 045108208.PUBCHEM 045108208.mol (via Jmol)
045108209.b3lyp_6-31g(d).inp

045108209.b3lyp_6-31g(d).qchem.inp (generated)

045108209.b3lyp_6-31g(d).gjf (generated)

045108209.b3lyp_6-31g(d).firefly.inp (generated)

045108209.b3lyp_6-31g(d).smash.inp (generated)

045108209.b3lyp_6-31g(d).nwchem.inp (generated) 045108209.b3lyp_6-31g(d).log.xz 045108209.td-b3lyp_6-31g+(d).inp 045108209.td-b3lyp_6-31g+(d).log.xz

045108209.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108209.td-b3lyp_6-31+g(d).gjf (generated)

045108209.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108209.mol 045108209.PUBCHEM 045108209.mol (via Jmol)
045108215.b3lyp_6-31g(d).inp

045108215.b3lyp_6-31g(d).qchem.inp (generated)

045108215.b3lyp_6-31g(d).gjf (generated)

045108215.b3lyp_6-31g(d).firefly.inp (generated)

045108215.b3lyp_6-31g(d).smash.inp (generated)

045108215.b3lyp_6-31g(d).nwchem.inp (generated) 045108215.b3lyp_6-31g(d).log.xz 045108215.td-b3lyp_6-31g+(d).inp 045108215.td-b3lyp_6-31g+(d).log.xz

045108215.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108215.td-b3lyp_6-31+g(d).gjf (generated)

045108215.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108215.mol 045108215.PUBCHEM 045108215.mol (via Jmol)
045108228.b3lyp_6-31g(d).inp

045108228.b3lyp_6-31g(d).qchem.inp (generated)

045108228.b3lyp_6-31g(d).gjf (generated)

045108228.b3lyp_6-31g(d).firefly.inp (generated)

045108228.b3lyp_6-31g(d).smash.inp (generated)

045108228.b3lyp_6-31g(d).nwchem.inp (generated) 045108228.b3lyp_6-31g(d).log.xz 045108228.td-b3lyp_6-31g+(d).inp 045108228.td-b3lyp_6-31g+(d).log.xz

045108228.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108228.td-b3lyp_6-31+g(d).gjf (generated)

045108228.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108228.mol 045108228.PUBCHEM 045108228.mol (via Jmol)
045108229.b3lyp_6-31g(d).inp

045108229.b3lyp_6-31g(d).qchem.inp (generated)

045108229.b3lyp_6-31g(d).gjf (generated)

045108229.b3lyp_6-31g(d).firefly.inp (generated)

045108229.b3lyp_6-31g(d).smash.inp (generated)

045108229.b3lyp_6-31g(d).nwchem.inp (generated) 045108229.b3lyp_6-31g(d).log.xz 045108229.td-b3lyp_6-31g+(d).inp 045108229.td-b3lyp_6-31g+(d).log.xz

045108229.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108229.td-b3lyp_6-31+g(d).gjf (generated)

045108229.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108229.mol 045108229.PUBCHEM 045108229.mol (via Jmol)
045108266.b3lyp_6-31g(d).inp

045108266.b3lyp_6-31g(d).qchem.inp (generated)

045108266.b3lyp_6-31g(d).gjf (generated)

045108266.b3lyp_6-31g(d).firefly.inp (generated)

045108266.b3lyp_6-31g(d).smash.inp (generated)

045108266.b3lyp_6-31g(d).nwchem.inp (generated) 045108266.b3lyp_6-31g(d).log.xz 045108266.td-b3lyp_6-31g+(d).inp 045108266.td-b3lyp_6-31g+(d).log.xz

045108266.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108266.td-b3lyp_6-31+g(d).gjf (generated)

045108266.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108266.mol 045108266.PUBCHEM 045108266.mol (via Jmol)
045108270.b3lyp_6-31g(d).inp

045108270.b3lyp_6-31g(d).qchem.inp (generated)

045108270.b3lyp_6-31g(d).gjf (generated)

045108270.b3lyp_6-31g(d).firefly.inp (generated)

045108270.b3lyp_6-31g(d).smash.inp (generated)

045108270.b3lyp_6-31g(d).nwchem.inp (generated) 045108270.b3lyp_6-31g(d).log.xz 045108270.td-b3lyp_6-31g+(d).inp 045108270.td-b3lyp_6-31g+(d).log.xz

045108270.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108270.td-b3lyp_6-31+g(d).gjf (generated)

045108270.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108270.mol 045108270.PUBCHEM 045108270.mol (via Jmol)
045108271.b3lyp_6-31g(d).inp

045108271.b3lyp_6-31g(d).qchem.inp (generated)

045108271.b3lyp_6-31g(d).gjf (generated)

045108271.b3lyp_6-31g(d).firefly.inp (generated)

045108271.b3lyp_6-31g(d).smash.inp (generated)

045108271.b3lyp_6-31g(d).nwchem.inp (generated) 045108271.b3lyp_6-31g(d).log.xz 045108271.td-b3lyp_6-31g+(d).inp 045108271.td-b3lyp_6-31g+(d).log.xz

045108271.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108271.td-b3lyp_6-31+g(d).gjf (generated)

045108271.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108271.mol 045108271.PUBCHEM 045108271.mol (via Jmol)
045108273.b3lyp_6-31g(d).inp

045108273.b3lyp_6-31g(d).qchem.inp (generated)

045108273.b3lyp_6-31g(d).gjf (generated)

045108273.b3lyp_6-31g(d).firefly.inp (generated)

045108273.b3lyp_6-31g(d).smash.inp (generated)

045108273.b3lyp_6-31g(d).nwchem.inp (generated) 045108273.b3lyp_6-31g(d).log.xz 045108273.td-b3lyp_6-31g+(d).inp 045108273.td-b3lyp_6-31g+(d).log.xz

045108273.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108273.td-b3lyp_6-31+g(d).gjf (generated)

045108273.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108273.mol 045108273.PUBCHEM 045108273.mol (via Jmol)
045108274.b3lyp_6-31g(d).inp

045108274.b3lyp_6-31g(d).qchem.inp (generated)

045108274.b3lyp_6-31g(d).gjf (generated)

045108274.b3lyp_6-31g(d).firefly.inp (generated)

045108274.b3lyp_6-31g(d).smash.inp (generated)

045108274.b3lyp_6-31g(d).nwchem.inp (generated) 045108274.b3lyp_6-31g(d).log.xz 045108274.td-b3lyp_6-31g+(d).inp 045108274.td-b3lyp_6-31g+(d).log.xz

045108274.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108274.td-b3lyp_6-31+g(d).gjf (generated)

045108274.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108274.mol 045108274.PUBCHEM 045108274.mol (via Jmol)
045108281.b3lyp_6-31g(d).inp

045108281.b3lyp_6-31g(d).qchem.inp (generated)

045108281.b3lyp_6-31g(d).gjf (generated)

045108281.b3lyp_6-31g(d).firefly.inp (generated)

045108281.b3lyp_6-31g(d).smash.inp (generated)

045108281.b3lyp_6-31g(d).nwchem.inp (generated) 045108281.b3lyp_6-31g(d).log.xz 045108281.td-b3lyp_6-31g+(d).inp 045108281.td-b3lyp_6-31g+(d).log.xz

045108281.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108281.td-b3lyp_6-31+g(d).gjf (generated)

045108281.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108281.mol 045108281.PUBCHEM 045108281.mol (via Jmol)
045108288.b3lyp_6-31g(d).inp

045108288.b3lyp_6-31g(d).qchem.inp (generated)

045108288.b3lyp_6-31g(d).gjf (generated)

045108288.b3lyp_6-31g(d).firefly.inp (generated)

045108288.b3lyp_6-31g(d).smash.inp (generated)

045108288.b3lyp_6-31g(d).nwchem.inp (generated) 045108288.b3lyp_6-31g(d).log.xz 045108288.td-b3lyp_6-31g+(d).inp 045108288.td-b3lyp_6-31g+(d).log.xz

045108288.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108288.td-b3lyp_6-31+g(d).gjf (generated)

045108288.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108288.mol 045108288.PUBCHEM 045108288.mol (via Jmol)
045108290.b3lyp_6-31g(d).inp

045108290.b3lyp_6-31g(d).qchem.inp (generated)

045108290.b3lyp_6-31g(d).gjf (generated)

045108290.b3lyp_6-31g(d).firefly.inp (generated)

045108290.b3lyp_6-31g(d).smash.inp (generated)

045108290.b3lyp_6-31g(d).nwchem.inp (generated) 045108290.b3lyp_6-31g(d).log.xz 045108290.td-b3lyp_6-31g+(d).inp 045108290.td-b3lyp_6-31g+(d).log.xz

045108290.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108290.td-b3lyp_6-31+g(d).gjf (generated)

045108290.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108290.mol 045108290.PUBCHEM 045108290.mol (via Jmol)
045108294.b3lyp_6-31g(d).inp

045108294.b3lyp_6-31g(d).qchem.inp (generated)

045108294.b3lyp_6-31g(d).gjf (generated)

045108294.b3lyp_6-31g(d).firefly.inp (generated)

045108294.b3lyp_6-31g(d).smash.inp (generated)

045108294.b3lyp_6-31g(d).nwchem.inp (generated) 045108294.b3lyp_6-31g(d).log.xz 045108294.td-b3lyp_6-31g+(d).inp 045108294.td-b3lyp_6-31g+(d).log.xz

045108294.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108294.td-b3lyp_6-31+g(d).gjf (generated)

045108294.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108294.mol 045108294.PUBCHEM 045108294.mol (via Jmol)
045108295.b3lyp_6-31g(d).inp

045108295.b3lyp_6-31g(d).qchem.inp (generated)

045108295.b3lyp_6-31g(d).gjf (generated)

045108295.b3lyp_6-31g(d).firefly.inp (generated)

045108295.b3lyp_6-31g(d).smash.inp (generated)

045108295.b3lyp_6-31g(d).nwchem.inp (generated) 045108295.b3lyp_6-31g(d).log.xz 045108295.td-b3lyp_6-31g+(d).inp 045108295.td-b3lyp_6-31g+(d).log.xz

045108295.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108295.td-b3lyp_6-31+g(d).gjf (generated)

045108295.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108295.mol 045108295.PUBCHEM 045108295.mol (via Jmol)
045108297.b3lyp_6-31g(d).inp

045108297.b3lyp_6-31g(d).qchem.inp (generated)

045108297.b3lyp_6-31g(d).gjf (generated)

045108297.b3lyp_6-31g(d).firefly.inp (generated)

045108297.b3lyp_6-31g(d).smash.inp (generated)

045108297.b3lyp_6-31g(d).nwchem.inp (generated) 045108297.b3lyp_6-31g(d).log.xz 045108297.td-b3lyp_6-31g+(d).inp 045108297.td-b3lyp_6-31g+(d).log.xz

045108297.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108297.td-b3lyp_6-31+g(d).gjf (generated)

045108297.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108297.mol 045108297.PUBCHEM 045108297.mol (via Jmol)
045108301.b3lyp_6-31g(d).inp

045108301.b3lyp_6-31g(d).qchem.inp (generated)

045108301.b3lyp_6-31g(d).gjf (generated)

045108301.b3lyp_6-31g(d).firefly.inp (generated)

045108301.b3lyp_6-31g(d).smash.inp (generated)

045108301.b3lyp_6-31g(d).nwchem.inp (generated) 045108301.b3lyp_6-31g(d).log.xz 045108301.td-b3lyp_6-31g+(d).inp 045108301.td-b3lyp_6-31g+(d).log.xz

045108301.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108301.td-b3lyp_6-31+g(d).gjf (generated)

045108301.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108301.mol 045108301.PUBCHEM 045108301.mol (via Jmol)
045108303.b3lyp_6-31g(d).inp

045108303.b3lyp_6-31g(d).qchem.inp (generated)

045108303.b3lyp_6-31g(d).gjf (generated)

045108303.b3lyp_6-31g(d).firefly.inp (generated)

045108303.b3lyp_6-31g(d).smash.inp (generated)

045108303.b3lyp_6-31g(d).nwchem.inp (generated) 045108303.b3lyp_6-31g(d).log.xz 045108303.td-b3lyp_6-31g+(d).inp 045108303.td-b3lyp_6-31g+(d).log.xz

045108303.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108303.td-b3lyp_6-31+g(d).gjf (generated)

045108303.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108303.mol 045108303.PUBCHEM 045108303.mol (via Jmol)
045108310.b3lyp_6-31g(d).inp

045108310.b3lyp_6-31g(d).qchem.inp (generated)

045108310.b3lyp_6-31g(d).gjf (generated)

045108310.b3lyp_6-31g(d).firefly.inp (generated)

045108310.b3lyp_6-31g(d).smash.inp (generated)

045108310.b3lyp_6-31g(d).nwchem.inp (generated) 045108310.b3lyp_6-31g(d).log.xz 045108310.td-b3lyp_6-31g+(d).inp 045108310.td-b3lyp_6-31g+(d).log.xz

045108310.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108310.td-b3lyp_6-31+g(d).gjf (generated)

045108310.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108310.mol 045108310.PUBCHEM 045108310.mol (via Jmol)
045108311.b3lyp_6-31g(d).inp

045108311.b3lyp_6-31g(d).qchem.inp (generated)

045108311.b3lyp_6-31g(d).gjf (generated)

045108311.b3lyp_6-31g(d).firefly.inp (generated)

045108311.b3lyp_6-31g(d).smash.inp (generated)

045108311.b3lyp_6-31g(d).nwchem.inp (generated) 045108311.b3lyp_6-31g(d).log.xz 045108311.mol 045108311.PUBCHEM 045108311.mol (via Jmol)
045108313.b3lyp_6-31g(d).inp

045108313.b3lyp_6-31g(d).qchem.inp (generated)

045108313.b3lyp_6-31g(d).gjf (generated)

045108313.b3lyp_6-31g(d).firefly.inp (generated)

045108313.b3lyp_6-31g(d).smash.inp (generated)

045108313.b3lyp_6-31g(d).nwchem.inp (generated) 045108313.b3lyp_6-31g(d).log.xz 045108313.mol 045108313.PUBCHEM 045108313.mol (via Jmol)
045108314.b3lyp_6-31g(d).inp

045108314.b3lyp_6-31g(d).qchem.inp (generated)

045108314.b3lyp_6-31g(d).gjf (generated)

045108314.b3lyp_6-31g(d).firefly.inp (generated)

045108314.b3lyp_6-31g(d).smash.inp (generated)

045108314.b3lyp_6-31g(d).nwchem.inp (generated) 045108314.b3lyp_6-31g(d).log.xz 045108314.td-b3lyp_6-31g+(d).inp 045108314.td-b3lyp_6-31g+(d).log.xz

045108314.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108314.td-b3lyp_6-31+g(d).gjf (generated)

045108314.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108314.mol 045108314.PUBCHEM 045108314.mol (via Jmol)
045108316.b3lyp_6-31g(d).inp

045108316.b3lyp_6-31g(d).qchem.inp (generated)

045108316.b3lyp_6-31g(d).gjf (generated)

045108316.b3lyp_6-31g(d).firefly.inp (generated)

045108316.b3lyp_6-31g(d).smash.inp (generated)

045108316.b3lyp_6-31g(d).nwchem.inp (generated) 045108316.b3lyp_6-31g(d).log.xz 045108316.td-b3lyp_6-31g+(d).inp 045108316.td-b3lyp_6-31g+(d).log.xz

045108316.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108316.td-b3lyp_6-31+g(d).gjf (generated)

045108316.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108316.mol 045108316.PUBCHEM 045108316.mol (via Jmol)
045108322.b3lyp_6-31g(d).inp

045108322.b3lyp_6-31g(d).qchem.inp (generated)

045108322.b3lyp_6-31g(d).gjf (generated)

045108322.b3lyp_6-31g(d).firefly.inp (generated)

045108322.b3lyp_6-31g(d).smash.inp (generated)

045108322.b3lyp_6-31g(d).nwchem.inp (generated) 045108322.b3lyp_6-31g(d).log.xz 045108322.td-b3lyp_6-31g+(d).inp 045108322.td-b3lyp_6-31g+(d).log.xz

045108322.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108322.td-b3lyp_6-31+g(d).gjf (generated)

045108322.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108322.mol 045108322.PUBCHEM 045108322.mol (via Jmol)
045108324.b3lyp_6-31g(d).inp

045108324.b3lyp_6-31g(d).qchem.inp (generated)

045108324.b3lyp_6-31g(d).gjf (generated)

045108324.b3lyp_6-31g(d).firefly.inp (generated)

045108324.b3lyp_6-31g(d).smash.inp (generated)

045108324.b3lyp_6-31g(d).nwchem.inp (generated) 045108324.b3lyp_6-31g(d).log.xz 045108324.td-b3lyp_6-31g+(d).inp 045108324.td-b3lyp_6-31g+(d).log.xz

045108324.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108324.td-b3lyp_6-31+g(d).gjf (generated)

045108324.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108324.mol 045108324.PUBCHEM 045108324.mol (via Jmol)
045108325.b3lyp_6-31g(d).inp

045108325.b3lyp_6-31g(d).qchem.inp (generated)

045108325.b3lyp_6-31g(d).gjf (generated)

045108325.b3lyp_6-31g(d).firefly.inp (generated)

045108325.b3lyp_6-31g(d).smash.inp (generated)

045108325.b3lyp_6-31g(d).nwchem.inp (generated) 045108325.b3lyp_6-31g(d).log.xz 045108325.td-b3lyp_6-31g+(d).inp 045108325.td-b3lyp_6-31g+(d).log.xz

045108325.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108325.td-b3lyp_6-31+g(d).gjf (generated)

045108325.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108325.mol 045108325.PUBCHEM 045108325.mol (via Jmol)
045108330.b3lyp_6-31g(d).inp

045108330.b3lyp_6-31g(d).qchem.inp (generated)

045108330.b3lyp_6-31g(d).gjf (generated)

045108330.b3lyp_6-31g(d).firefly.inp (generated)

045108330.b3lyp_6-31g(d).smash.inp (generated)

045108330.b3lyp_6-31g(d).nwchem.inp (generated) 045108330.b3lyp_6-31g(d).log.xz 045108330.td-b3lyp_6-31g+(d).inp 045108330.td-b3lyp_6-31g+(d).log.xz

045108330.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108330.td-b3lyp_6-31+g(d).gjf (generated)

045108330.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108330.mol 045108330.PUBCHEM 045108330.mol (via Jmol)
045108331.b3lyp_6-31g(d).inp

045108331.b3lyp_6-31g(d).qchem.inp (generated)

045108331.b3lyp_6-31g(d).gjf (generated)

045108331.b3lyp_6-31g(d).firefly.inp (generated)

045108331.b3lyp_6-31g(d).smash.inp (generated)

045108331.b3lyp_6-31g(d).nwchem.inp (generated) 045108331.b3lyp_6-31g(d).log.xz 045108331.td-b3lyp_6-31g+(d).inp 045108331.td-b3lyp_6-31g+(d).log.xz

045108331.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108331.td-b3lyp_6-31+g(d).gjf (generated)

045108331.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108331.mol 045108331.PUBCHEM 045108331.mol (via Jmol)
045108332.b3lyp_6-31g(d).inp

045108332.b3lyp_6-31g(d).qchem.inp (generated)

045108332.b3lyp_6-31g(d).gjf (generated)

045108332.b3lyp_6-31g(d).firefly.inp (generated)

045108332.b3lyp_6-31g(d).smash.inp (generated)

045108332.b3lyp_6-31g(d).nwchem.inp (generated) 045108332.b3lyp_6-31g(d).log.xz 045108332.td-b3lyp_6-31g+(d).inp 045108332.td-b3lyp_6-31g+(d).log.xz

045108332.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108332.td-b3lyp_6-31+g(d).gjf (generated)

045108332.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108332.mol 045108332.PUBCHEM 045108332.mol (via Jmol)
045108339.b3lyp_6-31g(d).inp

045108339.b3lyp_6-31g(d).qchem.inp (generated)

045108339.b3lyp_6-31g(d).gjf (generated)

045108339.b3lyp_6-31g(d).firefly.inp (generated)

045108339.b3lyp_6-31g(d).smash.inp (generated)

045108339.b3lyp_6-31g(d).nwchem.inp (generated) 045108339.b3lyp_6-31g(d).log.xz 045108339.td-b3lyp_6-31g+(d).inp 045108339.td-b3lyp_6-31g+(d).log.xz

045108339.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108339.td-b3lyp_6-31+g(d).gjf (generated)

045108339.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108339.mol 045108339.PUBCHEM 045108339.mol (via Jmol)
045108341.b3lyp_6-31g(d).inp

045108341.b3lyp_6-31g(d).qchem.inp (generated)

045108341.b3lyp_6-31g(d).gjf (generated)

045108341.b3lyp_6-31g(d).firefly.inp (generated)

045108341.b3lyp_6-31g(d).smash.inp (generated)

045108341.b3lyp_6-31g(d).nwchem.inp (generated) 045108341.b3lyp_6-31g(d).log.xz 045108341.td-b3lyp_6-31g+(d).inp 045108341.td-b3lyp_6-31g+(d).log.xz

045108341.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108341.td-b3lyp_6-31+g(d).gjf (generated)

045108341.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108341.mol 045108341.PUBCHEM 045108341.mol (via Jmol)
045108342.b3lyp_6-31g(d).inp

045108342.b3lyp_6-31g(d).qchem.inp (generated)

045108342.b3lyp_6-31g(d).gjf (generated)

045108342.b3lyp_6-31g(d).firefly.inp (generated)

045108342.b3lyp_6-31g(d).smash.inp (generated)

045108342.b3lyp_6-31g(d).nwchem.inp (generated) 045108342.b3lyp_6-31g(d).log.xz 045108342.td-b3lyp_6-31g+(d).inp 045108342.td-b3lyp_6-31g+(d).log.xz

045108342.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108342.td-b3lyp_6-31+g(d).gjf (generated)

045108342.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108342.mol 045108342.PUBCHEM 045108342.mol (via Jmol)
045108349.b3lyp_6-31g(d).inp

045108349.b3lyp_6-31g(d).qchem.inp (generated)

045108349.b3lyp_6-31g(d).gjf (generated)

045108349.b3lyp_6-31g(d).firefly.inp (generated)

045108349.b3lyp_6-31g(d).smash.inp (generated)

045108349.b3lyp_6-31g(d).nwchem.inp (generated) 045108349.b3lyp_6-31g(d).log.xz 045108349.td-b3lyp_6-31g+(d).inp 045108349.td-b3lyp_6-31g+(d).log.xz

045108349.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108349.td-b3lyp_6-31+g(d).gjf (generated)

045108349.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108349.mol 045108349.PUBCHEM 045108349.mol (via Jmol)
045108350.b3lyp_6-31g(d).inp

045108350.b3lyp_6-31g(d).qchem.inp (generated)

045108350.b3lyp_6-31g(d).gjf (generated)

045108350.b3lyp_6-31g(d).firefly.inp (generated)

045108350.b3lyp_6-31g(d).smash.inp (generated)

045108350.b3lyp_6-31g(d).nwchem.inp (generated) 045108350.b3lyp_6-31g(d).log.xz 045108350.td-b3lyp_6-31g+(d).inp 045108350.td-b3lyp_6-31g+(d).log.xz

045108350.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108350.td-b3lyp_6-31+g(d).gjf (generated)

045108350.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108350.mol 045108350.PUBCHEM 045108350.mol (via Jmol)
045108351.b3lyp_6-31g(d).inp

045108351.b3lyp_6-31g(d).qchem.inp (generated)

045108351.b3lyp_6-31g(d).gjf (generated)

045108351.b3lyp_6-31g(d).firefly.inp (generated)

045108351.b3lyp_6-31g(d).smash.inp (generated)

045108351.b3lyp_6-31g(d).nwchem.inp (generated) 045108351.b3lyp_6-31g(d).log.xz 045108351.td-b3lyp_6-31g+(d).inp 045108351.td-b3lyp_6-31g+(d).log.xz

045108351.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108351.td-b3lyp_6-31+g(d).gjf (generated)

045108351.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108351.mol 045108351.PUBCHEM 045108351.mol (via Jmol)
045108352.b3lyp_6-31g(d).inp

045108352.b3lyp_6-31g(d).qchem.inp (generated)

045108352.b3lyp_6-31g(d).gjf (generated)

045108352.b3lyp_6-31g(d).firefly.inp (generated)

045108352.b3lyp_6-31g(d).smash.inp (generated)

045108352.b3lyp_6-31g(d).nwchem.inp (generated) 045108352.b3lyp_6-31g(d).log.xz 045108352.td-b3lyp_6-31g+(d).inp 045108352.td-b3lyp_6-31g+(d).log.xz

045108352.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108352.td-b3lyp_6-31+g(d).gjf (generated)

045108352.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108352.mol 045108352.PUBCHEM 045108352.mol (via Jmol)
045108353.b3lyp_6-31g(d).inp

045108353.b3lyp_6-31g(d).qchem.inp (generated)

045108353.b3lyp_6-31g(d).gjf (generated)

045108353.b3lyp_6-31g(d).firefly.inp (generated)

045108353.b3lyp_6-31g(d).smash.inp (generated)

045108353.b3lyp_6-31g(d).nwchem.inp (generated) 045108353.b3lyp_6-31g(d).log.xz 045108353.td-b3lyp_6-31g+(d).inp 045108353.td-b3lyp_6-31g+(d).log.xz

045108353.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108353.td-b3lyp_6-31+g(d).gjf (generated)

045108353.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108353.mol 045108353.PUBCHEM 045108353.mol (via Jmol)
045108355.b3lyp_6-31g(d).inp

045108355.b3lyp_6-31g(d).qchem.inp (generated)

045108355.b3lyp_6-31g(d).gjf (generated)

045108355.b3lyp_6-31g(d).firefly.inp (generated)

045108355.b3lyp_6-31g(d).smash.inp (generated)

045108355.b3lyp_6-31g(d).nwchem.inp (generated) 045108355.b3lyp_6-31g(d).log.xz 045108355.td-b3lyp_6-31g+(d).inp 045108355.td-b3lyp_6-31g+(d).log.xz

045108355.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108355.td-b3lyp_6-31+g(d).gjf (generated)

045108355.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108355.mol 045108355.PUBCHEM 045108355.mol (via Jmol)
045108356.b3lyp_6-31g(d).inp

045108356.b3lyp_6-31g(d).qchem.inp (generated)

045108356.b3lyp_6-31g(d).gjf (generated)

045108356.b3lyp_6-31g(d).firefly.inp (generated)

045108356.b3lyp_6-31g(d).smash.inp (generated)

045108356.b3lyp_6-31g(d).nwchem.inp (generated) 045108356.b3lyp_6-31g(d).log.xz 045108356.td-b3lyp_6-31g+(d).inp 045108356.td-b3lyp_6-31g+(d).log.xz

045108356.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108356.td-b3lyp_6-31+g(d).gjf (generated)

045108356.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108356.mol 045108356.PUBCHEM 045108356.mol (via Jmol)
045108358.b3lyp_6-31g(d).inp

045108358.b3lyp_6-31g(d).qchem.inp (generated)

045108358.b3lyp_6-31g(d).gjf (generated)

045108358.b3lyp_6-31g(d).firefly.inp (generated)

045108358.b3lyp_6-31g(d).smash.inp (generated)

045108358.b3lyp_6-31g(d).nwchem.inp (generated) 045108358.b3lyp_6-31g(d).log.xz 045108358.td-b3lyp_6-31g+(d).inp 045108358.td-b3lyp_6-31g+(d).log.xz

045108358.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108358.td-b3lyp_6-31+g(d).gjf (generated)

045108358.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108358.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108358.mol 045108358.PUBCHEM 045108358.mol (via Jmol)
045108361.b3lyp_6-31g(d).inp

045108361.b3lyp_6-31g(d).qchem.inp (generated)

045108361.b3lyp_6-31g(d).gjf (generated)

045108361.b3lyp_6-31g(d).firefly.inp (generated)

045108361.b3lyp_6-31g(d).smash.inp (generated)

045108361.b3lyp_6-31g(d).nwchem.inp (generated) 045108361.b3lyp_6-31g(d).log.xz 045108361.td-b3lyp_6-31g+(d).inp 045108361.td-b3lyp_6-31g+(d).log.xz

045108361.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108361.td-b3lyp_6-31+g(d).gjf (generated)

045108361.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108361.mol 045108361.PUBCHEM 045108361.mol (via Jmol)
045108362.b3lyp_6-31g(d).inp

045108362.b3lyp_6-31g(d).qchem.inp (generated)

045108362.b3lyp_6-31g(d).gjf (generated)

045108362.b3lyp_6-31g(d).firefly.inp (generated)

045108362.b3lyp_6-31g(d).smash.inp (generated)

045108362.b3lyp_6-31g(d).nwchem.inp (generated) 045108362.b3lyp_6-31g(d).log.xz 045108362.td-b3lyp_6-31g+(d).inp 045108362.td-b3lyp_6-31g+(d).log.xz

045108362.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108362.td-b3lyp_6-31+g(d).gjf (generated)

045108362.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108362.mol 045108362.PUBCHEM 045108362.mol (via Jmol)
045108376.b3lyp_6-31g(d).inp

045108376.b3lyp_6-31g(d).qchem.inp (generated)

045108376.b3lyp_6-31g(d).gjf (generated)

045108376.b3lyp_6-31g(d).firefly.inp (generated)

045108376.b3lyp_6-31g(d).smash.inp (generated)

045108376.b3lyp_6-31g(d).nwchem.inp (generated) 045108376.b3lyp_6-31g(d).log.xz 045108376.td-b3lyp_6-31g+(d).inp 045108376.td-b3lyp_6-31g+(d).log.xz

045108376.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108376.td-b3lyp_6-31+g(d).gjf (generated)

045108376.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108376.mol 045108376.PUBCHEM 045108376.mol (via Jmol)
045108442.b3lyp_6-31g(d).inp

045108442.b3lyp_6-31g(d).qchem.inp (generated)

045108442.b3lyp_6-31g(d).gjf (generated)

045108442.b3lyp_6-31g(d).firefly.inp (generated)

045108442.b3lyp_6-31g(d).smash.inp (generated)

045108442.b3lyp_6-31g(d).nwchem.inp (generated) 045108442.b3lyp_6-31g(d).log.xz 045108442.mol 045108442.PUBCHEM 045108442.mol (via Jmol)
045108886.b3lyp_6-31g(d).inp

045108886.b3lyp_6-31g(d).qchem.inp (generated)

045108886.b3lyp_6-31g(d).gjf (generated)

045108886.b3lyp_6-31g(d).firefly.inp (generated)

045108886.b3lyp_6-31g(d).smash.inp (generated)

045108886.b3lyp_6-31g(d).nwchem.inp (generated) 045108886.b3lyp_6-31g(d).log.xz 045108886.td-b3lyp_6-31g+(d).inp 045108886.td-b3lyp_6-31g+(d).log.xz

045108886.td-b3lyp_6-31+g(d).qchem.inp (generated)

045108886.td-b3lyp_6-31+g(d).gjf (generated)

045108886.td-b3lyp_6-31+g(d).firefly.inp (generated)

045108886.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045108886.mol 045108886.PUBCHEM 045108886.mol (via Jmol)
045109701.b3lyp_6-31g(d).inp

045109701.b3lyp_6-31g(d).qchem.inp (generated)

045109701.b3lyp_6-31g(d).gjf (generated)

045109701.b3lyp_6-31g(d).firefly.inp (generated)

045109701.b3lyp_6-31g(d).smash.inp (generated)

045109701.b3lyp_6-31g(d).nwchem.inp (generated) 045109701.b3lyp_6-31g(d).log.xz 045109701.td-b3lyp_6-31g+(d).inp 045109701.td-b3lyp_6-31g+(d).log.xz

045109701.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109701.td-b3lyp_6-31+g(d).gjf (generated)

045109701.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109701.mol 045109701.PUBCHEM 045109701.mol (via Jmol)
045109756.b3lyp_6-31g(d).inp

045109756.b3lyp_6-31g(d).qchem.inp (generated)

045109756.b3lyp_6-31g(d).gjf (generated)

045109756.b3lyp_6-31g(d).firefly.inp (generated)

045109756.b3lyp_6-31g(d).smash.inp (generated)

045109756.b3lyp_6-31g(d).nwchem.inp (generated) 045109756.b3lyp_6-31g(d).log.xz 045109756.td-b3lyp_6-31g+(d).inp 045109756.td-b3lyp_6-31g+(d).log.xz

045109756.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109756.td-b3lyp_6-31+g(d).gjf (generated)

045109756.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109756.mol 045109756.PUBCHEM 045109756.mol (via Jmol)
045109758.b3lyp_6-31g(d).inp

045109758.b3lyp_6-31g(d).qchem.inp (generated)

045109758.b3lyp_6-31g(d).gjf (generated)

045109758.b3lyp_6-31g(d).firefly.inp (generated)

045109758.b3lyp_6-31g(d).smash.inp (generated)

045109758.b3lyp_6-31g(d).nwchem.inp (generated) 045109758.b3lyp_6-31g(d).log.xz 045109758.mol 045109758.PUBCHEM 045109758.mol (via Jmol)
045109761.b3lyp_6-31g(d).inp

045109761.b3lyp_6-31g(d).qchem.inp (generated)

045109761.b3lyp_6-31g(d).gjf (generated)

045109761.b3lyp_6-31g(d).firefly.inp (generated)

045109761.b3lyp_6-31g(d).smash.inp (generated)

045109761.b3lyp_6-31g(d).nwchem.inp (generated) 045109761.b3lyp_6-31g(d).log.xz 045109761.td-b3lyp_6-31g+(d).inp 045109761.td-b3lyp_6-31g+(d).log.xz

045109761.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109761.td-b3lyp_6-31+g(d).gjf (generated)

045109761.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109761.mol 045109761.PUBCHEM 045109761.mol (via Jmol)
045109762.b3lyp_6-31g(d).inp

045109762.b3lyp_6-31g(d).qchem.inp (generated)

045109762.b3lyp_6-31g(d).gjf (generated)

045109762.b3lyp_6-31g(d).firefly.inp (generated)

045109762.b3lyp_6-31g(d).smash.inp (generated)

045109762.b3lyp_6-31g(d).nwchem.inp (generated) 045109762.b3lyp_6-31g(d).log.xz 045109762.td-b3lyp_6-31g+(d).inp 045109762.td-b3lyp_6-31g+(d).log.xz

045109762.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109762.td-b3lyp_6-31+g(d).gjf (generated)

045109762.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109762.mol 045109762.PUBCHEM 045109762.mol (via Jmol)
045109769.b3lyp_6-31g(d).inp

045109769.b3lyp_6-31g(d).qchem.inp (generated)

045109769.b3lyp_6-31g(d).gjf (generated)

045109769.b3lyp_6-31g(d).firefly.inp (generated)

045109769.b3lyp_6-31g(d).smash.inp (generated)

045109769.b3lyp_6-31g(d).nwchem.inp (generated) 045109769.b3lyp_6-31g(d).log.xz 045109769.td-b3lyp_6-31g+(d).inp 045109769.td-b3lyp_6-31g+(d).log.xz

045109769.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109769.td-b3lyp_6-31+g(d).gjf (generated)

045109769.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109769.mol 045109769.PUBCHEM 045109769.mol (via Jmol)
045109776.b3lyp_6-31g(d).inp

045109776.b3lyp_6-31g(d).qchem.inp (generated)

045109776.b3lyp_6-31g(d).gjf (generated)

045109776.b3lyp_6-31g(d).firefly.inp (generated)

045109776.b3lyp_6-31g(d).smash.inp (generated)

045109776.b3lyp_6-31g(d).nwchem.inp (generated) 045109776.b3lyp_6-31g(d).log.xz 045109776.td-b3lyp_6-31g+(d).inp 045109776.td-b3lyp_6-31g+(d).log.xz

045109776.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109776.td-b3lyp_6-31+g(d).gjf (generated)

045109776.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109776.mol 045109776.PUBCHEM 045109776.mol (via Jmol)
045109777.b3lyp_6-31g(d).inp

045109777.b3lyp_6-31g(d).qchem.inp (generated)

045109777.b3lyp_6-31g(d).gjf (generated)

045109777.b3lyp_6-31g(d).firefly.inp (generated)

045109777.b3lyp_6-31g(d).smash.inp (generated)

045109777.b3lyp_6-31g(d).nwchem.inp (generated) 045109777.b3lyp_6-31g(d).log.xz 045109777.td-b3lyp_6-31g+(d).inp 045109777.td-b3lyp_6-31g+(d).log.xz

045109777.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109777.td-b3lyp_6-31+g(d).gjf (generated)

045109777.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109777.mol 045109777.PUBCHEM 045109777.mol (via Jmol)
045109796.b3lyp_6-31g(d).inp

045109796.b3lyp_6-31g(d).qchem.inp (generated)

045109796.b3lyp_6-31g(d).gjf (generated)

045109796.b3lyp_6-31g(d).firefly.inp (generated)

045109796.b3lyp_6-31g(d).smash.inp (generated)

045109796.b3lyp_6-31g(d).nwchem.inp (generated) 045109796.b3lyp_6-31g(d).log.xz 045109796.td-b3lyp_6-31g+(d).inp 045109796.td-b3lyp_6-31g+(d).log.xz

045109796.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109796.td-b3lyp_6-31+g(d).gjf (generated)

045109796.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109796.mol 045109796.PUBCHEM 045109796.mol (via Jmol)
045109799.b3lyp_6-31g(d).inp

045109799.b3lyp_6-31g(d).qchem.inp (generated)

045109799.b3lyp_6-31g(d).gjf (generated)

045109799.b3lyp_6-31g(d).firefly.inp (generated)

045109799.b3lyp_6-31g(d).smash.inp (generated)

045109799.b3lyp_6-31g(d).nwchem.inp (generated) 045109799.b3lyp_6-31g(d).log.xz 045109799.td-b3lyp_6-31g+(d).inp 045109799.td-b3lyp_6-31g+(d).log.xz

045109799.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109799.td-b3lyp_6-31+g(d).gjf (generated)

045109799.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109799.mol 045109799.PUBCHEM 045109799.mol (via Jmol)
045109820.b3lyp_6-31g(d).inp

045109820.b3lyp_6-31g(d).qchem.inp (generated)

045109820.b3lyp_6-31g(d).gjf (generated)

045109820.b3lyp_6-31g(d).firefly.inp (generated)

045109820.b3lyp_6-31g(d).smash.inp (generated)

045109820.b3lyp_6-31g(d).nwchem.inp (generated) 045109820.b3lyp_6-31g(d).log.xz 045109820.td-b3lyp_6-31g+(d).inp 045109820.td-b3lyp_6-31g+(d).log.xz

045109820.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109820.td-b3lyp_6-31+g(d).gjf (generated)

045109820.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109820.mol 045109820.PUBCHEM 045109820.mol (via Jmol)
045109825.b3lyp_6-31g(d).inp

045109825.b3lyp_6-31g(d).qchem.inp (generated)

045109825.b3lyp_6-31g(d).gjf (generated)

045109825.b3lyp_6-31g(d).firefly.inp (generated)

045109825.b3lyp_6-31g(d).smash.inp (generated)

045109825.b3lyp_6-31g(d).nwchem.inp (generated) 045109825.b3lyp_6-31g(d).log.xz 045109825.td-b3lyp_6-31g+(d).inp 045109825.td-b3lyp_6-31g+(d).log.xz

045109825.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109825.td-b3lyp_6-31+g(d).gjf (generated)

045109825.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109825.mol 045109825.PUBCHEM 045109825.mol (via Jmol)
045109826.b3lyp_6-31g(d).inp

045109826.b3lyp_6-31g(d).qchem.inp (generated)

045109826.b3lyp_6-31g(d).gjf (generated)

045109826.b3lyp_6-31g(d).firefly.inp (generated)

045109826.b3lyp_6-31g(d).smash.inp (generated)

045109826.b3lyp_6-31g(d).nwchem.inp (generated) 045109826.b3lyp_6-31g(d).log.xz 045109826.td-b3lyp_6-31g+(d).inp 045109826.td-b3lyp_6-31g+(d).log.xz

045109826.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109826.td-b3lyp_6-31+g(d).gjf (generated)

045109826.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109826.mol 045109826.PUBCHEM 045109826.mol (via Jmol)
045109841.b3lyp_6-31g(d).inp

045109841.b3lyp_6-31g(d).qchem.inp (generated)

045109841.b3lyp_6-31g(d).gjf (generated)

045109841.b3lyp_6-31g(d).firefly.inp (generated)

045109841.b3lyp_6-31g(d).smash.inp (generated)

045109841.b3lyp_6-31g(d).nwchem.inp (generated) 045109841.b3lyp_6-31g(d).log.xz 045109841.td-b3lyp_6-31g+(d).inp 045109841.td-b3lyp_6-31g+(d).log.xz

045109841.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109841.td-b3lyp_6-31+g(d).gjf (generated)

045109841.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109841.mol 045109841.PUBCHEM 045109841.mol (via Jmol)
045109908.b3lyp_6-31g(d).inp

045109908.b3lyp_6-31g(d).qchem.inp (generated)

045109908.b3lyp_6-31g(d).gjf (generated)

045109908.b3lyp_6-31g(d).firefly.inp (generated)

045109908.b3lyp_6-31g(d).smash.inp (generated)

045109908.b3lyp_6-31g(d).nwchem.inp (generated) 045109908.b3lyp_6-31g(d).log.xz 045109908.td-b3lyp_6-31g+(d).inp 045109908.td-b3lyp_6-31g+(d).log.xz

045109908.td-b3lyp_6-31+g(d).qchem.inp (generated)

045109908.td-b3lyp_6-31+g(d).gjf (generated)

045109908.td-b3lyp_6-31+g(d).firefly.inp (generated)

045109908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045109908.mol 045109908.PUBCHEM 045109908.mol (via Jmol)
045110034.b3lyp_6-31g(d).inp

045110034.b3lyp_6-31g(d).qchem.inp (generated)

045110034.b3lyp_6-31g(d).gjf (generated)

045110034.b3lyp_6-31g(d).firefly.inp (generated)

045110034.b3lyp_6-31g(d).smash.inp (generated)

045110034.b3lyp_6-31g(d).nwchem.inp (generated) 045110034.b3lyp_6-31g(d).log.xz 045110034.td-b3lyp_6-31g+(d).inp 045110034.td-b3lyp_6-31g+(d).log.xz

045110034.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110034.td-b3lyp_6-31+g(d).gjf (generated)

045110034.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110034.mol 045110034.PUBCHEM 045110034.mol (via Jmol)
045110035.b3lyp_6-31g(d).inp

045110035.b3lyp_6-31g(d).qchem.inp (generated)

045110035.b3lyp_6-31g(d).gjf (generated)

045110035.b3lyp_6-31g(d).firefly.inp (generated)

045110035.b3lyp_6-31g(d).smash.inp (generated)

045110035.b3lyp_6-31g(d).nwchem.inp (generated) 045110035.b3lyp_6-31g(d).log.xz 045110035.td-b3lyp_6-31g+(d).inp 045110035.td-b3lyp_6-31g+(d).log.xz

045110035.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110035.td-b3lyp_6-31+g(d).gjf (generated)

045110035.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110035.mol 045110035.PUBCHEM 045110035.mol (via Jmol)
045110111.b3lyp_6-31g(d).inp

045110111.b3lyp_6-31g(d).qchem.inp (generated)

045110111.b3lyp_6-31g(d).gjf (generated)

045110111.b3lyp_6-31g(d).firefly.inp (generated)

045110111.b3lyp_6-31g(d).smash.inp (generated)

045110111.b3lyp_6-31g(d).nwchem.inp (generated) 045110111.b3lyp_6-31g(d).log.xz 045110111.td-b3lyp_6-31g+(d).inp 045110111.td-b3lyp_6-31g+(d).log.xz

045110111.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110111.td-b3lyp_6-31+g(d).gjf (generated)

045110111.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110111.mol 045110111.PUBCHEM 045110111.mol (via Jmol)
045110113.b3lyp_6-31g(d).inp

045110113.b3lyp_6-31g(d).qchem.inp (generated)

045110113.b3lyp_6-31g(d).gjf (generated)

045110113.b3lyp_6-31g(d).firefly.inp (generated)

045110113.b3lyp_6-31g(d).smash.inp (generated)

045110113.b3lyp_6-31g(d).nwchem.inp (generated) 045110113.b3lyp_6-31g(d).log.xz 045110113.td-b3lyp_6-31g+(d).inp 045110113.td-b3lyp_6-31g+(d).log.xz

045110113.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110113.td-b3lyp_6-31+g(d).gjf (generated)

045110113.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110113.mol 045110113.PUBCHEM 045110113.mol (via Jmol)
045110160.b3lyp_6-31g(d).inp

045110160.b3lyp_6-31g(d).qchem.inp (generated)

045110160.b3lyp_6-31g(d).gjf (generated)

045110160.b3lyp_6-31g(d).firefly.inp (generated)

045110160.b3lyp_6-31g(d).smash.inp (generated)

045110160.b3lyp_6-31g(d).nwchem.inp (generated) 045110160.b3lyp_6-31g(d).log.xz 045110160.mol 045110160.PUBCHEM 045110160.mol (via Jmol)
045110165.b3lyp_6-31g(d).inp

045110165.b3lyp_6-31g(d).qchem.inp (generated)

045110165.b3lyp_6-31g(d).gjf (generated)

045110165.b3lyp_6-31g(d).firefly.inp (generated)

045110165.b3lyp_6-31g(d).smash.inp (generated)

045110165.b3lyp_6-31g(d).nwchem.inp (generated) 045110165.b3lyp_6-31g(d).log.xz 045110165.td-b3lyp_6-31g+(d).inp 045110165.td-b3lyp_6-31g+(d).log.xz

045110165.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110165.td-b3lyp_6-31+g(d).gjf (generated)

045110165.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110165.mol 045110165.PUBCHEM 045110165.mol (via Jmol)
045110168.b3lyp_6-31g(d).inp

045110168.b3lyp_6-31g(d).qchem.inp (generated)

045110168.b3lyp_6-31g(d).gjf (generated)

045110168.b3lyp_6-31g(d).firefly.inp (generated)

045110168.b3lyp_6-31g(d).smash.inp (generated)

045110168.b3lyp_6-31g(d).nwchem.inp (generated) 045110168.b3lyp_6-31g(d).log.xz 045110168.mol 045110168.PUBCHEM 045110168.mol (via Jmol)
045110169.b3lyp_6-31g(d).inp

045110169.b3lyp_6-31g(d).qchem.inp (generated)

045110169.b3lyp_6-31g(d).gjf (generated)

045110169.b3lyp_6-31g(d).firefly.inp (generated)

045110169.b3lyp_6-31g(d).smash.inp (generated)

045110169.b3lyp_6-31g(d).nwchem.inp (generated) 045110169.b3lyp_6-31g(d).log.xz 045110169.td-b3lyp_6-31g+(d).inp 045110169.td-b3lyp_6-31g+(d).log.xz

045110169.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110169.td-b3lyp_6-31+g(d).gjf (generated)

045110169.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110169.mol 045110169.PUBCHEM 045110169.mol (via Jmol)
045110229.b3lyp_6-31g(d).inp

045110229.b3lyp_6-31g(d).qchem.inp (generated)

045110229.b3lyp_6-31g(d).gjf (generated)

045110229.b3lyp_6-31g(d).firefly.inp (generated)

045110229.b3lyp_6-31g(d).smash.inp (generated)

045110229.b3lyp_6-31g(d).nwchem.inp (generated) 045110229.b3lyp_6-31g(d).log.xz 045110229.td-b3lyp_6-31g+(d).inp 045110229.td-b3lyp_6-31g+(d).log.xz

045110229.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110229.td-b3lyp_6-31+g(d).gjf (generated)

045110229.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110229.mol 045110229.PUBCHEM 045110229.mol (via Jmol)
045110231.b3lyp_6-31g(d).inp

045110231.b3lyp_6-31g(d).qchem.inp (generated)

045110231.b3lyp_6-31g(d).gjf (generated)

045110231.b3lyp_6-31g(d).firefly.inp (generated)

045110231.b3lyp_6-31g(d).smash.inp (generated)

045110231.b3lyp_6-31g(d).nwchem.inp (generated) 045110231.b3lyp_6-31g(d).log.xz 045110231.td-b3lyp_6-31g+(d).inp 045110231.td-b3lyp_6-31g+(d).log.xz

045110231.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110231.td-b3lyp_6-31+g(d).gjf (generated)

045110231.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110231.mol 045110231.PUBCHEM 045110231.mol (via Jmol)
045110232.b3lyp_6-31g(d).inp

045110232.b3lyp_6-31g(d).qchem.inp (generated)

045110232.b3lyp_6-31g(d).gjf (generated)

045110232.b3lyp_6-31g(d).firefly.inp (generated)

045110232.b3lyp_6-31g(d).smash.inp (generated)

045110232.b3lyp_6-31g(d).nwchem.inp (generated) 045110232.b3lyp_6-31g(d).log.xz 045110232.mol 045110232.PUBCHEM 045110232.mol (via Jmol)
045110289.b3lyp_6-31g(d).inp

045110289.b3lyp_6-31g(d).qchem.inp (generated)

045110289.b3lyp_6-31g(d).gjf (generated)

045110289.b3lyp_6-31g(d).firefly.inp (generated)

045110289.b3lyp_6-31g(d).smash.inp (generated)

045110289.b3lyp_6-31g(d).nwchem.inp (generated) 045110289.b3lyp_6-31g(d).log.xz 045110289.mol 045110289.PUBCHEM 045110289.mol (via Jmol)
045110291.b3lyp_6-31g(d).inp

045110291.b3lyp_6-31g(d).qchem.inp (generated)

045110291.b3lyp_6-31g(d).gjf (generated)

045110291.b3lyp_6-31g(d).firefly.inp (generated)

045110291.b3lyp_6-31g(d).smash.inp (generated)

045110291.b3lyp_6-31g(d).nwchem.inp (generated) 045110291.b3lyp_6-31g(d).log.xz 045110291.mol 045110291.PUBCHEM 045110291.mol (via Jmol)
045110408.b3lyp_6-31g(d).inp

045110408.b3lyp_6-31g(d).qchem.inp (generated)

045110408.b3lyp_6-31g(d).gjf (generated)

045110408.b3lyp_6-31g(d).firefly.inp (generated)

045110408.b3lyp_6-31g(d).smash.inp (generated)

045110408.b3lyp_6-31g(d).nwchem.inp (generated) 045110408.b3lyp_6-31g(d).log.xz 045110408.mol 045110408.PUBCHEM 045110408.mol (via Jmol)
045110473.b3lyp_6-31g(d).inp

045110473.b3lyp_6-31g(d).qchem.inp (generated)

045110473.b3lyp_6-31g(d).gjf (generated)

045110473.b3lyp_6-31g(d).firefly.inp (generated)

045110473.b3lyp_6-31g(d).smash.inp (generated)

045110473.b3lyp_6-31g(d).nwchem.inp (generated) 045110473.b3lyp_6-31g(d).log.xz 045110473.td-b3lyp_6-31g+(d).inp 045110473.td-b3lyp_6-31g+(d).log.xz

045110473.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110473.td-b3lyp_6-31+g(d).gjf (generated)

045110473.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110473.mol 045110473.PUBCHEM 045110473.mol (via Jmol)
045110529.b3lyp_6-31g(d).inp

045110529.b3lyp_6-31g(d).qchem.inp (generated)

045110529.b3lyp_6-31g(d).gjf (generated)

045110529.b3lyp_6-31g(d).firefly.inp (generated)

045110529.b3lyp_6-31g(d).smash.inp (generated)

045110529.b3lyp_6-31g(d).nwchem.inp (generated) 045110529.b3lyp_6-31g(d).log.xz 045110529.td-b3lyp_6-31g+(d).inp 045110529.td-b3lyp_6-31g+(d).log.xz

045110529.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110529.td-b3lyp_6-31+g(d).gjf (generated)

045110529.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110529.mol 045110529.PUBCHEM 045110529.mol (via Jmol)
045110530.b3lyp_6-31g(d).inp

045110530.b3lyp_6-31g(d).qchem.inp (generated)

045110530.b3lyp_6-31g(d).gjf (generated)

045110530.b3lyp_6-31g(d).firefly.inp (generated)

045110530.b3lyp_6-31g(d).smash.inp (generated)

045110530.b3lyp_6-31g(d).nwchem.inp (generated) 045110530.b3lyp_6-31g(d).log.xz 045110530.td-b3lyp_6-31g+(d).inp 045110530.td-b3lyp_6-31g+(d).log.xz

045110530.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110530.td-b3lyp_6-31+g(d).gjf (generated)

045110530.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110530.mol 045110530.PUBCHEM 045110530.mol (via Jmol)
045110531.b3lyp_6-31g(d).inp

045110531.b3lyp_6-31g(d).qchem.inp (generated)

045110531.b3lyp_6-31g(d).gjf (generated)

045110531.b3lyp_6-31g(d).firefly.inp (generated)

045110531.b3lyp_6-31g(d).smash.inp (generated)

045110531.b3lyp_6-31g(d).nwchem.inp (generated) 045110531.b3lyp_6-31g(d).log.xz 045110531.td-b3lyp_6-31g+(d).inp 045110531.td-b3lyp_6-31g+(d).log.xz

045110531.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110531.td-b3lyp_6-31+g(d).gjf (generated)

045110531.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110531.mol 045110531.PUBCHEM 045110531.mol (via Jmol)
045110532.b3lyp_6-31g(d).inp

045110532.b3lyp_6-31g(d).qchem.inp (generated)

045110532.b3lyp_6-31g(d).gjf (generated)

045110532.b3lyp_6-31g(d).firefly.inp (generated)

045110532.b3lyp_6-31g(d).smash.inp (generated)

045110532.b3lyp_6-31g(d).nwchem.inp (generated) 045110532.b3lyp_6-31g(d).log.xz 045110532.td-b3lyp_6-31g+(d).inp 045110532.td-b3lyp_6-31g+(d).log.xz

045110532.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110532.td-b3lyp_6-31+g(d).gjf (generated)

045110532.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110532.mol 045110532.PUBCHEM 045110532.mol (via Jmol)
045110533.b3lyp_6-31g(d).inp

045110533.b3lyp_6-31g(d).qchem.inp (generated)

045110533.b3lyp_6-31g(d).gjf (generated)

045110533.b3lyp_6-31g(d).firefly.inp (generated)

045110533.b3lyp_6-31g(d).smash.inp (generated)

045110533.b3lyp_6-31g(d).nwchem.inp (generated) 045110533.b3lyp_6-31g(d).log.xz 045110533.td-b3lyp_6-31g+(d).inp 045110533.td-b3lyp_6-31g+(d).log.xz

045110533.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110533.td-b3lyp_6-31+g(d).gjf (generated)

045110533.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110533.mol 045110533.PUBCHEM 045110533.mol (via Jmol)
045110534.b3lyp_6-31g(d).inp

045110534.b3lyp_6-31g(d).qchem.inp (generated)

045110534.b3lyp_6-31g(d).gjf (generated)

045110534.b3lyp_6-31g(d).firefly.inp (generated)

045110534.b3lyp_6-31g(d).smash.inp (generated)

045110534.b3lyp_6-31g(d).nwchem.inp (generated) 045110534.b3lyp_6-31g(d).log.xz 045110534.td-b3lyp_6-31g+(d).inp 045110534.td-b3lyp_6-31g+(d).log.xz

045110534.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110534.td-b3lyp_6-31+g(d).gjf (generated)

045110534.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110534.mol 045110534.PUBCHEM 045110534.mol (via Jmol)
045110657.b3lyp_6-31g(d).inp

045110657.b3lyp_6-31g(d).qchem.inp (generated)

045110657.b3lyp_6-31g(d).gjf (generated)

045110657.b3lyp_6-31g(d).firefly.inp (generated)

045110657.b3lyp_6-31g(d).smash.inp (generated)

045110657.b3lyp_6-31g(d).nwchem.inp (generated) 045110657.b3lyp_6-31g(d).log.xz 045110657.td-b3lyp_6-31g+(d).inp 045110657.td-b3lyp_6-31g+(d).log.xz

045110657.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110657.td-b3lyp_6-31+g(d).gjf (generated)

045110657.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110657.mol 045110657.PUBCHEM 045110657.mol (via Jmol)
045110662.b3lyp_6-31g(d).inp

045110662.b3lyp_6-31g(d).qchem.inp (generated)

045110662.b3lyp_6-31g(d).gjf (generated)

045110662.b3lyp_6-31g(d).firefly.inp (generated)

045110662.b3lyp_6-31g(d).smash.inp (generated)

045110662.b3lyp_6-31g(d).nwchem.inp (generated) 045110662.b3lyp_6-31g(d).log.xz 045110662.mol 045110662.PUBCHEM 045110662.mol (via Jmol)
045110663.b3lyp_6-31g(d).inp

045110663.b3lyp_6-31g(d).qchem.inp (generated)

045110663.b3lyp_6-31g(d).gjf (generated)

045110663.b3lyp_6-31g(d).firefly.inp (generated)

045110663.b3lyp_6-31g(d).smash.inp (generated)

045110663.b3lyp_6-31g(d).nwchem.inp (generated) 045110663.b3lyp_6-31g(d).log.xz 045110663.mol 045110663.PUBCHEM 045110663.mol (via Jmol)
045110664.b3lyp_6-31g(d).inp

045110664.b3lyp_6-31g(d).qchem.inp (generated)

045110664.b3lyp_6-31g(d).gjf (generated)

045110664.b3lyp_6-31g(d).firefly.inp (generated)

045110664.b3lyp_6-31g(d).smash.inp (generated)

045110664.b3lyp_6-31g(d).nwchem.inp (generated) 045110664.b3lyp_6-31g(d).log.xz 045110664.td-b3lyp_6-31g+(d).inp 045110664.td-b3lyp_6-31g+(d).log.xz

045110664.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110664.td-b3lyp_6-31+g(d).gjf (generated)

045110664.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110664.mol 045110664.PUBCHEM 045110664.mol (via Jmol)
045110665.b3lyp_6-31g(d).inp

045110665.b3lyp_6-31g(d).qchem.inp (generated)

045110665.b3lyp_6-31g(d).gjf (generated)

045110665.b3lyp_6-31g(d).firefly.inp (generated)

045110665.b3lyp_6-31g(d).smash.inp (generated)

045110665.b3lyp_6-31g(d).nwchem.inp (generated) 045110665.b3lyp_6-31g(d).log.xz 045110665.td-b3lyp_6-31g+(d).inp 045110665.td-b3lyp_6-31g+(d).log.xz

045110665.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110665.td-b3lyp_6-31+g(d).gjf (generated)

045110665.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110665.mol 045110665.PUBCHEM 045110665.mol (via Jmol)
045110795.b3lyp_6-31g(d).inp

045110795.b3lyp_6-31g(d).qchem.inp (generated)

045110795.b3lyp_6-31g(d).gjf (generated)

045110795.b3lyp_6-31g(d).firefly.inp (generated)

045110795.b3lyp_6-31g(d).smash.inp (generated)

045110795.b3lyp_6-31g(d).nwchem.inp (generated) 045110795.b3lyp_6-31g(d).log.xz 045110795.td-b3lyp_6-31g+(d).inp 045110795.td-b3lyp_6-31g+(d).log.xz

045110795.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110795.td-b3lyp_6-31+g(d).gjf (generated)

045110795.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110795.mol 045110795.PUBCHEM 045110795.mol (via Jmol)
045110796.b3lyp_6-31g(d).inp

045110796.b3lyp_6-31g(d).qchem.inp (generated)

045110796.b3lyp_6-31g(d).gjf (generated)

045110796.b3lyp_6-31g(d).firefly.inp (generated)

045110796.b3lyp_6-31g(d).smash.inp (generated)

045110796.b3lyp_6-31g(d).nwchem.inp (generated) 045110796.b3lyp_6-31g(d).log.xz 045110796.mol 045110796.PUBCHEM 045110796.mol (via Jmol)
045110797.b3lyp_6-31g(d).inp

045110797.b3lyp_6-31g(d).qchem.inp (generated)

045110797.b3lyp_6-31g(d).gjf (generated)

045110797.b3lyp_6-31g(d).firefly.inp (generated)

045110797.b3lyp_6-31g(d).smash.inp (generated)

045110797.b3lyp_6-31g(d).nwchem.inp (generated) 045110797.b3lyp_6-31g(d).log.xz 045110797.td-b3lyp_6-31g+(d).inp 045110797.td-b3lyp_6-31g+(d).log.xz

045110797.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110797.td-b3lyp_6-31+g(d).gjf (generated)

045110797.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110797.mol 045110797.PUBCHEM 045110797.mol (via Jmol)
045110798.b3lyp_6-31g(d).inp

045110798.b3lyp_6-31g(d).qchem.inp (generated)

045110798.b3lyp_6-31g(d).gjf (generated)

045110798.b3lyp_6-31g(d).firefly.inp (generated)

045110798.b3lyp_6-31g(d).smash.inp (generated)

045110798.b3lyp_6-31g(d).nwchem.inp (generated) 045110798.b3lyp_6-31g(d).log.xz 045110798.td-b3lyp_6-31g+(d).inp 045110798.td-b3lyp_6-31g+(d).log.xz

045110798.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110798.td-b3lyp_6-31+g(d).gjf (generated)

045110798.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110798.mol 045110798.PUBCHEM 045110798.mol (via Jmol)
045110799.b3lyp_6-31g(d).inp

045110799.b3lyp_6-31g(d).qchem.inp (generated)

045110799.b3lyp_6-31g(d).gjf (generated)

045110799.b3lyp_6-31g(d).firefly.inp (generated)

045110799.b3lyp_6-31g(d).smash.inp (generated)

045110799.b3lyp_6-31g(d).nwchem.inp (generated) 045110799.b3lyp_6-31g(d).log.xz 045110799.td-b3lyp_6-31g+(d).inp 045110799.td-b3lyp_6-31g+(d).log.xz

045110799.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110799.td-b3lyp_6-31+g(d).gjf (generated)

045110799.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110799.mol 045110799.PUBCHEM 045110799.mol (via Jmol)
045110800.b3lyp_6-31g(d).inp

045110800.b3lyp_6-31g(d).qchem.inp (generated)

045110800.b3lyp_6-31g(d).gjf (generated)

045110800.b3lyp_6-31g(d).firefly.inp (generated)

045110800.b3lyp_6-31g(d).smash.inp (generated)

045110800.b3lyp_6-31g(d).nwchem.inp (generated) 045110800.b3lyp_6-31g(d).log.xz 045110800.td-b3lyp_6-31g+(d).inp 045110800.td-b3lyp_6-31g+(d).log.xz

045110800.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110800.td-b3lyp_6-31+g(d).gjf (generated)

045110800.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110800.mol 045110800.PUBCHEM 045110800.mol (via Jmol)
045110801.b3lyp_6-31g(d).inp

045110801.b3lyp_6-31g(d).qchem.inp (generated)

045110801.b3lyp_6-31g(d).gjf (generated)

045110801.b3lyp_6-31g(d).firefly.inp (generated)

045110801.b3lyp_6-31g(d).smash.inp (generated)

045110801.b3lyp_6-31g(d).nwchem.inp (generated) 045110801.b3lyp_6-31g(d).log.xz 045110801.td-b3lyp_6-31g+(d).inp 045110801.td-b3lyp_6-31g+(d).log.xz

045110801.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110801.td-b3lyp_6-31+g(d).gjf (generated)

045110801.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110801.mol 045110801.PUBCHEM 045110801.mol (via Jmol)
045110802.b3lyp_6-31g(d).inp

045110802.b3lyp_6-31g(d).qchem.inp (generated)

045110802.b3lyp_6-31g(d).gjf (generated)

045110802.b3lyp_6-31g(d).firefly.inp (generated)

045110802.b3lyp_6-31g(d).smash.inp (generated)

045110802.b3lyp_6-31g(d).nwchem.inp (generated) 045110802.b3lyp_6-31g(d).log.xz 045110802.td-b3lyp_6-31g+(d).inp 045110802.td-b3lyp_6-31g+(d).log.xz

045110802.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110802.td-b3lyp_6-31+g(d).gjf (generated)

045110802.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110802.mol 045110802.PUBCHEM 045110802.mol (via Jmol)
045110940.b3lyp_6-31g(d).inp

045110940.b3lyp_6-31g(d).qchem.inp (generated)

045110940.b3lyp_6-31g(d).gjf (generated)

045110940.b3lyp_6-31g(d).firefly.inp (generated)

045110940.b3lyp_6-31g(d).smash.inp (generated)

045110940.b3lyp_6-31g(d).nwchem.inp (generated) 045110940.b3lyp_6-31g(d).log.xz 045110940.mol 045110940.PUBCHEM 045110940.mol (via Jmol)
045110941.b3lyp_6-31g(d).inp

045110941.b3lyp_6-31g(d).qchem.inp (generated)

045110941.b3lyp_6-31g(d).gjf (generated)

045110941.b3lyp_6-31g(d).firefly.inp (generated)

045110941.b3lyp_6-31g(d).smash.inp (generated)

045110941.b3lyp_6-31g(d).nwchem.inp (generated) 045110941.b3lyp_6-31g(d).log.xz 045110941.td-b3lyp_6-31g+(d).inp 045110941.td-b3lyp_6-31g+(d).log.xz

045110941.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110941.td-b3lyp_6-31+g(d).gjf (generated)

045110941.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110941.mol 045110941.PUBCHEM 045110941.mol (via Jmol)
045110942.b3lyp_6-31g(d).inp

045110942.b3lyp_6-31g(d).qchem.inp (generated)

045110942.b3lyp_6-31g(d).gjf (generated)

045110942.b3lyp_6-31g(d).firefly.inp (generated)

045110942.b3lyp_6-31g(d).smash.inp (generated)

045110942.b3lyp_6-31g(d).nwchem.inp (generated) 045110942.b3lyp_6-31g(d).log.xz 045110942.td-b3lyp_6-31g+(d).inp 045110942.td-b3lyp_6-31g+(d).log.xz

045110942.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110942.td-b3lyp_6-31+g(d).gjf (generated)

045110942.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110942.mol 045110942.PUBCHEM 045110942.mol (via Jmol)
045110943.b3lyp_6-31g(d).inp

045110943.b3lyp_6-31g(d).qchem.inp (generated)

045110943.b3lyp_6-31g(d).gjf (generated)

045110943.b3lyp_6-31g(d).firefly.inp (generated)

045110943.b3lyp_6-31g(d).smash.inp (generated)

045110943.b3lyp_6-31g(d).nwchem.inp (generated) 045110943.b3lyp_6-31g(d).log.xz 045110943.td-b3lyp_6-31g+(d).inp 045110943.td-b3lyp_6-31g+(d).log.xz

045110943.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110943.td-b3lyp_6-31+g(d).gjf (generated)

045110943.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110943.mol 045110943.PUBCHEM 045110943.mol (via Jmol)
045110947.b3lyp_6-31g(d).inp

045110947.b3lyp_6-31g(d).qchem.inp (generated)

045110947.b3lyp_6-31g(d).gjf (generated)

045110947.b3lyp_6-31g(d).firefly.inp (generated)

045110947.b3lyp_6-31g(d).smash.inp (generated)

045110947.b3lyp_6-31g(d).nwchem.inp (generated) 045110947.b3lyp_6-31g(d).log.xz 045110947.td-b3lyp_6-31g+(d).inp 045110947.td-b3lyp_6-31g+(d).log.xz

045110947.td-b3lyp_6-31+g(d).qchem.inp (generated)

045110947.td-b3lyp_6-31+g(d).gjf (generated)

045110947.td-b3lyp_6-31+g(d).firefly.inp (generated)

045110947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045110947.mol 045110947.PUBCHEM 045110947.mol (via Jmol)
045111080.b3lyp_6-31g(d).inp

045111080.b3lyp_6-31g(d).qchem.inp (generated)

045111080.b3lyp_6-31g(d).gjf (generated)

045111080.b3lyp_6-31g(d).firefly.inp (generated)

045111080.b3lyp_6-31g(d).smash.inp (generated)

045111080.b3lyp_6-31g(d).nwchem.inp (generated) 045111080.b3lyp_6-31g(d).log.xz 045111080.td-b3lyp_6-31g+(d).inp 045111080.td-b3lyp_6-31g+(d).log.xz

045111080.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111080.td-b3lyp_6-31+g(d).gjf (generated)

045111080.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111080.mol 045111080.PUBCHEM 045111080.mol (via Jmol)
045111081.b3lyp_6-31g(d).inp

045111081.b3lyp_6-31g(d).qchem.inp (generated)

045111081.b3lyp_6-31g(d).gjf (generated)

045111081.b3lyp_6-31g(d).firefly.inp (generated)

045111081.b3lyp_6-31g(d).smash.inp (generated)

045111081.b3lyp_6-31g(d).nwchem.inp (generated) 045111081.b3lyp_6-31g(d).log.xz 045111081.td-b3lyp_6-31g+(d).inp 045111081.td-b3lyp_6-31g+(d).log.xz

045111081.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111081.td-b3lyp_6-31+g(d).gjf (generated)

045111081.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111081.mol 045111081.PUBCHEM 045111081.mol (via Jmol)
045111082.b3lyp_6-31g(d).inp

045111082.b3lyp_6-31g(d).qchem.inp (generated)

045111082.b3lyp_6-31g(d).gjf (generated)

045111082.b3lyp_6-31g(d).firefly.inp (generated)

045111082.b3lyp_6-31g(d).smash.inp (generated)

045111082.b3lyp_6-31g(d).nwchem.inp (generated) 045111082.b3lyp_6-31g(d).log.xz 045111082.mol 045111082.PUBCHEM 045111082.mol (via Jmol)
045111083.b3lyp_6-31g(d).inp

045111083.b3lyp_6-31g(d).qchem.inp (generated)

045111083.b3lyp_6-31g(d).gjf (generated)

045111083.b3lyp_6-31g(d).firefly.inp (generated)

045111083.b3lyp_6-31g(d).smash.inp (generated)

045111083.b3lyp_6-31g(d).nwchem.inp (generated) 045111083.b3lyp_6-31g(d).log.xz 045111083.td-b3lyp_6-31g+(d).inp 045111083.td-b3lyp_6-31g+(d).log.xz

045111083.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111083.td-b3lyp_6-31+g(d).gjf (generated)

045111083.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111083.mol 045111083.PUBCHEM 045111083.mol (via Jmol)
045111084.b3lyp_6-31g(d).inp

045111084.b3lyp_6-31g(d).qchem.inp (generated)

045111084.b3lyp_6-31g(d).gjf (generated)

045111084.b3lyp_6-31g(d).firefly.inp (generated)

045111084.b3lyp_6-31g(d).smash.inp (generated)

045111084.b3lyp_6-31g(d).nwchem.inp (generated) 045111084.b3lyp_6-31g(d).log.xz 045111084.td-b3lyp_6-31g+(d).inp 045111084.td-b3lyp_6-31g+(d).log.xz

045111084.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111084.td-b3lyp_6-31+g(d).gjf (generated)

045111084.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111084.mol 045111084.PUBCHEM 045111084.mol (via Jmol)
045111086.b3lyp_6-31g(d).inp

045111086.b3lyp_6-31g(d).qchem.inp (generated)

045111086.b3lyp_6-31g(d).gjf (generated)

045111086.b3lyp_6-31g(d).firefly.inp (generated)

045111086.b3lyp_6-31g(d).smash.inp (generated)

045111086.b3lyp_6-31g(d).nwchem.inp (generated) 045111086.b3lyp_6-31g(d).log.xz 045111086.td-b3lyp_6-31g+(d).inp 045111086.td-b3lyp_6-31g+(d).log.xz

045111086.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111086.td-b3lyp_6-31+g(d).gjf (generated)

045111086.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111086.mol 045111086.PUBCHEM 045111086.mol (via Jmol)
045111087.b3lyp_6-31g(d).inp

045111087.b3lyp_6-31g(d).qchem.inp (generated)

045111087.b3lyp_6-31g(d).gjf (generated)

045111087.b3lyp_6-31g(d).firefly.inp (generated)

045111087.b3lyp_6-31g(d).smash.inp (generated)

045111087.b3lyp_6-31g(d).nwchem.inp (generated) 045111087.b3lyp_6-31g(d).log.xz 045111087.td-b3lyp_6-31g+(d).inp 045111087.td-b3lyp_6-31g+(d).log.xz

045111087.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111087.td-b3lyp_6-31+g(d).gjf (generated)

045111087.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111087.mol 045111087.PUBCHEM 045111087.mol (via Jmol)
045111088.b3lyp_6-31g(d).inp

045111088.b3lyp_6-31g(d).qchem.inp (generated)

045111088.b3lyp_6-31g(d).gjf (generated)

045111088.b3lyp_6-31g(d).firefly.inp (generated)

045111088.b3lyp_6-31g(d).smash.inp (generated)

045111088.b3lyp_6-31g(d).nwchem.inp (generated) 045111088.b3lyp_6-31g(d).log.xz 045111088.td-b3lyp_6-31g+(d).inp 045111088.td-b3lyp_6-31g+(d).log.xz

045111088.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111088.td-b3lyp_6-31+g(d).gjf (generated)

045111088.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111088.mol 045111088.PUBCHEM 045111088.mol (via Jmol)
045111089.b3lyp_6-31g(d).inp

045111089.b3lyp_6-31g(d).qchem.inp (generated)

045111089.b3lyp_6-31g(d).gjf (generated)

045111089.b3lyp_6-31g(d).firefly.inp (generated)

045111089.b3lyp_6-31g(d).smash.inp (generated)

045111089.b3lyp_6-31g(d).nwchem.inp (generated) 045111089.b3lyp_6-31g(d).log.xz 045111089.td-b3lyp_6-31g+(d).inp 045111089.td-b3lyp_6-31g+(d).log.xz

045111089.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111089.td-b3lyp_6-31+g(d).gjf (generated)

045111089.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111089.mol 045111089.PUBCHEM 045111089.mol (via Jmol)
045111139.b3lyp_6-31g(d).inp

045111139.b3lyp_6-31g(d).qchem.inp (generated)

045111139.b3lyp_6-31g(d).gjf (generated)

045111139.b3lyp_6-31g(d).firefly.inp (generated)

045111139.b3lyp_6-31g(d).smash.inp (generated)

045111139.b3lyp_6-31g(d).nwchem.inp (generated) 045111139.b3lyp_6-31g(d).log.xz 045111139.td-b3lyp_6-31g+(d).inp 045111139.td-b3lyp_6-31g+(d).log.xz

045111139.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111139.td-b3lyp_6-31+g(d).gjf (generated)

045111139.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111139.mol 045111139.PUBCHEM 045111139.mol (via Jmol)
045111140.b3lyp_6-31g(d).inp

045111140.b3lyp_6-31g(d).qchem.inp (generated)

045111140.b3lyp_6-31g(d).gjf (generated)

045111140.b3lyp_6-31g(d).firefly.inp (generated)

045111140.b3lyp_6-31g(d).smash.inp (generated)

045111140.b3lyp_6-31g(d).nwchem.inp (generated) 045111140.b3lyp_6-31g(d).log.xz 045111140.td-b3lyp_6-31g+(d).inp 045111140.td-b3lyp_6-31g+(d).log.xz

045111140.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111140.td-b3lyp_6-31+g(d).gjf (generated)

045111140.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111140.mol 045111140.PUBCHEM 045111140.mol (via Jmol)
045111141.b3lyp_6-31g(d).inp

045111141.b3lyp_6-31g(d).qchem.inp (generated)

045111141.b3lyp_6-31g(d).gjf (generated)

045111141.b3lyp_6-31g(d).firefly.inp (generated)

045111141.b3lyp_6-31g(d).smash.inp (generated)

045111141.b3lyp_6-31g(d).nwchem.inp (generated) 045111141.b3lyp_6-31g(d).log.xz 045111141.td-b3lyp_6-31g+(d).inp 045111141.td-b3lyp_6-31g+(d).log.xz

045111141.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111141.td-b3lyp_6-31+g(d).gjf (generated)

045111141.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111141.mol 045111141.PUBCHEM 045111141.mol (via Jmol)
045111143.b3lyp_6-31g(d).inp

045111143.b3lyp_6-31g(d).qchem.inp (generated)

045111143.b3lyp_6-31g(d).gjf (generated)

045111143.b3lyp_6-31g(d).firefly.inp (generated)

045111143.b3lyp_6-31g(d).smash.inp (generated)

045111143.b3lyp_6-31g(d).nwchem.inp (generated) 045111143.b3lyp_6-31g(d).log.xz 045111143.td-b3lyp_6-31g+(d).inp 045111143.td-b3lyp_6-31g+(d).log.xz

045111143.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111143.td-b3lyp_6-31+g(d).gjf (generated)

045111143.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111143.mol 045111143.PUBCHEM 045111143.mol (via Jmol)
045111217.b3lyp_6-31g(d).inp

045111217.b3lyp_6-31g(d).qchem.inp (generated)

045111217.b3lyp_6-31g(d).gjf (generated)

045111217.b3lyp_6-31g(d).firefly.inp (generated)

045111217.b3lyp_6-31g(d).smash.inp (generated)

045111217.b3lyp_6-31g(d).nwchem.inp (generated) 045111217.b3lyp_6-31g(d).log.xz 045111217.mol 045111217.PUBCHEM 045111217.mol (via Jmol)
045111232.b3lyp_6-31g(d).inp

045111232.b3lyp_6-31g(d).qchem.inp (generated)

045111232.b3lyp_6-31g(d).gjf (generated)

045111232.b3lyp_6-31g(d).firefly.inp (generated)

045111232.b3lyp_6-31g(d).smash.inp (generated)

045111232.b3lyp_6-31g(d).nwchem.inp (generated) 045111232.b3lyp_6-31g(d).log.xz 045111232.td-b3lyp_6-31g+(d).inp 045111232.td-b3lyp_6-31g+(d).log.xz

045111232.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111232.td-b3lyp_6-31+g(d).gjf (generated)

045111232.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111232.mol 045111232.PUBCHEM 045111232.mol (via Jmol)
045111233.b3lyp_6-31g(d).inp

045111233.b3lyp_6-31g(d).qchem.inp (generated)

045111233.b3lyp_6-31g(d).gjf (generated)

045111233.b3lyp_6-31g(d).firefly.inp (generated)

045111233.b3lyp_6-31g(d).smash.inp (generated)

045111233.b3lyp_6-31g(d).nwchem.inp (generated) 045111233.b3lyp_6-31g(d).log.xz 045111233.td-b3lyp_6-31g+(d).inp 045111233.td-b3lyp_6-31g+(d).log.xz

045111233.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111233.td-b3lyp_6-31+g(d).gjf (generated)

045111233.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111233.mol 045111233.PUBCHEM 045111233.mol (via Jmol)
045111234.b3lyp_6-31g(d).inp

045111234.b3lyp_6-31g(d).qchem.inp (generated)

045111234.b3lyp_6-31g(d).gjf (generated)

045111234.b3lyp_6-31g(d).firefly.inp (generated)

045111234.b3lyp_6-31g(d).smash.inp (generated)

045111234.b3lyp_6-31g(d).nwchem.inp (generated) 045111234.b3lyp_6-31g(d).log.xz 045111234.td-b3lyp_6-31g+(d).inp 045111234.td-b3lyp_6-31g+(d).log.xz

045111234.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111234.td-b3lyp_6-31+g(d).gjf (generated)

045111234.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111234.mol 045111234.PUBCHEM 045111234.mol (via Jmol)
045111235.b3lyp_6-31g(d).inp

045111235.b3lyp_6-31g(d).qchem.inp (generated)

045111235.b3lyp_6-31g(d).gjf (generated)

045111235.b3lyp_6-31g(d).firefly.inp (generated)

045111235.b3lyp_6-31g(d).smash.inp (generated)

045111235.b3lyp_6-31g(d).nwchem.inp (generated) 045111235.b3lyp_6-31g(d).log.xz 045111235.td-b3lyp_6-31g+(d).inp 045111235.td-b3lyp_6-31g+(d).log.xz

045111235.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111235.td-b3lyp_6-31+g(d).gjf (generated)

045111235.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111235.mol 045111235.PUBCHEM 045111235.mol (via Jmol)
045111236.b3lyp_6-31g(d).inp

045111236.b3lyp_6-31g(d).qchem.inp (generated)

045111236.b3lyp_6-31g(d).gjf (generated)

045111236.b3lyp_6-31g(d).firefly.inp (generated)

045111236.b3lyp_6-31g(d).smash.inp (generated)

045111236.b3lyp_6-31g(d).nwchem.inp (generated) 045111236.b3lyp_6-31g(d).log.xz 045111236.td-b3lyp_6-31g+(d).inp 045111236.td-b3lyp_6-31g+(d).log.xz

045111236.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111236.td-b3lyp_6-31+g(d).gjf (generated)

045111236.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111236.mol 045111236.PUBCHEM 045111236.mol (via Jmol)
045111237.b3lyp_6-31g(d).inp

045111237.b3lyp_6-31g(d).qchem.inp (generated)

045111237.b3lyp_6-31g(d).gjf (generated)

045111237.b3lyp_6-31g(d).firefly.inp (generated)

045111237.b3lyp_6-31g(d).smash.inp (generated)

045111237.b3lyp_6-31g(d).nwchem.inp (generated) 045111237.b3lyp_6-31g(d).log.xz 045111237.td-b3lyp_6-31g+(d).inp 045111237.td-b3lyp_6-31g+(d).log.xz

045111237.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111237.td-b3lyp_6-31+g(d).gjf (generated)

045111237.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111237.mol 045111237.PUBCHEM 045111237.mol (via Jmol)
045111285.b3lyp_6-31g(d).inp

045111285.b3lyp_6-31g(d).qchem.inp (generated)

045111285.b3lyp_6-31g(d).gjf (generated)

045111285.b3lyp_6-31g(d).firefly.inp (generated)

045111285.b3lyp_6-31g(d).smash.inp (generated)

045111285.b3lyp_6-31g(d).nwchem.inp (generated) 045111285.b3lyp_6-31g(d).log.xz 045111285.mol 045111285.PUBCHEM 045111285.mol (via Jmol)
045111288.b3lyp_6-31g(d).inp

045111288.b3lyp_6-31g(d).qchem.inp (generated)

045111288.b3lyp_6-31g(d).gjf (generated)

045111288.b3lyp_6-31g(d).firefly.inp (generated)

045111288.b3lyp_6-31g(d).smash.inp (generated)

045111288.b3lyp_6-31g(d).nwchem.inp (generated) 045111288.b3lyp_6-31g(d).log.xz 045111288.mol 045111288.PUBCHEM 045111288.mol (via Jmol)
045111291.b3lyp_6-31g(d).inp

045111291.b3lyp_6-31g(d).qchem.inp (generated)

045111291.b3lyp_6-31g(d).gjf (generated)

045111291.b3lyp_6-31g(d).firefly.inp (generated)

045111291.b3lyp_6-31g(d).smash.inp (generated)

045111291.b3lyp_6-31g(d).nwchem.inp (generated) 045111291.b3lyp_6-31g(d).log.xz 045111291.td-b3lyp_6-31g+(d).inp 045111291.td-b3lyp_6-31g+(d).log.xz

045111291.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111291.td-b3lyp_6-31+g(d).gjf (generated)

045111291.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111291.mol 045111291.PUBCHEM 045111291.mol (via Jmol)
045111292.b3lyp_6-31g(d).inp

045111292.b3lyp_6-31g(d).qchem.inp (generated)

045111292.b3lyp_6-31g(d).gjf (generated)

045111292.b3lyp_6-31g(d).firefly.inp (generated)

045111292.b3lyp_6-31g(d).smash.inp (generated)

045111292.b3lyp_6-31g(d).nwchem.inp (generated) 045111292.b3lyp_6-31g(d).log.xz 045111292.td-b3lyp_6-31g+(d).inp 045111292.td-b3lyp_6-31g+(d).log.xz

045111292.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111292.td-b3lyp_6-31+g(d).gjf (generated)

045111292.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111292.mol 045111292.PUBCHEM 045111292.mol (via Jmol)
045111295.b3lyp_6-31g(d).inp

045111295.b3lyp_6-31g(d).qchem.inp (generated)

045111295.b3lyp_6-31g(d).gjf (generated)

045111295.b3lyp_6-31g(d).firefly.inp (generated)

045111295.b3lyp_6-31g(d).smash.inp (generated)

045111295.b3lyp_6-31g(d).nwchem.inp (generated) 045111295.b3lyp_6-31g(d).log.xz 045111295.mol 045111295.PUBCHEM 045111295.mol (via Jmol)
045111385.b3lyp_6-31g(d).inp

045111385.b3lyp_6-31g(d).qchem.inp (generated)

045111385.b3lyp_6-31g(d).gjf (generated)

045111385.b3lyp_6-31g(d).firefly.inp (generated)

045111385.b3lyp_6-31g(d).smash.inp (generated)

045111385.b3lyp_6-31g(d).nwchem.inp (generated) 045111385.b3lyp_6-31g(d).log.xz 045111385.mol 045111385.PUBCHEM 045111385.mol (via Jmol)
045111386.b3lyp_6-31g(d).inp

045111386.b3lyp_6-31g(d).qchem.inp (generated)

045111386.b3lyp_6-31g(d).gjf (generated)

045111386.b3lyp_6-31g(d).firefly.inp (generated)

045111386.b3lyp_6-31g(d).smash.inp (generated)

045111386.b3lyp_6-31g(d).nwchem.inp (generated) 045111386.b3lyp_6-31g(d).log.xz 045111386.mol 045111386.PUBCHEM 045111386.mol (via Jmol)
045111387.b3lyp_6-31g(d).inp

045111387.b3lyp_6-31g(d).qchem.inp (generated)

045111387.b3lyp_6-31g(d).gjf (generated)

045111387.b3lyp_6-31g(d).firefly.inp (generated)

045111387.b3lyp_6-31g(d).smash.inp (generated)

045111387.b3lyp_6-31g(d).nwchem.inp (generated) 045111387.b3lyp_6-31g(d).log.xz 045111387.td-b3lyp_6-31g+(d).inp 045111387.td-b3lyp_6-31g+(d).log.xz

045111387.td-b3lyp_6-31+g(d).qchem.inp (generated)

045111387.td-b3lyp_6-31+g(d).gjf (generated)

045111387.td-b3lyp_6-31+g(d).firefly.inp (generated)

045111387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 045111387.mol 045111387.PUBCHEM 045111387.mol (via Jmol)
045111388.b3lyp_6-31g(d).inp

045111388.b3lyp_6-31g(d).qchem.inp (generated)

045111388.b3lyp_6-31g(d).gjf (generated)

045111388.b3lyp_6-31g(d).firefly.inp (generated)