Index of

Last updated : Thu Mar 23 01:58:55 JST 2017
Total : 600 (520) in this page
004525302.b3lyp_6-31g(d).inp

004525302.b3lyp_6-31g(d).qchem.inp (generated)

004525302.b3lyp_6-31g(d).gjf (generated)

004525302.b3lyp_6-31g(d).firefly.inp (generated)

004525302.b3lyp_6-31g(d).smash.inp (generated)

004525302.b3lyp_6-31g(d).nwchem.inp (generated) 004525302.b3lyp_6-31g(d).log.xz 004525302.mol 004525302.PUBCHEM 004525302.mol (via Jmol)
004525304.b3lyp_6-31g(d).inp

004525304.b3lyp_6-31g(d).qchem.inp (generated)

004525304.b3lyp_6-31g(d).gjf (generated)

004525304.b3lyp_6-31g(d).firefly.inp (generated)

004525304.b3lyp_6-31g(d).smash.inp (generated)

004525304.b3lyp_6-31g(d).nwchem.inp (generated) 004525304.b3lyp_6-31g(d).log.xz 004525304.td-b3lyp_6-31g+(d).inp 004525304.td-b3lyp_6-31g+(d).log.xz

004525304.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525304.td-b3lyp_6-31+g(d).gjf (generated)

004525304.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525304.mol 004525304.PUBCHEM 004525304.mol (via Jmol)
004525335.b3lyp_6-31g(d).inp

004525335.b3lyp_6-31g(d).qchem.inp (generated)

004525335.b3lyp_6-31g(d).gjf (generated)

004525335.b3lyp_6-31g(d).firefly.inp (generated)

004525335.b3lyp_6-31g(d).smash.inp (generated)

004525335.b3lyp_6-31g(d).nwchem.inp (generated) 004525335.b3lyp_6-31g(d).log.xz 004525335.td-b3lyp_6-31g+(d).inp 004525335.td-b3lyp_6-31g+(d).log.xz

004525335.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525335.td-b3lyp_6-31+g(d).gjf (generated)

004525335.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525335.mol 004525335.PUBCHEM 004525335.mol (via Jmol)
004525338.b3lyp_6-31g(d).inp

004525338.b3lyp_6-31g(d).qchem.inp (generated)

004525338.b3lyp_6-31g(d).gjf (generated)

004525338.b3lyp_6-31g(d).firefly.inp (generated)

004525338.b3lyp_6-31g(d).smash.inp (generated)

004525338.b3lyp_6-31g(d).nwchem.inp (generated) 004525338.b3lyp_6-31g(d).log.xz 004525338.td-b3lyp_6-31g+(d).inp 004525338.td-b3lyp_6-31g+(d).log.xz

004525338.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525338.td-b3lyp_6-31+g(d).gjf (generated)

004525338.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525338.mol 004525338.PUBCHEM 004525338.mol (via Jmol)
004525379.b3lyp_6-31g(d).inp

004525379.b3lyp_6-31g(d).qchem.inp (generated)

004525379.b3lyp_6-31g(d).gjf (generated)

004525379.b3lyp_6-31g(d).firefly.inp (generated)

004525379.b3lyp_6-31g(d).smash.inp (generated)

004525379.b3lyp_6-31g(d).nwchem.inp (generated) 004525379.b3lyp_6-31g(d).log.xz 004525379.td-b3lyp_6-31g+(d).inp 004525379.td-b3lyp_6-31g+(d).log.xz

004525379.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525379.td-b3lyp_6-31+g(d).gjf (generated)

004525379.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525379.mol 004525379.PUBCHEM 004525379.mol (via Jmol)
004525385.b3lyp_6-31g(d).inp

004525385.b3lyp_6-31g(d).qchem.inp (generated)

004525385.b3lyp_6-31g(d).gjf (generated)

004525385.b3lyp_6-31g(d).firefly.inp (generated)

004525385.b3lyp_6-31g(d).smash.inp (generated)

004525385.b3lyp_6-31g(d).nwchem.inp (generated) 004525385.b3lyp_6-31g(d).log.xz 004525385.td-b3lyp_6-31g+(d).inp 004525385.td-b3lyp_6-31g+(d).log.xz

004525385.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525385.td-b3lyp_6-31+g(d).gjf (generated)

004525385.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525385.mol 004525385.PUBCHEM 004525385.mol (via Jmol)
004525386.b3lyp_6-31g(d).inp

004525386.b3lyp_6-31g(d).qchem.inp (generated)

004525386.b3lyp_6-31g(d).gjf (generated)

004525386.b3lyp_6-31g(d).firefly.inp (generated)

004525386.b3lyp_6-31g(d).smash.inp (generated)

004525386.b3lyp_6-31g(d).nwchem.inp (generated) 004525386.b3lyp_6-31g(d).log.xz 004525386.td-b3lyp_6-31g+(d).inp 004525386.td-b3lyp_6-31g+(d).log.xz

004525386.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525386.td-b3lyp_6-31+g(d).gjf (generated)

004525386.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525386.mol 004525386.PUBCHEM 004525386.mol (via Jmol)
004525387.b3lyp_6-31g(d).inp

004525387.b3lyp_6-31g(d).qchem.inp (generated)

004525387.b3lyp_6-31g(d).gjf (generated)

004525387.b3lyp_6-31g(d).firefly.inp (generated)

004525387.b3lyp_6-31g(d).smash.inp (generated)

004525387.b3lyp_6-31g(d).nwchem.inp (generated) 004525387.b3lyp_6-31g(d).log.xz 004525387.td-b3lyp_6-31g+(d).inp 004525387.td-b3lyp_6-31g+(d).log.xz

004525387.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525387.td-b3lyp_6-31+g(d).gjf (generated)

004525387.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525387.mol 004525387.PUBCHEM 004525387.mol (via Jmol)
004525391.b3lyp_6-31g(d).inp

004525391.b3lyp_6-31g(d).qchem.inp (generated)

004525391.b3lyp_6-31g(d).gjf (generated)

004525391.b3lyp_6-31g(d).firefly.inp (generated)

004525391.b3lyp_6-31g(d).smash.inp (generated)

004525391.b3lyp_6-31g(d).nwchem.inp (generated) 004525391.b3lyp_6-31g(d).log.xz 004525391.mol 004525391.PUBCHEM 004525391.mol (via Jmol)
004525393.b3lyp_6-31g(d).inp

004525393.b3lyp_6-31g(d).qchem.inp (generated)

004525393.b3lyp_6-31g(d).gjf (generated)

004525393.b3lyp_6-31g(d).firefly.inp (generated)

004525393.b3lyp_6-31g(d).smash.inp (generated)

004525393.b3lyp_6-31g(d).nwchem.inp (generated) 004525393.b3lyp_6-31g(d).log.xz 004525393.td-b3lyp_6-31g+(d).inp 004525393.td-b3lyp_6-31g+(d).log.xz

004525393.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525393.td-b3lyp_6-31+g(d).gjf (generated)

004525393.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525393.mol 004525393.PUBCHEM 004525393.mol (via Jmol)
004525465.b3lyp_6-31g(d).inp

004525465.b3lyp_6-31g(d).qchem.inp (generated)

004525465.b3lyp_6-31g(d).gjf (generated)

004525465.b3lyp_6-31g(d).firefly.inp (generated)

004525465.b3lyp_6-31g(d).smash.inp (generated)

004525465.b3lyp_6-31g(d).nwchem.inp (generated) 004525465.b3lyp_6-31g(d).log.xz 004525465.mol 004525465.PUBCHEM 004525465.mol (via Jmol)
004525466.b3lyp_6-31g(d).inp

004525466.b3lyp_6-31g(d).qchem.inp (generated)

004525466.b3lyp_6-31g(d).gjf (generated)

004525466.b3lyp_6-31g(d).firefly.inp (generated)

004525466.b3lyp_6-31g(d).smash.inp (generated)

004525466.b3lyp_6-31g(d).nwchem.inp (generated) 004525466.b3lyp_6-31g(d).log.xz 004525466.td-b3lyp_6-31g+(d).inp 004525466.td-b3lyp_6-31g+(d).log.xz

004525466.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525466.td-b3lyp_6-31+g(d).gjf (generated)

004525466.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525466.mol 004525466.PUBCHEM 004525466.mol (via Jmol)
004525487.b3lyp_6-31g(d).inp

004525487.b3lyp_6-31g(d).qchem.inp (generated)

004525487.b3lyp_6-31g(d).gjf (generated)

004525487.b3lyp_6-31g(d).firefly.inp (generated)

004525487.b3lyp_6-31g(d).smash.inp (generated)

004525487.b3lyp_6-31g(d).nwchem.inp (generated) 004525487.b3lyp_6-31g(d).log.xz 004525487.td-b3lyp_6-31g+(d).inp 004525487.td-b3lyp_6-31g+(d).log.xz

004525487.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525487.td-b3lyp_6-31+g(d).gjf (generated)

004525487.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525487.mol 004525487.PUBCHEM 004525487.mol (via Jmol)
004525530.b3lyp_6-31g(d).inp

004525530.b3lyp_6-31g(d).qchem.inp (generated)

004525530.b3lyp_6-31g(d).gjf (generated)

004525530.b3lyp_6-31g(d).firefly.inp (generated)

004525530.b3lyp_6-31g(d).smash.inp (generated)

004525530.b3lyp_6-31g(d).nwchem.inp (generated) 004525530.b3lyp_6-31g(d).log.xz 004525530.td-b3lyp_6-31g+(d).inp 004525530.td-b3lyp_6-31g+(d).log.xz

004525530.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525530.td-b3lyp_6-31+g(d).gjf (generated)

004525530.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525530.mol 004525530.PUBCHEM 004525530.mol (via Jmol)
004525531.b3lyp_6-31g(d).inp

004525531.b3lyp_6-31g(d).qchem.inp (generated)

004525531.b3lyp_6-31g(d).gjf (generated)

004525531.b3lyp_6-31g(d).firefly.inp (generated)

004525531.b3lyp_6-31g(d).smash.inp (generated)

004525531.b3lyp_6-31g(d).nwchem.inp (generated) 004525531.b3lyp_6-31g(d).log.xz 004525531.mol 004525531.PUBCHEM 004525531.mol (via Jmol)
004525546.b3lyp_6-31g(d).inp

004525546.b3lyp_6-31g(d).qchem.inp (generated)

004525546.b3lyp_6-31g(d).gjf (generated)

004525546.b3lyp_6-31g(d).firefly.inp (generated)

004525546.b3lyp_6-31g(d).smash.inp (generated)

004525546.b3lyp_6-31g(d).nwchem.inp (generated) 004525546.b3lyp_6-31g(d).log.xz 004525546.td-b3lyp_6-31g+(d).inp 004525546.td-b3lyp_6-31g+(d).log.xz

004525546.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525546.td-b3lyp_6-31+g(d).gjf (generated)

004525546.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525546.mol 004525546.PUBCHEM 004525546.mol (via Jmol)
004525567.b3lyp_6-31g(d).inp

004525567.b3lyp_6-31g(d).qchem.inp (generated)

004525567.b3lyp_6-31g(d).gjf (generated)

004525567.b3lyp_6-31g(d).firefly.inp (generated)

004525567.b3lyp_6-31g(d).smash.inp (generated)

004525567.b3lyp_6-31g(d).nwchem.inp (generated) 004525567.b3lyp_6-31g(d).log.xz 004525567.td-b3lyp_6-31g+(d).inp 004525567.td-b3lyp_6-31g+(d).log.xz

004525567.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525567.td-b3lyp_6-31+g(d).gjf (generated)

004525567.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525567.mol 004525567.PUBCHEM 004525567.mol (via Jmol)
004525599.b3lyp_6-31g(d).inp

004525599.b3lyp_6-31g(d).qchem.inp (generated)

004525599.b3lyp_6-31g(d).gjf (generated)

004525599.b3lyp_6-31g(d).firefly.inp (generated)

004525599.b3lyp_6-31g(d).smash.inp (generated)

004525599.b3lyp_6-31g(d).nwchem.inp (generated) 004525599.b3lyp_6-31g(d).log.xz 004525599.td-b3lyp_6-31g+(d).inp 004525599.td-b3lyp_6-31g+(d).log.xz

004525599.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525599.td-b3lyp_6-31+g(d).gjf (generated)

004525599.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525599.mol 004525599.PUBCHEM 004525599.mol (via Jmol)
004525600.b3lyp_6-31g(d).inp

004525600.b3lyp_6-31g(d).qchem.inp (generated)

004525600.b3lyp_6-31g(d).gjf (generated)

004525600.b3lyp_6-31g(d).firefly.inp (generated)

004525600.b3lyp_6-31g(d).smash.inp (generated)

004525600.b3lyp_6-31g(d).nwchem.inp (generated) 004525600.b3lyp_6-31g(d).log.xz 004525600.td-b3lyp_6-31g+(d).inp 004525600.td-b3lyp_6-31g+(d).log.xz

004525600.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525600.td-b3lyp_6-31+g(d).gjf (generated)

004525600.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525600.mol 004525600.PUBCHEM 004525600.mol (via Jmol)
004525601.b3lyp_6-31g(d).inp

004525601.b3lyp_6-31g(d).qchem.inp (generated)

004525601.b3lyp_6-31g(d).gjf (generated)

004525601.b3lyp_6-31g(d).firefly.inp (generated)

004525601.b3lyp_6-31g(d).smash.inp (generated)

004525601.b3lyp_6-31g(d).nwchem.inp (generated) 004525601.b3lyp_6-31g(d).log.xz 004525601.td-b3lyp_6-31g+(d).inp 004525601.td-b3lyp_6-31g+(d).log.xz

004525601.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525601.td-b3lyp_6-31+g(d).gjf (generated)

004525601.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525601.mol 004525601.PUBCHEM 004525601.mol (via Jmol)
004525616.b3lyp_6-31g(d).inp

004525616.b3lyp_6-31g(d).qchem.inp (generated)

004525616.b3lyp_6-31g(d).gjf (generated)

004525616.b3lyp_6-31g(d).firefly.inp (generated)

004525616.b3lyp_6-31g(d).smash.inp (generated)

004525616.b3lyp_6-31g(d).nwchem.inp (generated) 004525616.b3lyp_6-31g(d).log.xz 004525616.td-b3lyp_6-31g+(d).inp 004525616.td-b3lyp_6-31g+(d).log.xz

004525616.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525616.td-b3lyp_6-31+g(d).gjf (generated)

004525616.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525616.mol 004525616.PUBCHEM 004525616.mol (via Jmol)
004525628.b3lyp_6-31g(d).inp

004525628.b3lyp_6-31g(d).qchem.inp (generated)

004525628.b3lyp_6-31g(d).gjf (generated)

004525628.b3lyp_6-31g(d).firefly.inp (generated)

004525628.b3lyp_6-31g(d).smash.inp (generated)

004525628.b3lyp_6-31g(d).nwchem.inp (generated) 004525628.b3lyp_6-31g(d).log.xz 004525628.td-b3lyp_6-31g+(d).inp 004525628.td-b3lyp_6-31g+(d).log.xz

004525628.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525628.td-b3lyp_6-31+g(d).gjf (generated)

004525628.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525628.mol 004525628.PUBCHEM 004525628.mol (via Jmol)
004525657.b3lyp_6-31g(d).inp

004525657.b3lyp_6-31g(d).qchem.inp (generated)

004525657.b3lyp_6-31g(d).gjf (generated)

004525657.b3lyp_6-31g(d).firefly.inp (generated)

004525657.b3lyp_6-31g(d).smash.inp (generated)

004525657.b3lyp_6-31g(d).nwchem.inp (generated) 004525657.b3lyp_6-31g(d).log.xz 004525657.td-b3lyp_6-31g+(d).inp 004525657.td-b3lyp_6-31g+(d).log.xz

004525657.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525657.td-b3lyp_6-31+g(d).gjf (generated)

004525657.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525657.mol 004525657.PUBCHEM 004525657.mol (via Jmol)
004525659.b3lyp_6-31g(d).inp

004525659.b3lyp_6-31g(d).qchem.inp (generated)

004525659.b3lyp_6-31g(d).gjf (generated)

004525659.b3lyp_6-31g(d).firefly.inp (generated)

004525659.b3lyp_6-31g(d).smash.inp (generated)

004525659.b3lyp_6-31g(d).nwchem.inp (generated) 004525659.b3lyp_6-31g(d).log.xz 004525659.td-b3lyp_6-31g+(d).inp 004525659.td-b3lyp_6-31g+(d).log.xz

004525659.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525659.td-b3lyp_6-31+g(d).gjf (generated)

004525659.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525659.mol 004525659.PUBCHEM 004525659.mol (via Jmol)
004525785.b3lyp_6-31g(d).inp

004525785.b3lyp_6-31g(d).qchem.inp (generated)

004525785.b3lyp_6-31g(d).gjf (generated)

004525785.b3lyp_6-31g(d).firefly.inp (generated)

004525785.b3lyp_6-31g(d).smash.inp (generated)

004525785.b3lyp_6-31g(d).nwchem.inp (generated) 004525785.b3lyp_6-31g(d).log.xz 004525785.mol 004525785.PUBCHEM 004525785.mol (via Jmol)
004525872.b3lyp_6-31g(d).inp

004525872.b3lyp_6-31g(d).qchem.inp (generated)

004525872.b3lyp_6-31g(d).gjf (generated)

004525872.b3lyp_6-31g(d).firefly.inp (generated)

004525872.b3lyp_6-31g(d).smash.inp (generated)

004525872.b3lyp_6-31g(d).nwchem.inp (generated) 004525872.b3lyp_6-31g(d).log.xz 004525872.td-b3lyp_6-31g+(d).inp 004525872.td-b3lyp_6-31g+(d).log.xz

004525872.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525872.td-b3lyp_6-31+g(d).gjf (generated)

004525872.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525872.mol 004525872.PUBCHEM 004525872.mol (via Jmol)
004525916.b3lyp_6-31g(d).inp

004525916.b3lyp_6-31g(d).qchem.inp (generated)

004525916.b3lyp_6-31g(d).gjf (generated)

004525916.b3lyp_6-31g(d).firefly.inp (generated)

004525916.b3lyp_6-31g(d).smash.inp (generated)

004525916.b3lyp_6-31g(d).nwchem.inp (generated) 004525916.b3lyp_6-31g(d).log.xz 004525916.td-b3lyp_6-31g+(d).inp 004525916.td-b3lyp_6-31g+(d).log.xz

004525916.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525916.td-b3lyp_6-31+g(d).gjf (generated)

004525916.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525916.mol 004525916.PUBCHEM 004525916.mol (via Jmol)
004525979.b3lyp_6-31g(d).inp

004525979.b3lyp_6-31g(d).qchem.inp (generated)

004525979.b3lyp_6-31g(d).gjf (generated)

004525979.b3lyp_6-31g(d).firefly.inp (generated)

004525979.b3lyp_6-31g(d).smash.inp (generated)

004525979.b3lyp_6-31g(d).nwchem.inp (generated) 004525979.b3lyp_6-31g(d).log.xz 004525979.td-b3lyp_6-31g+(d).inp 004525979.td-b3lyp_6-31g+(d).log.xz

004525979.td-b3lyp_6-31+g(d).qchem.inp (generated)

004525979.td-b3lyp_6-31+g(d).gjf (generated)

004525979.td-b3lyp_6-31+g(d).firefly.inp (generated)

004525979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004525979.mol 004525979.PUBCHEM 004525979.mol (via Jmol)
004526058.b3lyp_6-31g(d).inp

004526058.b3lyp_6-31g(d).qchem.inp (generated)

004526058.b3lyp_6-31g(d).gjf (generated)

004526058.b3lyp_6-31g(d).firefly.inp (generated)

004526058.b3lyp_6-31g(d).smash.inp (generated)

004526058.b3lyp_6-31g(d).nwchem.inp (generated) 004526058.b3lyp_6-31g(d).log.xz 004526058.td-b3lyp_6-31g+(d).inp 004526058.td-b3lyp_6-31g+(d).log.xz

004526058.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526058.td-b3lyp_6-31+g(d).gjf (generated)

004526058.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526058.mol 004526058.PUBCHEM 004526058.mol (via Jmol)
004526063.b3lyp_6-31g(d).inp

004526063.b3lyp_6-31g(d).qchem.inp (generated)

004526063.b3lyp_6-31g(d).gjf (generated)

004526063.b3lyp_6-31g(d).firefly.inp (generated)

004526063.b3lyp_6-31g(d).smash.inp (generated)

004526063.b3lyp_6-31g(d).nwchem.inp (generated) 004526063.b3lyp_6-31g(d).log.xz 004526063.td-b3lyp_6-31g+(d).inp 004526063.td-b3lyp_6-31g+(d).log.xz

004526063.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526063.td-b3lyp_6-31+g(d).gjf (generated)

004526063.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526063.mol 004526063.PUBCHEM 004526063.mol (via Jmol)
004526103.b3lyp_6-31g(d).inp

004526103.b3lyp_6-31g(d).qchem.inp (generated)

004526103.b3lyp_6-31g(d).gjf (generated)

004526103.b3lyp_6-31g(d).firefly.inp (generated)

004526103.b3lyp_6-31g(d).smash.inp (generated)

004526103.b3lyp_6-31g(d).nwchem.inp (generated) 004526103.b3lyp_6-31g(d).log.xz 004526103.mol 004526103.PUBCHEM 004526103.mol (via Jmol)
004526156.b3lyp_6-31g(d).inp

004526156.b3lyp_6-31g(d).qchem.inp (generated)

004526156.b3lyp_6-31g(d).gjf (generated)

004526156.b3lyp_6-31g(d).firefly.inp (generated)

004526156.b3lyp_6-31g(d).smash.inp (generated)

004526156.b3lyp_6-31g(d).nwchem.inp (generated) 004526156.b3lyp_6-31g(d).log.xz 004526156.td-b3lyp_6-31g+(d).inp 004526156.td-b3lyp_6-31g+(d).log.xz

004526156.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526156.td-b3lyp_6-31+g(d).gjf (generated)

004526156.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526156.mol 004526156.PUBCHEM 004526156.mol (via Jmol)
004526166.b3lyp_6-31g(d).inp

004526166.b3lyp_6-31g(d).qchem.inp (generated)

004526166.b3lyp_6-31g(d).gjf (generated)

004526166.b3lyp_6-31g(d).firefly.inp (generated)

004526166.b3lyp_6-31g(d).smash.inp (generated)

004526166.b3lyp_6-31g(d).nwchem.inp (generated) 004526166.b3lyp_6-31g(d).log.xz 004526166.td-b3lyp_6-31g+(d).inp 004526166.td-b3lyp_6-31g+(d).log.xz

004526166.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526166.td-b3lyp_6-31+g(d).gjf (generated)

004526166.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526166.mol 004526166.PUBCHEM 004526166.mol (via Jmol)
004526218.b3lyp_6-31g(d).inp

004526218.b3lyp_6-31g(d).qchem.inp (generated)

004526218.b3lyp_6-31g(d).gjf (generated)

004526218.b3lyp_6-31g(d).firefly.inp (generated)

004526218.b3lyp_6-31g(d).smash.inp (generated)

004526218.b3lyp_6-31g(d).nwchem.inp (generated) 004526218.b3lyp_6-31g(d).log.xz 004526218.td-b3lyp_6-31g+(d).inp 004526218.td-b3lyp_6-31g+(d).log.xz

004526218.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526218.td-b3lyp_6-31+g(d).gjf (generated)

004526218.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526218.mol 004526218.PUBCHEM 004526218.mol (via Jmol)
004526222.b3lyp_6-31g(d).inp

004526222.b3lyp_6-31g(d).qchem.inp (generated)

004526222.b3lyp_6-31g(d).gjf (generated)

004526222.b3lyp_6-31g(d).firefly.inp (generated)

004526222.b3lyp_6-31g(d).smash.inp (generated)

004526222.b3lyp_6-31g(d).nwchem.inp (generated) 004526222.b3lyp_6-31g(d).log.xz 004526222.td-b3lyp_6-31g+(d).inp 004526222.td-b3lyp_6-31g+(d).log.xz

004526222.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526222.td-b3lyp_6-31+g(d).gjf (generated)

004526222.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526222.mol 004526222.PUBCHEM 004526222.mol (via Jmol)
004526293.b3lyp_6-31g(d).inp

004526293.b3lyp_6-31g(d).qchem.inp (generated)

004526293.b3lyp_6-31g(d).gjf (generated)

004526293.b3lyp_6-31g(d).firefly.inp (generated)

004526293.b3lyp_6-31g(d).smash.inp (generated)

004526293.b3lyp_6-31g(d).nwchem.inp (generated) 004526293.b3lyp_6-31g(d).log.xz 004526293.td-b3lyp_6-31g+(d).inp 004526293.td-b3lyp_6-31g+(d).log.xz

004526293.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526293.td-b3lyp_6-31+g(d).gjf (generated)

004526293.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526293.mol 004526293.PUBCHEM 004526293.mol (via Jmol)
004526344.b3lyp_6-31g(d).inp

004526344.b3lyp_6-31g(d).qchem.inp (generated)

004526344.b3lyp_6-31g(d).gjf (generated)

004526344.b3lyp_6-31g(d).firefly.inp (generated)

004526344.b3lyp_6-31g(d).smash.inp (generated)

004526344.b3lyp_6-31g(d).nwchem.inp (generated) 004526344.b3lyp_6-31g(d).log.xz 004526344.td-b3lyp_6-31g+(d).inp 004526344.td-b3lyp_6-31g+(d).log.xz

004526344.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526344.td-b3lyp_6-31+g(d).gjf (generated)

004526344.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526344.mol 004526344.PUBCHEM 004526344.mol (via Jmol)
004526384.b3lyp_6-31g(d).inp

004526384.b3lyp_6-31g(d).qchem.inp (generated)

004526384.b3lyp_6-31g(d).gjf (generated)

004526384.b3lyp_6-31g(d).firefly.inp (generated)

004526384.b3lyp_6-31g(d).smash.inp (generated)

004526384.b3lyp_6-31g(d).nwchem.inp (generated) 004526384.b3lyp_6-31g(d).log.xz 004526384.td-b3lyp_6-31g+(d).inp 004526384.td-b3lyp_6-31g+(d).log.xz

004526384.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526384.td-b3lyp_6-31+g(d).gjf (generated)

004526384.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526384.mol 004526384.PUBCHEM 004526384.mol (via Jmol)
004526392.b3lyp_6-31g(d).inp

004526392.b3lyp_6-31g(d).qchem.inp (generated)

004526392.b3lyp_6-31g(d).gjf (generated)

004526392.b3lyp_6-31g(d).firefly.inp (generated)

004526392.b3lyp_6-31g(d).smash.inp (generated)

004526392.b3lyp_6-31g(d).nwchem.inp (generated) 004526392.b3lyp_6-31g(d).log.xz 004526392.td-b3lyp_6-31g+(d).inp 004526392.td-b3lyp_6-31g+(d).log.xz

004526392.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526392.td-b3lyp_6-31+g(d).gjf (generated)

004526392.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526392.mol 004526392.PUBCHEM 004526392.mol (via Jmol)
004526493.b3lyp_6-31g(d).inp

004526493.b3lyp_6-31g(d).qchem.inp (generated)

004526493.b3lyp_6-31g(d).gjf (generated)

004526493.b3lyp_6-31g(d).firefly.inp (generated)

004526493.b3lyp_6-31g(d).smash.inp (generated)

004526493.b3lyp_6-31g(d).nwchem.inp (generated) 004526493.b3lyp_6-31g(d).log.xz 004526493.td-b3lyp_6-31g+(d).inp 004526493.td-b3lyp_6-31g+(d).log.xz

004526493.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526493.td-b3lyp_6-31+g(d).gjf (generated)

004526493.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526493.mol 004526493.PUBCHEM 004526493.mol (via Jmol)
004526530.b3lyp_6-31g(d).inp

004526530.b3lyp_6-31g(d).qchem.inp (generated)

004526530.b3lyp_6-31g(d).gjf (generated)

004526530.b3lyp_6-31g(d).firefly.inp (generated)

004526530.b3lyp_6-31g(d).smash.inp (generated)

004526530.b3lyp_6-31g(d).nwchem.inp (generated) 004526530.b3lyp_6-31g(d).log.xz 004526530.td-b3lyp_6-31g+(d).inp 004526530.td-b3lyp_6-31g+(d).log.xz

004526530.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526530.td-b3lyp_6-31+g(d).gjf (generated)

004526530.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526530.mol 004526530.PUBCHEM 004526530.mol (via Jmol)
004526596.b3lyp_6-31g(d).inp

004526596.b3lyp_6-31g(d).qchem.inp (generated)

004526596.b3lyp_6-31g(d).gjf (generated)

004526596.b3lyp_6-31g(d).firefly.inp (generated)

004526596.b3lyp_6-31g(d).smash.inp (generated)

004526596.b3lyp_6-31g(d).nwchem.inp (generated) 004526596.b3lyp_6-31g(d).log.xz 004526596.td-b3lyp_6-31g+(d).inp 004526596.td-b3lyp_6-31g+(d).log.xz

004526596.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526596.td-b3lyp_6-31+g(d).gjf (generated)

004526596.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526596.mol 004526596.PUBCHEM 004526596.mol (via Jmol)
004526597.b3lyp_6-31g(d).inp

004526597.b3lyp_6-31g(d).qchem.inp (generated)

004526597.b3lyp_6-31g(d).gjf (generated)

004526597.b3lyp_6-31g(d).firefly.inp (generated)

004526597.b3lyp_6-31g(d).smash.inp (generated)

004526597.b3lyp_6-31g(d).nwchem.inp (generated) 004526597.b3lyp_6-31g(d).log.xz 004526597.td-b3lyp_6-31g+(d).inp 004526597.td-b3lyp_6-31g+(d).log.xz

004526597.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526597.td-b3lyp_6-31+g(d).gjf (generated)

004526597.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526597.mol 004526597.PUBCHEM 004526597.mol (via Jmol)
004526629.b3lyp_6-31g(d).inp

004526629.b3lyp_6-31g(d).qchem.inp (generated)

004526629.b3lyp_6-31g(d).gjf (generated)

004526629.b3lyp_6-31g(d).firefly.inp (generated)

004526629.b3lyp_6-31g(d).smash.inp (generated)

004526629.b3lyp_6-31g(d).nwchem.inp (generated) 004526629.b3lyp_6-31g(d).log.xz 004526629.mol 004526629.PUBCHEM 004526629.mol (via Jmol)
004526636.b3lyp_6-31g(d).inp

004526636.b3lyp_6-31g(d).qchem.inp (generated)

004526636.b3lyp_6-31g(d).gjf (generated)

004526636.b3lyp_6-31g(d).firefly.inp (generated)

004526636.b3lyp_6-31g(d).smash.inp (generated)

004526636.b3lyp_6-31g(d).nwchem.inp (generated) 004526636.b3lyp_6-31g(d).log.xz 004526636.td-b3lyp_6-31g+(d).inp 004526636.td-b3lyp_6-31g+(d).log.xz

004526636.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526636.td-b3lyp_6-31+g(d).gjf (generated)

004526636.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526636.mol 004526636.PUBCHEM 004526636.mol (via Jmol)
004526745.b3lyp_6-31g(d).inp

004526745.b3lyp_6-31g(d).qchem.inp (generated)

004526745.b3lyp_6-31g(d).gjf (generated)

004526745.b3lyp_6-31g(d).firefly.inp (generated)

004526745.b3lyp_6-31g(d).smash.inp (generated)

004526745.b3lyp_6-31g(d).nwchem.inp (generated) 004526745.b3lyp_6-31g(d).log.xz 004526745.td-b3lyp_6-31g+(d).inp 004526745.td-b3lyp_6-31g+(d).log.xz

004526745.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526745.td-b3lyp_6-31+g(d).gjf (generated)

004526745.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526745.mol 004526745.PUBCHEM 004526745.mol (via Jmol)
004526749.b3lyp_6-31g(d).inp

004526749.b3lyp_6-31g(d).qchem.inp (generated)

004526749.b3lyp_6-31g(d).gjf (generated)

004526749.b3lyp_6-31g(d).firefly.inp (generated)

004526749.b3lyp_6-31g(d).smash.inp (generated)

004526749.b3lyp_6-31g(d).nwchem.inp (generated) 004526749.b3lyp_6-31g(d).log.xz 004526749.mol 004526749.PUBCHEM 004526749.mol (via Jmol)
004526799.b3lyp_6-31g(d).inp

004526799.b3lyp_6-31g(d).qchem.inp (generated)

004526799.b3lyp_6-31g(d).gjf (generated)

004526799.b3lyp_6-31g(d).firefly.inp (generated)

004526799.b3lyp_6-31g(d).smash.inp (generated)

004526799.b3lyp_6-31g(d).nwchem.inp (generated) 004526799.b3lyp_6-31g(d).log.xz 004526799.td-b3lyp_6-31g+(d).inp 004526799.td-b3lyp_6-31g+(d).log.xz

004526799.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526799.td-b3lyp_6-31+g(d).gjf (generated)

004526799.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526799.mol 004526799.PUBCHEM 004526799.mol (via Jmol)
004526805.b3lyp_6-31g(d).inp

004526805.b3lyp_6-31g(d).qchem.inp (generated)

004526805.b3lyp_6-31g(d).gjf (generated)

004526805.b3lyp_6-31g(d).firefly.inp (generated)

004526805.b3lyp_6-31g(d).smash.inp (generated)

004526805.b3lyp_6-31g(d).nwchem.inp (generated) 004526805.b3lyp_6-31g(d).log.xz 004526805.td-b3lyp_6-31g+(d).inp 004526805.td-b3lyp_6-31g+(d).log.xz

004526805.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526805.td-b3lyp_6-31+g(d).gjf (generated)

004526805.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526805.mol 004526805.PUBCHEM 004526805.mol (via Jmol)
004526829.b3lyp_6-31g(d).inp

004526829.b3lyp_6-31g(d).qchem.inp (generated)

004526829.b3lyp_6-31g(d).gjf (generated)

004526829.b3lyp_6-31g(d).firefly.inp (generated)

004526829.b3lyp_6-31g(d).smash.inp (generated)

004526829.b3lyp_6-31g(d).nwchem.inp (generated) 004526829.b3lyp_6-31g(d).log.xz 004526829.td-b3lyp_6-31g+(d).inp 004526829.td-b3lyp_6-31g+(d).log.xz

004526829.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526829.td-b3lyp_6-31+g(d).gjf (generated)

004526829.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526829.mol 004526829.PUBCHEM 004526829.mol (via Jmol)
004526863.b3lyp_6-31g(d).inp

004526863.b3lyp_6-31g(d).qchem.inp (generated)

004526863.b3lyp_6-31g(d).gjf (generated)

004526863.b3lyp_6-31g(d).firefly.inp (generated)

004526863.b3lyp_6-31g(d).smash.inp (generated)

004526863.b3lyp_6-31g(d).nwchem.inp (generated) 004526863.b3lyp_6-31g(d).log.xz 004526863.td-b3lyp_6-31g+(d).inp 004526863.td-b3lyp_6-31g+(d).log.xz

004526863.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526863.td-b3lyp_6-31+g(d).gjf (generated)

004526863.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526863.mol 004526863.PUBCHEM 004526863.mol (via Jmol)
004526890.b3lyp_6-31g(d).inp

004526890.b3lyp_6-31g(d).qchem.inp (generated)

004526890.b3lyp_6-31g(d).gjf (generated)

004526890.b3lyp_6-31g(d).firefly.inp (generated)

004526890.b3lyp_6-31g(d).smash.inp (generated)

004526890.b3lyp_6-31g(d).nwchem.inp (generated) 004526890.b3lyp_6-31g(d).log.xz 004526890.td-b3lyp_6-31g+(d).inp 004526890.td-b3lyp_6-31g+(d).log.xz

004526890.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526890.td-b3lyp_6-31+g(d).gjf (generated)

004526890.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526890.mol 004526890.PUBCHEM 004526890.mol (via Jmol)
004526893.b3lyp_6-31g(d).inp

004526893.b3lyp_6-31g(d).qchem.inp (generated)

004526893.b3lyp_6-31g(d).gjf (generated)

004526893.b3lyp_6-31g(d).firefly.inp (generated)

004526893.b3lyp_6-31g(d).smash.inp (generated)

004526893.b3lyp_6-31g(d).nwchem.inp (generated) 004526893.b3lyp_6-31g(d).log.xz 004526893.td-b3lyp_6-31g+(d).inp 004526893.td-b3lyp_6-31g+(d).log.xz

004526893.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526893.td-b3lyp_6-31+g(d).gjf (generated)

004526893.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526893.mol 004526893.PUBCHEM 004526893.mol (via Jmol)
004526902.b3lyp_6-31g(d).inp

004526902.b3lyp_6-31g(d).qchem.inp (generated)

004526902.b3lyp_6-31g(d).gjf (generated)

004526902.b3lyp_6-31g(d).firefly.inp (generated)

004526902.b3lyp_6-31g(d).smash.inp (generated)

004526902.b3lyp_6-31g(d).nwchem.inp (generated) 004526902.b3lyp_6-31g(d).log.xz 004526902.td-b3lyp_6-31g+(d).inp 004526902.td-b3lyp_6-31g+(d).log.xz

004526902.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526902.td-b3lyp_6-31+g(d).gjf (generated)

004526902.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526902.mol 004526902.PUBCHEM 004526902.mol (via Jmol)
004526904.b3lyp_6-31g(d).inp

004526904.b3lyp_6-31g(d).qchem.inp (generated)

004526904.b3lyp_6-31g(d).gjf (generated)

004526904.b3lyp_6-31g(d).firefly.inp (generated)

004526904.b3lyp_6-31g(d).smash.inp (generated)

004526904.b3lyp_6-31g(d).nwchem.inp (generated) 004526904.b3lyp_6-31g(d).log.xz 004526904.td-b3lyp_6-31g+(d).inp 004526904.td-b3lyp_6-31g+(d).log.xz

004526904.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526904.td-b3lyp_6-31+g(d).gjf (generated)

004526904.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526904.mol 004526904.PUBCHEM 004526904.mol (via Jmol)
004526905.b3lyp_6-31g(d).inp

004526905.b3lyp_6-31g(d).qchem.inp (generated)

004526905.b3lyp_6-31g(d).gjf (generated)

004526905.b3lyp_6-31g(d).firefly.inp (generated)

004526905.b3lyp_6-31g(d).smash.inp (generated)

004526905.b3lyp_6-31g(d).nwchem.inp (generated) 004526905.b3lyp_6-31g(d).log.xz 004526905.td-b3lyp_6-31g+(d).inp 004526905.td-b3lyp_6-31g+(d).log.xz

004526905.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526905.td-b3lyp_6-31+g(d).gjf (generated)

004526905.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526905.mol 004526905.PUBCHEM 004526905.mol (via Jmol)
004526910.b3lyp_6-31g(d).inp

004526910.b3lyp_6-31g(d).qchem.inp (generated)

004526910.b3lyp_6-31g(d).gjf (generated)

004526910.b3lyp_6-31g(d).firefly.inp (generated)

004526910.b3lyp_6-31g(d).smash.inp (generated)

004526910.b3lyp_6-31g(d).nwchem.inp (generated) 004526910.b3lyp_6-31g(d).log.xz 004526910.td-b3lyp_6-31g+(d).inp 004526910.td-b3lyp_6-31g+(d).log.xz

004526910.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526910.td-b3lyp_6-31+g(d).gjf (generated)

004526910.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526910.mol 004526910.PUBCHEM 004526910.mol (via Jmol)
004526987.b3lyp_6-31g(d).inp

004526987.b3lyp_6-31g(d).qchem.inp (generated)

004526987.b3lyp_6-31g(d).gjf (generated)

004526987.b3lyp_6-31g(d).firefly.inp (generated)

004526987.b3lyp_6-31g(d).smash.inp (generated)

004526987.b3lyp_6-31g(d).nwchem.inp (generated) 004526987.b3lyp_6-31g(d).log.xz 004526987.td-b3lyp_6-31g+(d).inp 004526987.td-b3lyp_6-31g+(d).log.xz

004526987.td-b3lyp_6-31+g(d).qchem.inp (generated)

004526987.td-b3lyp_6-31+g(d).gjf (generated)

004526987.td-b3lyp_6-31+g(d).firefly.inp (generated)

004526987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004526987.mol 004526987.PUBCHEM 004526987.mol (via Jmol)
004527004.b3lyp_6-31g(d).inp

004527004.b3lyp_6-31g(d).qchem.inp (generated)

004527004.b3lyp_6-31g(d).gjf (generated)

004527004.b3lyp_6-31g(d).firefly.inp (generated)

004527004.b3lyp_6-31g(d).smash.inp (generated)

004527004.b3lyp_6-31g(d).nwchem.inp (generated) 004527004.b3lyp_6-31g(d).log.xz 004527004.td-b3lyp_6-31g+(d).inp 004527004.td-b3lyp_6-31g+(d).log.xz

004527004.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527004.td-b3lyp_6-31+g(d).gjf (generated)

004527004.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527004.mol 004527004.PUBCHEM 004527004.mol (via Jmol)
004527006.b3lyp_6-31g(d).inp

004527006.b3lyp_6-31g(d).qchem.inp (generated)

004527006.b3lyp_6-31g(d).gjf (generated)

004527006.b3lyp_6-31g(d).firefly.inp (generated)

004527006.b3lyp_6-31g(d).smash.inp (generated)

004527006.b3lyp_6-31g(d).nwchem.inp (generated) 004527006.b3lyp_6-31g(d).log.xz 004527006.mol 004527006.PUBCHEM 004527006.mol (via Jmol)
004527008.b3lyp_6-31g(d).inp

004527008.b3lyp_6-31g(d).qchem.inp (generated)

004527008.b3lyp_6-31g(d).gjf (generated)

004527008.b3lyp_6-31g(d).firefly.inp (generated)

004527008.b3lyp_6-31g(d).smash.inp (generated)

004527008.b3lyp_6-31g(d).nwchem.inp (generated) 004527008.b3lyp_6-31g(d).log.xz 004527008.td-b3lyp_6-31g+(d).inp 004527008.td-b3lyp_6-31g+(d).log.xz

004527008.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527008.td-b3lyp_6-31+g(d).gjf (generated)

004527008.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527008.mol 004527008.PUBCHEM 004527008.mol (via Jmol)
004527060.b3lyp_6-31g(d).inp

004527060.b3lyp_6-31g(d).qchem.inp (generated)

004527060.b3lyp_6-31g(d).gjf (generated)

004527060.b3lyp_6-31g(d).firefly.inp (generated)

004527060.b3lyp_6-31g(d).smash.inp (generated)

004527060.b3lyp_6-31g(d).nwchem.inp (generated) 004527060.b3lyp_6-31g(d).log.xz 004527060.td-b3lyp_6-31g+(d).inp 004527060.td-b3lyp_6-31g+(d).log.xz

004527060.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527060.td-b3lyp_6-31+g(d).gjf (generated)

004527060.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527060.mol 004527060.PUBCHEM 004527060.mol (via Jmol)
004527166.b3lyp_6-31g(d).inp

004527166.b3lyp_6-31g(d).qchem.inp (generated)

004527166.b3lyp_6-31g(d).gjf (generated)

004527166.b3lyp_6-31g(d).firefly.inp (generated)

004527166.b3lyp_6-31g(d).smash.inp (generated)

004527166.b3lyp_6-31g(d).nwchem.inp (generated) 004527166.b3lyp_6-31g(d).log.xz 004527166.td-b3lyp_6-31g+(d).inp 004527166.td-b3lyp_6-31g+(d).log.xz

004527166.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527166.td-b3lyp_6-31+g(d).gjf (generated)

004527166.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527166.mol 004527166.PUBCHEM 004527166.mol (via Jmol)
004527177.b3lyp_6-31g(d).inp

004527177.b3lyp_6-31g(d).qchem.inp (generated)

004527177.b3lyp_6-31g(d).gjf (generated)

004527177.b3lyp_6-31g(d).firefly.inp (generated)

004527177.b3lyp_6-31g(d).smash.inp (generated)

004527177.b3lyp_6-31g(d).nwchem.inp (generated) 004527177.b3lyp_6-31g(d).log.xz 004527177.td-b3lyp_6-31g+(d).inp 004527177.td-b3lyp_6-31g+(d).log.xz

004527177.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527177.td-b3lyp_6-31+g(d).gjf (generated)

004527177.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527177.mol 004527177.PUBCHEM 004527177.mol (via Jmol)
004527180.b3lyp_6-31g(d).inp

004527180.b3lyp_6-31g(d).qchem.inp (generated)

004527180.b3lyp_6-31g(d).gjf (generated)

004527180.b3lyp_6-31g(d).firefly.inp (generated)

004527180.b3lyp_6-31g(d).smash.inp (generated)

004527180.b3lyp_6-31g(d).nwchem.inp (generated) 004527180.b3lyp_6-31g(d).log.xz 004527180.td-b3lyp_6-31g+(d).inp 004527180.td-b3lyp_6-31g+(d).log.xz

004527180.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527180.td-b3lyp_6-31+g(d).gjf (generated)

004527180.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527180.mol 004527180.PUBCHEM 004527180.mol (via Jmol)
004527181.b3lyp_6-31g(d).inp

004527181.b3lyp_6-31g(d).qchem.inp (generated)

004527181.b3lyp_6-31g(d).gjf (generated)

004527181.b3lyp_6-31g(d).firefly.inp (generated)

004527181.b3lyp_6-31g(d).smash.inp (generated)

004527181.b3lyp_6-31g(d).nwchem.inp (generated) 004527181.b3lyp_6-31g(d).log.xz 004527181.td-b3lyp_6-31g+(d).inp 004527181.td-b3lyp_6-31g+(d).log.xz

004527181.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527181.td-b3lyp_6-31+g(d).gjf (generated)

004527181.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527181.mol 004527181.PUBCHEM 004527181.mol (via Jmol)
004527217.b3lyp_6-31g(d).inp

004527217.b3lyp_6-31g(d).qchem.inp (generated)

004527217.b3lyp_6-31g(d).gjf (generated)

004527217.b3lyp_6-31g(d).firefly.inp (generated)

004527217.b3lyp_6-31g(d).smash.inp (generated)

004527217.b3lyp_6-31g(d).nwchem.inp (generated) 004527217.b3lyp_6-31g(d).log.xz 004527217.mol 004527217.PUBCHEM 004527217.mol (via Jmol)
004527246.b3lyp_6-31g(d).inp

004527246.b3lyp_6-31g(d).qchem.inp (generated)

004527246.b3lyp_6-31g(d).gjf (generated)

004527246.b3lyp_6-31g(d).firefly.inp (generated)

004527246.b3lyp_6-31g(d).smash.inp (generated)

004527246.b3lyp_6-31g(d).nwchem.inp (generated) 004527246.b3lyp_6-31g(d).log.xz 004527246.td-b3lyp_6-31g+(d).inp 004527246.td-b3lyp_6-31g+(d).log.xz

004527246.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527246.td-b3lyp_6-31+g(d).gjf (generated)

004527246.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527246.mol 004527246.PUBCHEM 004527246.mol (via Jmol)
004527301.b3lyp_6-31g(d).inp

004527301.b3lyp_6-31g(d).qchem.inp (generated)

004527301.b3lyp_6-31g(d).gjf (generated)

004527301.b3lyp_6-31g(d).firefly.inp (generated)

004527301.b3lyp_6-31g(d).smash.inp (generated)

004527301.b3lyp_6-31g(d).nwchem.inp (generated) 004527301.b3lyp_6-31g(d).log.xz 004527301.mol 004527301.PUBCHEM 004527301.mol (via Jmol)
004527381.b3lyp_6-31g(d).inp

004527381.b3lyp_6-31g(d).qchem.inp (generated)

004527381.b3lyp_6-31g(d).gjf (generated)

004527381.b3lyp_6-31g(d).firefly.inp (generated)

004527381.b3lyp_6-31g(d).smash.inp (generated)

004527381.b3lyp_6-31g(d).nwchem.inp (generated) 004527381.b3lyp_6-31g(d).log.xz 004527381.td-b3lyp_6-31g+(d).inp 004527381.td-b3lyp_6-31g+(d).log.xz

004527381.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527381.td-b3lyp_6-31+g(d).gjf (generated)

004527381.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527381.mol 004527381.PUBCHEM 004527381.mol (via Jmol)
004527387.b3lyp_6-31g(d).inp

004527387.b3lyp_6-31g(d).qchem.inp (generated)

004527387.b3lyp_6-31g(d).gjf (generated)

004527387.b3lyp_6-31g(d).firefly.inp (generated)

004527387.b3lyp_6-31g(d).smash.inp (generated)

004527387.b3lyp_6-31g(d).nwchem.inp (generated) 004527387.b3lyp_6-31g(d).log.xz 004527387.td-b3lyp_6-31g+(d).inp 004527387.td-b3lyp_6-31g+(d).log.xz

004527387.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527387.td-b3lyp_6-31+g(d).gjf (generated)

004527387.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527387.mol 004527387.PUBCHEM 004527387.mol (via Jmol)
004527399.b3lyp_6-31g(d).inp

004527399.b3lyp_6-31g(d).qchem.inp (generated)

004527399.b3lyp_6-31g(d).gjf (generated)

004527399.b3lyp_6-31g(d).firefly.inp (generated)

004527399.b3lyp_6-31g(d).smash.inp (generated)

004527399.b3lyp_6-31g(d).nwchem.inp (generated) 004527399.b3lyp_6-31g(d).log.xz 004527399.td-b3lyp_6-31g+(d).inp 004527399.td-b3lyp_6-31g+(d).log.xz

004527399.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527399.td-b3lyp_6-31+g(d).gjf (generated)

004527399.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527399.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527399.mol 004527399.PUBCHEM 004527399.mol (via Jmol)
004527405.b3lyp_6-31g(d).inp

004527405.b3lyp_6-31g(d).qchem.inp (generated)

004527405.b3lyp_6-31g(d).gjf (generated)

004527405.b3lyp_6-31g(d).firefly.inp (generated)

004527405.b3lyp_6-31g(d).smash.inp (generated)

004527405.b3lyp_6-31g(d).nwchem.inp (generated) 004527405.b3lyp_6-31g(d).log.xz 004527405.td-b3lyp_6-31g+(d).inp 004527405.td-b3lyp_6-31g+(d).log.xz

004527405.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527405.td-b3lyp_6-31+g(d).gjf (generated)

004527405.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527405.mol 004527405.PUBCHEM 004527405.mol (via Jmol)
004527421.b3lyp_6-31g(d).inp

004527421.b3lyp_6-31g(d).qchem.inp (generated)

004527421.b3lyp_6-31g(d).gjf (generated)

004527421.b3lyp_6-31g(d).firefly.inp (generated)

004527421.b3lyp_6-31g(d).smash.inp (generated)

004527421.b3lyp_6-31g(d).nwchem.inp (generated) 004527421.b3lyp_6-31g(d).log.xz 004527421.td-b3lyp_6-31g+(d).inp 004527421.td-b3lyp_6-31g+(d).log.xz

004527421.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527421.td-b3lyp_6-31+g(d).gjf (generated)

004527421.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527421.mol 004527421.PUBCHEM 004527421.mol (via Jmol)
004527475.b3lyp_6-31g(d).inp

004527475.b3lyp_6-31g(d).qchem.inp (generated)

004527475.b3lyp_6-31g(d).gjf (generated)

004527475.b3lyp_6-31g(d).firefly.inp (generated)

004527475.b3lyp_6-31g(d).smash.inp (generated)

004527475.b3lyp_6-31g(d).nwchem.inp (generated) 004527475.b3lyp_6-31g(d).log.xz 004527475.td-b3lyp_6-31g+(d).inp 004527475.td-b3lyp_6-31g+(d).log.xz

004527475.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527475.td-b3lyp_6-31+g(d).gjf (generated)

004527475.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527475.mol 004527475.PUBCHEM 004527475.mol (via Jmol)
004527513.b3lyp_6-31g(d).inp

004527513.b3lyp_6-31g(d).qchem.inp (generated)

004527513.b3lyp_6-31g(d).gjf (generated)

004527513.b3lyp_6-31g(d).firefly.inp (generated)

004527513.b3lyp_6-31g(d).smash.inp (generated)

004527513.b3lyp_6-31g(d).nwchem.inp (generated) 004527513.b3lyp_6-31g(d).log.xz 004527513.td-b3lyp_6-31g+(d).inp 004527513.td-b3lyp_6-31g+(d).log.xz

004527513.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527513.td-b3lyp_6-31+g(d).gjf (generated)

004527513.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527513.mol 004527513.PUBCHEM 004527513.mol (via Jmol)
004527518.b3lyp_6-31g(d).inp

004527518.b3lyp_6-31g(d).qchem.inp (generated)

004527518.b3lyp_6-31g(d).gjf (generated)

004527518.b3lyp_6-31g(d).firefly.inp (generated)

004527518.b3lyp_6-31g(d).smash.inp (generated)

004527518.b3lyp_6-31g(d).nwchem.inp (generated) 004527518.b3lyp_6-31g(d).log.xz 004527518.td-b3lyp_6-31g+(d).inp 004527518.td-b3lyp_6-31g+(d).log.xz

004527518.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527518.td-b3lyp_6-31+g(d).gjf (generated)

004527518.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527518.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527518.mol 004527518.PUBCHEM 004527518.mol (via Jmol)
004527576.b3lyp_6-31g(d).inp

004527576.b3lyp_6-31g(d).qchem.inp (generated)

004527576.b3lyp_6-31g(d).gjf (generated)

004527576.b3lyp_6-31g(d).firefly.inp (generated)

004527576.b3lyp_6-31g(d).smash.inp (generated)

004527576.b3lyp_6-31g(d).nwchem.inp (generated) 004527576.b3lyp_6-31g(d).log.xz 004527576.td-b3lyp_6-31g+(d).inp 004527576.td-b3lyp_6-31g+(d).log.xz

004527576.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527576.td-b3lyp_6-31+g(d).gjf (generated)

004527576.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527576.mol 004527576.PUBCHEM 004527576.mol (via Jmol)
004527582.b3lyp_6-31g(d).inp

004527582.b3lyp_6-31g(d).qchem.inp (generated)

004527582.b3lyp_6-31g(d).gjf (generated)

004527582.b3lyp_6-31g(d).firefly.inp (generated)

004527582.b3lyp_6-31g(d).smash.inp (generated)

004527582.b3lyp_6-31g(d).nwchem.inp (generated) 004527582.b3lyp_6-31g(d).log.xz 004527582.td-b3lyp_6-31g+(d).inp 004527582.td-b3lyp_6-31g+(d).log.xz

004527582.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527582.td-b3lyp_6-31+g(d).gjf (generated)

004527582.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527582.mol 004527582.PUBCHEM 004527582.mol (via Jmol)
004527639.b3lyp_6-31g(d).inp

004527639.b3lyp_6-31g(d).qchem.inp (generated)

004527639.b3lyp_6-31g(d).gjf (generated)

004527639.b3lyp_6-31g(d).firefly.inp (generated)

004527639.b3lyp_6-31g(d).smash.inp (generated)

004527639.b3lyp_6-31g(d).nwchem.inp (generated) 004527639.b3lyp_6-31g(d).log.xz 004527639.td-b3lyp_6-31g+(d).inp 004527639.td-b3lyp_6-31g+(d).log.xz

004527639.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527639.td-b3lyp_6-31+g(d).gjf (generated)

004527639.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527639.mol 004527639.PUBCHEM 004527639.mol (via Jmol)
004527697.b3lyp_6-31g(d).inp

004527697.b3lyp_6-31g(d).qchem.inp (generated)

004527697.b3lyp_6-31g(d).gjf (generated)

004527697.b3lyp_6-31g(d).firefly.inp (generated)

004527697.b3lyp_6-31g(d).smash.inp (generated)

004527697.b3lyp_6-31g(d).nwchem.inp (generated) 004527697.b3lyp_6-31g(d).log.xz 004527697.mol 004527697.PUBCHEM 004527697.mol (via Jmol)
004527745.b3lyp_6-31g(d).inp

004527745.b3lyp_6-31g(d).qchem.inp (generated)

004527745.b3lyp_6-31g(d).gjf (generated)

004527745.b3lyp_6-31g(d).firefly.inp (generated)

004527745.b3lyp_6-31g(d).smash.inp (generated)

004527745.b3lyp_6-31g(d).nwchem.inp (generated) 004527745.b3lyp_6-31g(d).log.xz 004527745.mol 004527745.PUBCHEM 004527745.mol (via Jmol)
004527759.b3lyp_6-31g(d).inp

004527759.b3lyp_6-31g(d).qchem.inp (generated)

004527759.b3lyp_6-31g(d).gjf (generated)

004527759.b3lyp_6-31g(d).firefly.inp (generated)

004527759.b3lyp_6-31g(d).smash.inp (generated)

004527759.b3lyp_6-31g(d).nwchem.inp (generated) 004527759.b3lyp_6-31g(d).log.xz 004527759.td-b3lyp_6-31g+(d).inp 004527759.td-b3lyp_6-31g+(d).log.xz

004527759.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527759.td-b3lyp_6-31+g(d).gjf (generated)

004527759.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527759.mol 004527759.PUBCHEM 004527759.mol (via Jmol)
004527760.b3lyp_6-31g(d).inp

004527760.b3lyp_6-31g(d).qchem.inp (generated)

004527760.b3lyp_6-31g(d).gjf (generated)

004527760.b3lyp_6-31g(d).firefly.inp (generated)

004527760.b3lyp_6-31g(d).smash.inp (generated)

004527760.b3lyp_6-31g(d).nwchem.inp (generated) 004527760.b3lyp_6-31g(d).log.xz 004527760.mol 004527760.PUBCHEM 004527760.mol (via Jmol)
004527762.b3lyp_6-31g(d).inp

004527762.b3lyp_6-31g(d).qchem.inp (generated)

004527762.b3lyp_6-31g(d).gjf (generated)

004527762.b3lyp_6-31g(d).firefly.inp (generated)

004527762.b3lyp_6-31g(d).smash.inp (generated)

004527762.b3lyp_6-31g(d).nwchem.inp (generated) 004527762.b3lyp_6-31g(d).log.xz 004527762.td-b3lyp_6-31g+(d).inp 004527762.td-b3lyp_6-31g+(d).log.xz

004527762.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527762.td-b3lyp_6-31+g(d).gjf (generated)

004527762.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527762.mol 004527762.PUBCHEM 004527762.mol (via Jmol)
004527776.b3lyp_6-31g(d).inp

004527776.b3lyp_6-31g(d).qchem.inp (generated)

004527776.b3lyp_6-31g(d).gjf (generated)

004527776.b3lyp_6-31g(d).firefly.inp (generated)

004527776.b3lyp_6-31g(d).smash.inp (generated)

004527776.b3lyp_6-31g(d).nwchem.inp (generated) 004527776.b3lyp_6-31g(d).log.xz 004527776.td-b3lyp_6-31g+(d).inp 004527776.td-b3lyp_6-31g+(d).log.xz

004527776.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527776.td-b3lyp_6-31+g(d).gjf (generated)

004527776.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527776.mol 004527776.PUBCHEM 004527776.mol (via Jmol)
004527822.b3lyp_6-31g(d).inp

004527822.b3lyp_6-31g(d).qchem.inp (generated)

004527822.b3lyp_6-31g(d).gjf (generated)

004527822.b3lyp_6-31g(d).firefly.inp (generated)

004527822.b3lyp_6-31g(d).smash.inp (generated)

004527822.b3lyp_6-31g(d).nwchem.inp (generated) 004527822.b3lyp_6-31g(d).log.xz 004527822.td-b3lyp_6-31g+(d).inp 004527822.td-b3lyp_6-31g+(d).log.xz

004527822.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527822.td-b3lyp_6-31+g(d).gjf (generated)

004527822.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527822.mol 004527822.PUBCHEM 004527822.mol (via Jmol)
004527846.b3lyp_6-31g(d).inp

004527846.b3lyp_6-31g(d).qchem.inp (generated)

004527846.b3lyp_6-31g(d).gjf (generated)

004527846.b3lyp_6-31g(d).firefly.inp (generated)

004527846.b3lyp_6-31g(d).smash.inp (generated)

004527846.b3lyp_6-31g(d).nwchem.inp (generated) 004527846.b3lyp_6-31g(d).log.xz 004527846.td-b3lyp_6-31g+(d).inp 004527846.td-b3lyp_6-31g+(d).log.xz

004527846.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527846.td-b3lyp_6-31+g(d).gjf (generated)

004527846.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527846.mol 004527846.PUBCHEM 004527846.mol (via Jmol)
004527957.b3lyp_6-31g(d).inp

004527957.b3lyp_6-31g(d).qchem.inp (generated)

004527957.b3lyp_6-31g(d).gjf (generated)

004527957.b3lyp_6-31g(d).firefly.inp (generated)

004527957.b3lyp_6-31g(d).smash.inp (generated)

004527957.b3lyp_6-31g(d).nwchem.inp (generated) 004527957.b3lyp_6-31g(d).log.xz 004527957.td-b3lyp_6-31g+(d).inp 004527957.td-b3lyp_6-31g+(d).log.xz

004527957.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527957.td-b3lyp_6-31+g(d).gjf (generated)

004527957.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527957.mol 004527957.PUBCHEM 004527957.mol (via Jmol)
004527967.b3lyp_6-31g(d).inp

004527967.b3lyp_6-31g(d).qchem.inp (generated)

004527967.b3lyp_6-31g(d).gjf (generated)

004527967.b3lyp_6-31g(d).firefly.inp (generated)

004527967.b3lyp_6-31g(d).smash.inp (generated)

004527967.b3lyp_6-31g(d).nwchem.inp (generated) 004527967.b3lyp_6-31g(d).log.xz 004527967.td-b3lyp_6-31g+(d).inp 004527967.td-b3lyp_6-31g+(d).log.xz

004527967.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527967.td-b3lyp_6-31+g(d).gjf (generated)

004527967.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527967.mol 004527967.PUBCHEM 004527967.mol (via Jmol)
004527976.b3lyp_6-31g(d).inp

004527976.b3lyp_6-31g(d).qchem.inp (generated)

004527976.b3lyp_6-31g(d).gjf (generated)

004527976.b3lyp_6-31g(d).firefly.inp (generated)

004527976.b3lyp_6-31g(d).smash.inp (generated)

004527976.b3lyp_6-31g(d).nwchem.inp (generated) 004527976.b3lyp_6-31g(d).log.xz 004527976.td-b3lyp_6-31g+(d).inp 004527976.td-b3lyp_6-31g+(d).log.xz

004527976.td-b3lyp_6-31+g(d).qchem.inp (generated)

004527976.td-b3lyp_6-31+g(d).gjf (generated)

004527976.td-b3lyp_6-31+g(d).firefly.inp (generated)

004527976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004527976.mol 004527976.PUBCHEM 004527976.mol (via Jmol)
004527978.b3lyp_6-31g(d).inp

004527978.b3lyp_6-31g(d).qchem.inp (generated)

004527978.b3lyp_6-31g(d).gjf (generated)

004527978.b3lyp_6-31g(d).firefly.inp (generated)

004527978.b3lyp_6-31g(d).smash.inp (generated)

004527978.b3lyp_6-31g(d).nwchem.inp (generated) 004527978.b3lyp_6-31g(d).log.xz 004527978.mol 004527978.PUBCHEM 004527978.mol (via Jmol)
004528053.b3lyp_6-31g(d).inp

004528053.b3lyp_6-31g(d).qchem.inp (generated)

004528053.b3lyp_6-31g(d).gjf (generated)

004528053.b3lyp_6-31g(d).firefly.inp (generated)

004528053.b3lyp_6-31g(d).smash.inp (generated)

004528053.b3lyp_6-31g(d).nwchem.inp (generated) 004528053.b3lyp_6-31g(d).log.xz 004528053.td-b3lyp_6-31g+(d).inp 004528053.td-b3lyp_6-31g+(d).log.xz

004528053.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528053.td-b3lyp_6-31+g(d).gjf (generated)

004528053.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528053.mol 004528053.PUBCHEM 004528053.mol (via Jmol)
004528073.b3lyp_6-31g(d).inp

004528073.b3lyp_6-31g(d).qchem.inp (generated)

004528073.b3lyp_6-31g(d).gjf (generated)

004528073.b3lyp_6-31g(d).firefly.inp (generated)

004528073.b3lyp_6-31g(d).smash.inp (generated)

004528073.b3lyp_6-31g(d).nwchem.inp (generated) 004528073.b3lyp_6-31g(d).log.xz 004528073.td-b3lyp_6-31g+(d).inp 004528073.td-b3lyp_6-31g+(d).log.xz

004528073.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528073.td-b3lyp_6-31+g(d).gjf (generated)

004528073.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528073.mol 004528073.PUBCHEM 004528073.mol (via Jmol)
004528109.b3lyp_6-31g(d).inp

004528109.b3lyp_6-31g(d).qchem.inp (generated)

004528109.b3lyp_6-31g(d).gjf (generated)

004528109.b3lyp_6-31g(d).firefly.inp (generated)

004528109.b3lyp_6-31g(d).smash.inp (generated)

004528109.b3lyp_6-31g(d).nwchem.inp (generated) 004528109.b3lyp_6-31g(d).log.xz 004528109.td-b3lyp_6-31g+(d).inp 004528109.td-b3lyp_6-31g+(d).log.xz

004528109.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528109.td-b3lyp_6-31+g(d).gjf (generated)

004528109.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528109.mol 004528109.PUBCHEM 004528109.mol (via Jmol)
004528178.b3lyp_6-31g(d).inp

004528178.b3lyp_6-31g(d).qchem.inp (generated)

004528178.b3lyp_6-31g(d).gjf (generated)

004528178.b3lyp_6-31g(d).firefly.inp (generated)

004528178.b3lyp_6-31g(d).smash.inp (generated)

004528178.b3lyp_6-31g(d).nwchem.inp (generated) 004528178.b3lyp_6-31g(d).log.xz 004528178.td-b3lyp_6-31g+(d).inp 004528178.td-b3lyp_6-31g+(d).log.xz

004528178.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528178.td-b3lyp_6-31+g(d).gjf (generated)

004528178.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528178.mol 004528178.PUBCHEM 004528178.mol (via Jmol)
004528185.b3lyp_6-31g(d).inp

004528185.b3lyp_6-31g(d).qchem.inp (generated)

004528185.b3lyp_6-31g(d).gjf (generated)

004528185.b3lyp_6-31g(d).firefly.inp (generated)

004528185.b3lyp_6-31g(d).smash.inp (generated)

004528185.b3lyp_6-31g(d).nwchem.inp (generated) 004528185.b3lyp_6-31g(d).log.xz 004528185.td-b3lyp_6-31g+(d).inp 004528185.td-b3lyp_6-31g+(d).log.xz

004528185.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528185.td-b3lyp_6-31+g(d).gjf (generated)

004528185.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528185.mol 004528185.PUBCHEM 004528185.mol (via Jmol)
004528189.b3lyp_6-31g(d).inp

004528189.b3lyp_6-31g(d).qchem.inp (generated)

004528189.b3lyp_6-31g(d).gjf (generated)

004528189.b3lyp_6-31g(d).firefly.inp (generated)

004528189.b3lyp_6-31g(d).smash.inp (generated)

004528189.b3lyp_6-31g(d).nwchem.inp (generated) 004528189.b3lyp_6-31g(d).log.xz 004528189.mol 004528189.PUBCHEM 004528189.mol (via Jmol)
004528205.b3lyp_6-31g(d).inp

004528205.b3lyp_6-31g(d).qchem.inp (generated)

004528205.b3lyp_6-31g(d).gjf (generated)

004528205.b3lyp_6-31g(d).firefly.inp (generated)

004528205.b3lyp_6-31g(d).smash.inp (generated)

004528205.b3lyp_6-31g(d).nwchem.inp (generated) 004528205.b3lyp_6-31g(d).log.xz 004528205.td-b3lyp_6-31g+(d).inp 004528205.td-b3lyp_6-31g+(d).log.xz

004528205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528205.td-b3lyp_6-31+g(d).gjf (generated)

004528205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528205.mol 004528205.PUBCHEM 004528205.mol (via Jmol)
004528207.b3lyp_6-31g(d).inp

004528207.b3lyp_6-31g(d).qchem.inp (generated)

004528207.b3lyp_6-31g(d).gjf (generated)

004528207.b3lyp_6-31g(d).firefly.inp (generated)

004528207.b3lyp_6-31g(d).smash.inp (generated)

004528207.b3lyp_6-31g(d).nwchem.inp (generated) 004528207.b3lyp_6-31g(d).log.xz 004528207.td-b3lyp_6-31g+(d).inp 004528207.td-b3lyp_6-31g+(d).log.xz

004528207.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528207.td-b3lyp_6-31+g(d).gjf (generated)

004528207.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528207.mol 004528207.PUBCHEM 004528207.mol (via Jmol)
004528211.b3lyp_6-31g(d).inp

004528211.b3lyp_6-31g(d).qchem.inp (generated)

004528211.b3lyp_6-31g(d).gjf (generated)

004528211.b3lyp_6-31g(d).firefly.inp (generated)

004528211.b3lyp_6-31g(d).smash.inp (generated)

004528211.b3lyp_6-31g(d).nwchem.inp (generated) 004528211.b3lyp_6-31g(d).log.xz 004528211.td-b3lyp_6-31g+(d).inp 004528211.td-b3lyp_6-31g+(d).log.xz

004528211.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528211.td-b3lyp_6-31+g(d).gjf (generated)

004528211.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528211.mol 004528211.PUBCHEM 004528211.mol (via Jmol)
004528414.b3lyp_6-31g(d).inp

004528414.b3lyp_6-31g(d).qchem.inp (generated)

004528414.b3lyp_6-31g(d).gjf (generated)

004528414.b3lyp_6-31g(d).firefly.inp (generated)

004528414.b3lyp_6-31g(d).smash.inp (generated)

004528414.b3lyp_6-31g(d).nwchem.inp (generated) 004528414.b3lyp_6-31g(d).log.xz 004528414.td-b3lyp_6-31g+(d).inp 004528414.td-b3lyp_6-31g+(d).log.xz

004528414.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528414.td-b3lyp_6-31+g(d).gjf (generated)

004528414.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528414.mol 004528414.PUBCHEM 004528414.mol (via Jmol)
004528485.b3lyp_6-31g(d).inp

004528485.b3lyp_6-31g(d).qchem.inp (generated)

004528485.b3lyp_6-31g(d).gjf (generated)

004528485.b3lyp_6-31g(d).firefly.inp (generated)

004528485.b3lyp_6-31g(d).smash.inp (generated)

004528485.b3lyp_6-31g(d).nwchem.inp (generated) 004528485.b3lyp_6-31g(d).log.xz 004528485.td-b3lyp_6-31g+(d).inp 004528485.td-b3lyp_6-31g+(d).log.xz

004528485.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528485.td-b3lyp_6-31+g(d).gjf (generated)

004528485.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528485.mol 004528485.PUBCHEM 004528485.mol (via Jmol)
004528599.b3lyp_6-31g(d).inp

004528599.b3lyp_6-31g(d).qchem.inp (generated)

004528599.b3lyp_6-31g(d).gjf (generated)

004528599.b3lyp_6-31g(d).firefly.inp (generated)

004528599.b3lyp_6-31g(d).smash.inp (generated)

004528599.b3lyp_6-31g(d).nwchem.inp (generated) 004528599.b3lyp_6-31g(d).log.xz 004528599.td-b3lyp_6-31g+(d).inp 004528599.td-b3lyp_6-31g+(d).log.xz

004528599.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528599.td-b3lyp_6-31+g(d).gjf (generated)

004528599.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528599.mol 004528599.PUBCHEM 004528599.mol (via Jmol)
004528620.b3lyp_6-31g(d).inp

004528620.b3lyp_6-31g(d).qchem.inp (generated)

004528620.b3lyp_6-31g(d).gjf (generated)

004528620.b3lyp_6-31g(d).firefly.inp (generated)

004528620.b3lyp_6-31g(d).smash.inp (generated)

004528620.b3lyp_6-31g(d).nwchem.inp (generated) 004528620.b3lyp_6-31g(d).log.xz 004528620.mol 004528620.PUBCHEM 004528620.mol (via Jmol)
004528668.b3lyp_6-31g(d).inp

004528668.b3lyp_6-31g(d).qchem.inp (generated)

004528668.b3lyp_6-31g(d).gjf (generated)

004528668.b3lyp_6-31g(d).firefly.inp (generated)

004528668.b3lyp_6-31g(d).smash.inp (generated)

004528668.b3lyp_6-31g(d).nwchem.inp (generated) 004528668.b3lyp_6-31g(d).log.xz 004528668.td-b3lyp_6-31g+(d).inp 004528668.td-b3lyp_6-31g+(d).log.xz

004528668.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528668.td-b3lyp_6-31+g(d).gjf (generated)

004528668.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528668.mol 004528668.PUBCHEM 004528668.mol (via Jmol)
004528692.b3lyp_6-31g(d).inp

004528692.b3lyp_6-31g(d).qchem.inp (generated)

004528692.b3lyp_6-31g(d).gjf (generated)

004528692.b3lyp_6-31g(d).firefly.inp (generated)

004528692.b3lyp_6-31g(d).smash.inp (generated)

004528692.b3lyp_6-31g(d).nwchem.inp (generated) 004528692.b3lyp_6-31g(d).log.xz 004528692.td-b3lyp_6-31g+(d).inp 004528692.td-b3lyp_6-31g+(d).log.xz

004528692.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528692.td-b3lyp_6-31+g(d).gjf (generated)

004528692.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528692.mol 004528692.PUBCHEM 004528692.mol (via Jmol)
004528751.b3lyp_6-31g(d).inp

004528751.b3lyp_6-31g(d).qchem.inp (generated)

004528751.b3lyp_6-31g(d).gjf (generated)

004528751.b3lyp_6-31g(d).firefly.inp (generated)

004528751.b3lyp_6-31g(d).smash.inp (generated)

004528751.b3lyp_6-31g(d).nwchem.inp (generated) 004528751.b3lyp_6-31g(d).log.xz 004528751.mol 004528751.PUBCHEM 004528751.mol (via Jmol)
004528754.b3lyp_6-31g(d).inp

004528754.b3lyp_6-31g(d).qchem.inp (generated)

004528754.b3lyp_6-31g(d).gjf (generated)

004528754.b3lyp_6-31g(d).firefly.inp (generated)

004528754.b3lyp_6-31g(d).smash.inp (generated)

004528754.b3lyp_6-31g(d).nwchem.inp (generated) 004528754.b3lyp_6-31g(d).log.xz 004528754.td-b3lyp_6-31g+(d).inp 004528754.td-b3lyp_6-31g+(d).log.xz

004528754.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528754.td-b3lyp_6-31+g(d).gjf (generated)

004528754.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528754.mol 004528754.PUBCHEM 004528754.mol (via Jmol)
004528758.b3lyp_6-31g(d).inp

004528758.b3lyp_6-31g(d).qchem.inp (generated)

004528758.b3lyp_6-31g(d).gjf (generated)

004528758.b3lyp_6-31g(d).firefly.inp (generated)

004528758.b3lyp_6-31g(d).smash.inp (generated)

004528758.b3lyp_6-31g(d).nwchem.inp (generated) 004528758.b3lyp_6-31g(d).log.xz 004528758.td-b3lyp_6-31g+(d).inp 004528758.td-b3lyp_6-31g+(d).log.xz

004528758.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528758.td-b3lyp_6-31+g(d).gjf (generated)

004528758.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528758.mol 004528758.PUBCHEM 004528758.mol (via Jmol)
004528776.b3lyp_6-31g(d).inp

004528776.b3lyp_6-31g(d).qchem.inp (generated)

004528776.b3lyp_6-31g(d).gjf (generated)

004528776.b3lyp_6-31g(d).firefly.inp (generated)

004528776.b3lyp_6-31g(d).smash.inp (generated)

004528776.b3lyp_6-31g(d).nwchem.inp (generated) 004528776.b3lyp_6-31g(d).log.xz 004528776.td-b3lyp_6-31g+(d).inp 004528776.td-b3lyp_6-31g+(d).log.xz

004528776.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528776.td-b3lyp_6-31+g(d).gjf (generated)

004528776.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528776.mol 004528776.PUBCHEM 004528776.mol (via Jmol)
004528915.b3lyp_6-31g(d).inp

004528915.b3lyp_6-31g(d).qchem.inp (generated)

004528915.b3lyp_6-31g(d).gjf (generated)

004528915.b3lyp_6-31g(d).firefly.inp (generated)

004528915.b3lyp_6-31g(d).smash.inp (generated)

004528915.b3lyp_6-31g(d).nwchem.inp (generated) 004528915.b3lyp_6-31g(d).log.xz 004528915.td-b3lyp_6-31g+(d).inp 004528915.td-b3lyp_6-31g+(d).log.xz

004528915.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528915.td-b3lyp_6-31+g(d).gjf (generated)

004528915.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528915.mol 004528915.PUBCHEM 004528915.mol (via Jmol)
004528916.b3lyp_6-31g(d).inp

004528916.b3lyp_6-31g(d).qchem.inp (generated)

004528916.b3lyp_6-31g(d).gjf (generated)

004528916.b3lyp_6-31g(d).firefly.inp (generated)

004528916.b3lyp_6-31g(d).smash.inp (generated)

004528916.b3lyp_6-31g(d).nwchem.inp (generated) 004528916.b3lyp_6-31g(d).log.xz 004528916.td-b3lyp_6-31g+(d).inp 004528916.td-b3lyp_6-31g+(d).log.xz

004528916.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528916.td-b3lyp_6-31+g(d).gjf (generated)

004528916.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528916.mol 004528916.PUBCHEM 004528916.mol (via Jmol)
004528922.b3lyp_6-31g(d).inp

004528922.b3lyp_6-31g(d).qchem.inp (generated)

004528922.b3lyp_6-31g(d).gjf (generated)

004528922.b3lyp_6-31g(d).firefly.inp (generated)

004528922.b3lyp_6-31g(d).smash.inp (generated)

004528922.b3lyp_6-31g(d).nwchem.inp (generated) 004528922.b3lyp_6-31g(d).log.xz 004528922.td-b3lyp_6-31g+(d).inp 004528922.td-b3lyp_6-31g+(d).log.xz

004528922.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528922.td-b3lyp_6-31+g(d).gjf (generated)

004528922.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528922.mol 004528922.PUBCHEM 004528922.mol (via Jmol)
004528939.b3lyp_6-31g(d).inp

004528939.b3lyp_6-31g(d).qchem.inp (generated)

004528939.b3lyp_6-31g(d).gjf (generated)

004528939.b3lyp_6-31g(d).firefly.inp (generated)

004528939.b3lyp_6-31g(d).smash.inp (generated)

004528939.b3lyp_6-31g(d).nwchem.inp (generated) 004528939.b3lyp_6-31g(d).log.xz 004528939.td-b3lyp_6-31g+(d).inp 004528939.td-b3lyp_6-31g+(d).log.xz

004528939.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528939.td-b3lyp_6-31+g(d).gjf (generated)

004528939.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528939.mol 004528939.PUBCHEM 004528939.mol (via Jmol)
004528993.b3lyp_6-31g(d).inp

004528993.b3lyp_6-31g(d).qchem.inp (generated)

004528993.b3lyp_6-31g(d).gjf (generated)

004528993.b3lyp_6-31g(d).firefly.inp (generated)

004528993.b3lyp_6-31g(d).smash.inp (generated)

004528993.b3lyp_6-31g(d).nwchem.inp (generated) 004528993.b3lyp_6-31g(d).log.xz 004528993.td-b3lyp_6-31g+(d).inp 004528993.td-b3lyp_6-31g+(d).log.xz

004528993.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528993.td-b3lyp_6-31+g(d).gjf (generated)

004528993.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528993.mol 004528993.PUBCHEM 004528993.mol (via Jmol)
004528999.b3lyp_6-31g(d).inp

004528999.b3lyp_6-31g(d).qchem.inp (generated)

004528999.b3lyp_6-31g(d).gjf (generated)

004528999.b3lyp_6-31g(d).firefly.inp (generated)

004528999.b3lyp_6-31g(d).smash.inp (generated)

004528999.b3lyp_6-31g(d).nwchem.inp (generated) 004528999.b3lyp_6-31g(d).log.xz 004528999.td-b3lyp_6-31g+(d).inp 004528999.td-b3lyp_6-31g+(d).log.xz

004528999.td-b3lyp_6-31+g(d).qchem.inp (generated)

004528999.td-b3lyp_6-31+g(d).gjf (generated)

004528999.td-b3lyp_6-31+g(d).firefly.inp (generated)

004528999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004528999.mol 004528999.PUBCHEM 004528999.mol (via Jmol)
004529024.b3lyp_6-31g(d).inp

004529024.b3lyp_6-31g(d).qchem.inp (generated)

004529024.b3lyp_6-31g(d).gjf (generated)

004529024.b3lyp_6-31g(d).firefly.inp (generated)

004529024.b3lyp_6-31g(d).smash.inp (generated)

004529024.b3lyp_6-31g(d).nwchem.inp (generated) 004529024.b3lyp_6-31g(d).log.xz 004529024.td-b3lyp_6-31g+(d).inp 004529024.td-b3lyp_6-31g+(d).log.xz

004529024.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529024.td-b3lyp_6-31+g(d).gjf (generated)

004529024.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529024.mol 004529024.PUBCHEM 004529024.mol (via Jmol)
004529033.b3lyp_6-31g(d).inp

004529033.b3lyp_6-31g(d).qchem.inp (generated)

004529033.b3lyp_6-31g(d).gjf (generated)

004529033.b3lyp_6-31g(d).firefly.inp (generated)

004529033.b3lyp_6-31g(d).smash.inp (generated)

004529033.b3lyp_6-31g(d).nwchem.inp (generated) 004529033.b3lyp_6-31g(d).log.xz 004529033.td-b3lyp_6-31g+(d).inp 004529033.td-b3lyp_6-31g+(d).log.xz

004529033.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529033.td-b3lyp_6-31+g(d).gjf (generated)

004529033.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529033.mol 004529033.PUBCHEM 004529033.mol (via Jmol)
004529048.b3lyp_6-31g(d).inp

004529048.b3lyp_6-31g(d).qchem.inp (generated)

004529048.b3lyp_6-31g(d).gjf (generated)

004529048.b3lyp_6-31g(d).firefly.inp (generated)

004529048.b3lyp_6-31g(d).smash.inp (generated)

004529048.b3lyp_6-31g(d).nwchem.inp (generated) 004529048.b3lyp_6-31g(d).log.xz 004529048.td-b3lyp_6-31g+(d).inp 004529048.td-b3lyp_6-31g+(d).log.xz

004529048.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529048.td-b3lyp_6-31+g(d).gjf (generated)

004529048.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529048.mol 004529048.PUBCHEM 004529048.mol (via Jmol)
004529068.b3lyp_6-31g(d).inp

004529068.b3lyp_6-31g(d).qchem.inp (generated)

004529068.b3lyp_6-31g(d).gjf (generated)

004529068.b3lyp_6-31g(d).firefly.inp (generated)

004529068.b3lyp_6-31g(d).smash.inp (generated)

004529068.b3lyp_6-31g(d).nwchem.inp (generated) 004529068.b3lyp_6-31g(d).log.xz 004529068.mol 004529068.PUBCHEM 004529068.mol (via Jmol)
004529071.b3lyp_6-31g(d).inp

004529071.b3lyp_6-31g(d).qchem.inp (generated)

004529071.b3lyp_6-31g(d).gjf (generated)

004529071.b3lyp_6-31g(d).firefly.inp (generated)

004529071.b3lyp_6-31g(d).smash.inp (generated)

004529071.b3lyp_6-31g(d).nwchem.inp (generated) 004529071.b3lyp_6-31g(d).log.xz 004529071.mol 004529071.PUBCHEM 004529071.mol (via Jmol)
004529137.b3lyp_6-31g(d).inp

004529137.b3lyp_6-31g(d).qchem.inp (generated)

004529137.b3lyp_6-31g(d).gjf (generated)

004529137.b3lyp_6-31g(d).firefly.inp (generated)

004529137.b3lyp_6-31g(d).smash.inp (generated)

004529137.b3lyp_6-31g(d).nwchem.inp (generated) 004529137.b3lyp_6-31g(d).log.xz 004529137.mol 004529137.PUBCHEM 004529137.mol (via Jmol)
004529220.b3lyp_6-31g(d).inp

004529220.b3lyp_6-31g(d).qchem.inp (generated)

004529220.b3lyp_6-31g(d).gjf (generated)

004529220.b3lyp_6-31g(d).firefly.inp (generated)

004529220.b3lyp_6-31g(d).smash.inp (generated)

004529220.b3lyp_6-31g(d).nwchem.inp (generated) 004529220.b3lyp_6-31g(d).log.xz 004529220.mol 004529220.PUBCHEM 004529220.mol (via Jmol)
004529236.b3lyp_6-31g(d).inp

004529236.b3lyp_6-31g(d).qchem.inp (generated)

004529236.b3lyp_6-31g(d).gjf (generated)

004529236.b3lyp_6-31g(d).firefly.inp (generated)

004529236.b3lyp_6-31g(d).smash.inp (generated)

004529236.b3lyp_6-31g(d).nwchem.inp (generated) 004529236.b3lyp_6-31g(d).log.xz 004529236.mol 004529236.PUBCHEM 004529236.mol (via Jmol)
004529307.b3lyp_6-31g(d).inp

004529307.b3lyp_6-31g(d).qchem.inp (generated)

004529307.b3lyp_6-31g(d).gjf (generated)

004529307.b3lyp_6-31g(d).firefly.inp (generated)

004529307.b3lyp_6-31g(d).smash.inp (generated)

004529307.b3lyp_6-31g(d).nwchem.inp (generated) 004529307.b3lyp_6-31g(d).log.xz 004529307.td-b3lyp_6-31g+(d).inp 004529307.td-b3lyp_6-31g+(d).log.xz

004529307.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529307.td-b3lyp_6-31+g(d).gjf (generated)

004529307.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529307.mol 004529307.PUBCHEM 004529307.mol (via Jmol)
004529324.b3lyp_6-31g(d).inp

004529324.b3lyp_6-31g(d).qchem.inp (generated)

004529324.b3lyp_6-31g(d).gjf (generated)

004529324.b3lyp_6-31g(d).firefly.inp (generated)

004529324.b3lyp_6-31g(d).smash.inp (generated)

004529324.b3lyp_6-31g(d).nwchem.inp (generated) 004529324.b3lyp_6-31g(d).log.xz 004529324.td-b3lyp_6-31g+(d).inp 004529324.td-b3lyp_6-31g+(d).log.xz

004529324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529324.td-b3lyp_6-31+g(d).gjf (generated)

004529324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529324.mol 004529324.PUBCHEM 004529324.mol (via Jmol)
004529372.b3lyp_6-31g(d).inp

004529372.b3lyp_6-31g(d).qchem.inp (generated)

004529372.b3lyp_6-31g(d).gjf (generated)

004529372.b3lyp_6-31g(d).firefly.inp (generated)

004529372.b3lyp_6-31g(d).smash.inp (generated)

004529372.b3lyp_6-31g(d).nwchem.inp (generated) 004529372.b3lyp_6-31g(d).log.xz 004529372.td-b3lyp_6-31g+(d).inp 004529372.td-b3lyp_6-31g+(d).log.xz

004529372.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529372.td-b3lyp_6-31+g(d).gjf (generated)

004529372.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529372.mol 004529372.PUBCHEM 004529372.mol (via Jmol)
004529491.b3lyp_6-31g(d).inp

004529491.b3lyp_6-31g(d).qchem.inp (generated)

004529491.b3lyp_6-31g(d).gjf (generated)

004529491.b3lyp_6-31g(d).firefly.inp (generated)

004529491.b3lyp_6-31g(d).smash.inp (generated)

004529491.b3lyp_6-31g(d).nwchem.inp (generated) 004529491.b3lyp_6-31g(d).log.xz 004529491.td-b3lyp_6-31g+(d).inp 004529491.td-b3lyp_6-31g+(d).log.xz

004529491.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529491.td-b3lyp_6-31+g(d).gjf (generated)

004529491.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529491.mol 004529491.PUBCHEM 004529491.mol (via Jmol)
004529617.b3lyp_6-31g(d).inp

004529617.b3lyp_6-31g(d).qchem.inp (generated)

004529617.b3lyp_6-31g(d).gjf (generated)

004529617.b3lyp_6-31g(d).firefly.inp (generated)

004529617.b3lyp_6-31g(d).smash.inp (generated)

004529617.b3lyp_6-31g(d).nwchem.inp (generated) 004529617.b3lyp_6-31g(d).log.xz 004529617.td-b3lyp_6-31g+(d).inp 004529617.td-b3lyp_6-31g+(d).log.xz

004529617.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529617.td-b3lyp_6-31+g(d).gjf (generated)

004529617.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529617.mol 004529617.PUBCHEM 004529617.mol (via Jmol)
004529660.b3lyp_6-31g(d).inp

004529660.b3lyp_6-31g(d).qchem.inp (generated)

004529660.b3lyp_6-31g(d).gjf (generated)

004529660.b3lyp_6-31g(d).firefly.inp (generated)

004529660.b3lyp_6-31g(d).smash.inp (generated)

004529660.b3lyp_6-31g(d).nwchem.inp (generated) 004529660.b3lyp_6-31g(d).log.xz 004529660.td-b3lyp_6-31g+(d).inp 004529660.td-b3lyp_6-31g+(d).log.xz

004529660.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529660.td-b3lyp_6-31+g(d).gjf (generated)

004529660.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529660.mol 004529660.PUBCHEM 004529660.mol (via Jmol)
004529842.b3lyp_6-31g(d).inp

004529842.b3lyp_6-31g(d).qchem.inp (generated)

004529842.b3lyp_6-31g(d).gjf (generated)

004529842.b3lyp_6-31g(d).firefly.inp (generated)

004529842.b3lyp_6-31g(d).smash.inp (generated)

004529842.b3lyp_6-31g(d).nwchem.inp (generated) 004529842.b3lyp_6-31g(d).log.xz 004529842.td-b3lyp_6-31g+(d).inp 004529842.td-b3lyp_6-31g+(d).log.xz

004529842.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529842.td-b3lyp_6-31+g(d).gjf (generated)

004529842.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529842.mol 004529842.PUBCHEM 004529842.mol (via Jmol)
004529851.b3lyp_6-31g(d).inp

004529851.b3lyp_6-31g(d).qchem.inp (generated)

004529851.b3lyp_6-31g(d).gjf (generated)

004529851.b3lyp_6-31g(d).firefly.inp (generated)

004529851.b3lyp_6-31g(d).smash.inp (generated)

004529851.b3lyp_6-31g(d).nwchem.inp (generated) 004529851.b3lyp_6-31g(d).log.xz 004529851.td-b3lyp_6-31g+(d).inp 004529851.td-b3lyp_6-31g+(d).log.xz

004529851.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529851.td-b3lyp_6-31+g(d).gjf (generated)

004529851.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529851.mol 004529851.PUBCHEM 004529851.mol (via Jmol)
004529900.b3lyp_6-31g(d).inp

004529900.b3lyp_6-31g(d).qchem.inp (generated)

004529900.b3lyp_6-31g(d).gjf (generated)

004529900.b3lyp_6-31g(d).firefly.inp (generated)

004529900.b3lyp_6-31g(d).smash.inp (generated)

004529900.b3lyp_6-31g(d).nwchem.inp (generated) 004529900.b3lyp_6-31g(d).log.xz 004529900.mol 004529900.PUBCHEM 004529900.mol (via Jmol)
004529907.b3lyp_6-31g(d).inp

004529907.b3lyp_6-31g(d).qchem.inp (generated)

004529907.b3lyp_6-31g(d).gjf (generated)

004529907.b3lyp_6-31g(d).firefly.inp (generated)

004529907.b3lyp_6-31g(d).smash.inp (generated)

004529907.b3lyp_6-31g(d).nwchem.inp (generated) 004529907.b3lyp_6-31g(d).log.xz 004529907.td-b3lyp_6-31g+(d).inp 004529907.td-b3lyp_6-31g+(d).log.xz

004529907.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529907.td-b3lyp_6-31+g(d).gjf (generated)

004529907.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529907.mol 004529907.PUBCHEM 004529907.mol (via Jmol)
004529952.b3lyp_6-31g(d).inp

004529952.b3lyp_6-31g(d).qchem.inp (generated)

004529952.b3lyp_6-31g(d).gjf (generated)

004529952.b3lyp_6-31g(d).firefly.inp (generated)

004529952.b3lyp_6-31g(d).smash.inp (generated)

004529952.b3lyp_6-31g(d).nwchem.inp (generated) 004529952.b3lyp_6-31g(d).log.xz 004529952.td-b3lyp_6-31g+(d).inp 004529952.td-b3lyp_6-31g+(d).log.xz

004529952.td-b3lyp_6-31+g(d).qchem.inp (generated)

004529952.td-b3lyp_6-31+g(d).gjf (generated)

004529952.td-b3lyp_6-31+g(d).firefly.inp (generated)

004529952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004529952.mol 004529952.PUBCHEM 004529952.mol (via Jmol)
004529963.b3lyp_6-31g(d).inp

004529963.b3lyp_6-31g(d).qchem.inp (generated)

004529963.b3lyp_6-31g(d).gjf (generated)

004529963.b3lyp_6-31g(d).firefly.inp (generated)

004529963.b3lyp_6-31g(d).smash.inp (generated)

004529963.b3lyp_6-31g(d).nwchem.inp (generated) 004529963.b3lyp_6-31g(d).log.xz 004529963.mol 004529963.PUBCHEM 004529963.mol (via Jmol)
004530006.b3lyp_6-31g(d).inp

004530006.b3lyp_6-31g(d).qchem.inp (generated)

004530006.b3lyp_6-31g(d).gjf (generated)

004530006.b3lyp_6-31g(d).firefly.inp (generated)

004530006.b3lyp_6-31g(d).smash.inp (generated)

004530006.b3lyp_6-31g(d).nwchem.inp (generated) 004530006.b3lyp_6-31g(d).log.xz 004530006.td-b3lyp_6-31g+(d).inp 004530006.td-b3lyp_6-31g+(d).log.xz

004530006.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530006.td-b3lyp_6-31+g(d).gjf (generated)

004530006.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530006.mol 004530006.PUBCHEM 004530006.mol (via Jmol)
004530045.b3lyp_6-31g(d).inp

004530045.b3lyp_6-31g(d).qchem.inp (generated)

004530045.b3lyp_6-31g(d).gjf (generated)

004530045.b3lyp_6-31g(d).firefly.inp (generated)

004530045.b3lyp_6-31g(d).smash.inp (generated)

004530045.b3lyp_6-31g(d).nwchem.inp (generated) 004530045.b3lyp_6-31g(d).log.xz 004530045.td-b3lyp_6-31g+(d).inp 004530045.td-b3lyp_6-31g+(d).log.xz

004530045.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530045.td-b3lyp_6-31+g(d).gjf (generated)

004530045.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530045.mol 004530045.PUBCHEM 004530045.mol (via Jmol)
004530104.b3lyp_6-31g(d).inp

004530104.b3lyp_6-31g(d).qchem.inp (generated)

004530104.b3lyp_6-31g(d).gjf (generated)

004530104.b3lyp_6-31g(d).firefly.inp (generated)

004530104.b3lyp_6-31g(d).smash.inp (generated)

004530104.b3lyp_6-31g(d).nwchem.inp (generated) 004530104.b3lyp_6-31g(d).log.xz 004530104.td-b3lyp_6-31g+(d).inp 004530104.td-b3lyp_6-31g+(d).log.xz

004530104.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530104.td-b3lyp_6-31+g(d).gjf (generated)

004530104.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530104.mol 004530104.PUBCHEM 004530104.mol (via Jmol)
004530140.b3lyp_6-31g(d).inp

004530140.b3lyp_6-31g(d).qchem.inp (generated)

004530140.b3lyp_6-31g(d).gjf (generated)

004530140.b3lyp_6-31g(d).firefly.inp (generated)

004530140.b3lyp_6-31g(d).smash.inp (generated)

004530140.b3lyp_6-31g(d).nwchem.inp (generated) 004530140.b3lyp_6-31g(d).log.xz 004530140.td-b3lyp_6-31g+(d).inp 004530140.td-b3lyp_6-31g+(d).log.xz

004530140.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530140.td-b3lyp_6-31+g(d).gjf (generated)

004530140.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530140.mol 004530140.PUBCHEM 004530140.mol (via Jmol)
004530158.b3lyp_6-31g(d).inp

004530158.b3lyp_6-31g(d).qchem.inp (generated)

004530158.b3lyp_6-31g(d).gjf (generated)

004530158.b3lyp_6-31g(d).firefly.inp (generated)

004530158.b3lyp_6-31g(d).smash.inp (generated)

004530158.b3lyp_6-31g(d).nwchem.inp (generated) 004530158.b3lyp_6-31g(d).log.xz 004530158.td-b3lyp_6-31g+(d).inp 004530158.td-b3lyp_6-31g+(d).log.xz

004530158.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530158.td-b3lyp_6-31+g(d).gjf (generated)

004530158.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530158.mol 004530158.PUBCHEM 004530158.mol (via Jmol)
004530164.b3lyp_6-31g(d).inp

004530164.b3lyp_6-31g(d).qchem.inp (generated)

004530164.b3lyp_6-31g(d).gjf (generated)

004530164.b3lyp_6-31g(d).firefly.inp (generated)

004530164.b3lyp_6-31g(d).smash.inp (generated)

004530164.b3lyp_6-31g(d).nwchem.inp (generated) 004530164.b3lyp_6-31g(d).log.xz 004530164.td-b3lyp_6-31g+(d).inp 004530164.td-b3lyp_6-31g+(d).log.xz

004530164.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530164.td-b3lyp_6-31+g(d).gjf (generated)

004530164.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530164.mol 004530164.PUBCHEM 004530164.mol (via Jmol)
004530194.b3lyp_6-31g(d).inp

004530194.b3lyp_6-31g(d).qchem.inp (generated)

004530194.b3lyp_6-31g(d).gjf (generated)

004530194.b3lyp_6-31g(d).firefly.inp (generated)

004530194.b3lyp_6-31g(d).smash.inp (generated)

004530194.b3lyp_6-31g(d).nwchem.inp (generated) 004530194.b3lyp_6-31g(d).log.xz 004530194.td-b3lyp_6-31g+(d).inp 004530194.td-b3lyp_6-31g+(d).log.xz

004530194.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530194.td-b3lyp_6-31+g(d).gjf (generated)

004530194.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530194.mol 004530194.PUBCHEM 004530194.mol (via Jmol)
004530219.b3lyp_6-31g(d).inp

004530219.b3lyp_6-31g(d).qchem.inp (generated)

004530219.b3lyp_6-31g(d).gjf (generated)

004530219.b3lyp_6-31g(d).firefly.inp (generated)

004530219.b3lyp_6-31g(d).smash.inp (generated)

004530219.b3lyp_6-31g(d).nwchem.inp (generated) 004530219.b3lyp_6-31g(d).log.xz 004530219.td-b3lyp_6-31g+(d).inp 004530219.td-b3lyp_6-31g+(d).log.xz

004530219.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530219.td-b3lyp_6-31+g(d).gjf (generated)

004530219.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530219.mol 004530219.PUBCHEM 004530219.mol (via Jmol)
004530324.b3lyp_6-31g(d).inp

004530324.b3lyp_6-31g(d).qchem.inp (generated)

004530324.b3lyp_6-31g(d).gjf (generated)

004530324.b3lyp_6-31g(d).firefly.inp (generated)

004530324.b3lyp_6-31g(d).smash.inp (generated)

004530324.b3lyp_6-31g(d).nwchem.inp (generated) 004530324.b3lyp_6-31g(d).log.xz 004530324.td-b3lyp_6-31g+(d).inp 004530324.td-b3lyp_6-31g+(d).log.xz

004530324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530324.td-b3lyp_6-31+g(d).gjf (generated)

004530324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530324.mol 004530324.PUBCHEM 004530324.mol (via Jmol)
004530342.b3lyp_6-31g(d).inp

004530342.b3lyp_6-31g(d).qchem.inp (generated)

004530342.b3lyp_6-31g(d).gjf (generated)

004530342.b3lyp_6-31g(d).firefly.inp (generated)

004530342.b3lyp_6-31g(d).smash.inp (generated)

004530342.b3lyp_6-31g(d).nwchem.inp (generated) 004530342.b3lyp_6-31g(d).log.xz 004530342.td-b3lyp_6-31g+(d).inp 004530342.td-b3lyp_6-31g+(d).log.xz

004530342.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530342.td-b3lyp_6-31+g(d).gjf (generated)

004530342.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530342.mol 004530342.PUBCHEM 004530342.mol (via Jmol)
004530355.b3lyp_6-31g(d).inp

004530355.b3lyp_6-31g(d).qchem.inp (generated)

004530355.b3lyp_6-31g(d).gjf (generated)

004530355.b3lyp_6-31g(d).firefly.inp (generated)

004530355.b3lyp_6-31g(d).smash.inp (generated)

004530355.b3lyp_6-31g(d).nwchem.inp (generated) 004530355.b3lyp_6-31g(d).log.xz 004530355.mol 004530355.PUBCHEM 004530355.mol (via Jmol)
004530436.b3lyp_6-31g(d).inp

004530436.b3lyp_6-31g(d).qchem.inp (generated)

004530436.b3lyp_6-31g(d).gjf (generated)

004530436.b3lyp_6-31g(d).firefly.inp (generated)

004530436.b3lyp_6-31g(d).smash.inp (generated)

004530436.b3lyp_6-31g(d).nwchem.inp (generated) 004530436.b3lyp_6-31g(d).log.xz 004530436.td-b3lyp_6-31g+(d).inp 004530436.td-b3lyp_6-31g+(d).log.xz

004530436.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530436.td-b3lyp_6-31+g(d).gjf (generated)

004530436.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530436.mol 004530436.PUBCHEM 004530436.mol (via Jmol)
004530483.b3lyp_6-31g(d).inp

004530483.b3lyp_6-31g(d).qchem.inp (generated)

004530483.b3lyp_6-31g(d).gjf (generated)

004530483.b3lyp_6-31g(d).firefly.inp (generated)

004530483.b3lyp_6-31g(d).smash.inp (generated)

004530483.b3lyp_6-31g(d).nwchem.inp (generated) 004530483.b3lyp_6-31g(d).log.xz 004530483.td-b3lyp_6-31g+(d).inp 004530483.td-b3lyp_6-31g+(d).log.xz

004530483.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530483.td-b3lyp_6-31+g(d).gjf (generated)

004530483.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530483.mol 004530483.PUBCHEM 004530483.mol (via Jmol)
004530492.b3lyp_6-31g(d).inp

004530492.b3lyp_6-31g(d).qchem.inp (generated)

004530492.b3lyp_6-31g(d).gjf (generated)

004530492.b3lyp_6-31g(d).firefly.inp (generated)

004530492.b3lyp_6-31g(d).smash.inp (generated)

004530492.b3lyp_6-31g(d).nwchem.inp (generated) 004530492.b3lyp_6-31g(d).log.xz 004530492.td-b3lyp_6-31g+(d).inp 004530492.td-b3lyp_6-31g+(d).log.xz

004530492.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530492.td-b3lyp_6-31+g(d).gjf (generated)

004530492.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530492.mol 004530492.PUBCHEM 004530492.mol (via Jmol)
004530498.b3lyp_6-31g(d).inp

004530498.b3lyp_6-31g(d).qchem.inp (generated)

004530498.b3lyp_6-31g(d).gjf (generated)

004530498.b3lyp_6-31g(d).firefly.inp (generated)

004530498.b3lyp_6-31g(d).smash.inp (generated)

004530498.b3lyp_6-31g(d).nwchem.inp (generated) 004530498.b3lyp_6-31g(d).log.xz 004530498.mol 004530498.PUBCHEM 004530498.mol (via Jmol)
004530537.b3lyp_6-31g(d).inp

004530537.b3lyp_6-31g(d).qchem.inp (generated)

004530537.b3lyp_6-31g(d).gjf (generated)

004530537.b3lyp_6-31g(d).firefly.inp (generated)

004530537.b3lyp_6-31g(d).smash.inp (generated)

004530537.b3lyp_6-31g(d).nwchem.inp (generated) 004530537.b3lyp_6-31g(d).log.xz 004530537.td-b3lyp_6-31g+(d).inp 004530537.td-b3lyp_6-31g+(d).log.xz

004530537.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530537.td-b3lyp_6-31+g(d).gjf (generated)

004530537.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530537.mol 004530537.PUBCHEM 004530537.mol (via Jmol)
004530576.b3lyp_6-31g(d).inp

004530576.b3lyp_6-31g(d).qchem.inp (generated)

004530576.b3lyp_6-31g(d).gjf (generated)

004530576.b3lyp_6-31g(d).firefly.inp (generated)

004530576.b3lyp_6-31g(d).smash.inp (generated)

004530576.b3lyp_6-31g(d).nwchem.inp (generated) 004530576.b3lyp_6-31g(d).log.xz 004530576.td-b3lyp_6-31g+(d).inp 004530576.td-b3lyp_6-31g+(d).log.xz

004530576.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530576.td-b3lyp_6-31+g(d).gjf (generated)

004530576.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530576.mol 004530576.PUBCHEM 004530576.mol (via Jmol)
004530587.b3lyp_6-31g(d).inp

004530587.b3lyp_6-31g(d).qchem.inp (generated)

004530587.b3lyp_6-31g(d).gjf (generated)

004530587.b3lyp_6-31g(d).firefly.inp (generated)

004530587.b3lyp_6-31g(d).smash.inp (generated)

004530587.b3lyp_6-31g(d).nwchem.inp (generated) 004530587.b3lyp_6-31g(d).log.xz 004530587.td-b3lyp_6-31g+(d).inp 004530587.td-b3lyp_6-31g+(d).log.xz

004530587.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530587.td-b3lyp_6-31+g(d).gjf (generated)

004530587.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530587.mol 004530587.PUBCHEM 004530587.mol (via Jmol)
004530776.b3lyp_6-31g(d).inp

004530776.b3lyp_6-31g(d).qchem.inp (generated)

004530776.b3lyp_6-31g(d).gjf (generated)

004530776.b3lyp_6-31g(d).firefly.inp (generated)

004530776.b3lyp_6-31g(d).smash.inp (generated)

004530776.b3lyp_6-31g(d).nwchem.inp (generated) 004530776.b3lyp_6-31g(d).log.xz 004530776.mol 004530776.PUBCHEM 004530776.mol (via Jmol)
004530815.b3lyp_6-31g(d).inp

004530815.b3lyp_6-31g(d).qchem.inp (generated)

004530815.b3lyp_6-31g(d).gjf (generated)

004530815.b3lyp_6-31g(d).firefly.inp (generated)

004530815.b3lyp_6-31g(d).smash.inp (generated)

004530815.b3lyp_6-31g(d).nwchem.inp (generated) 004530815.b3lyp_6-31g(d).log.xz 004530815.td-b3lyp_6-31g+(d).inp 004530815.td-b3lyp_6-31g+(d).log.xz

004530815.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530815.td-b3lyp_6-31+g(d).gjf (generated)

004530815.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530815.mol 004530815.PUBCHEM 004530815.mol (via Jmol)
004530847.b3lyp_6-31g(d).inp

004530847.b3lyp_6-31g(d).qchem.inp (generated)

004530847.b3lyp_6-31g(d).gjf (generated)

004530847.b3lyp_6-31g(d).firefly.inp (generated)

004530847.b3lyp_6-31g(d).smash.inp (generated)

004530847.b3lyp_6-31g(d).nwchem.inp (generated) 004530847.b3lyp_6-31g(d).log.xz 004530847.td-b3lyp_6-31g+(d).inp 004530847.td-b3lyp_6-31g+(d).log.xz

004530847.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530847.td-b3lyp_6-31+g(d).gjf (generated)

004530847.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530847.mol 004530847.PUBCHEM 004530847.mol (via Jmol)
004530855.b3lyp_6-31g(d).inp

004530855.b3lyp_6-31g(d).qchem.inp (generated)

004530855.b3lyp_6-31g(d).gjf (generated)

004530855.b3lyp_6-31g(d).firefly.inp (generated)

004530855.b3lyp_6-31g(d).smash.inp (generated)

004530855.b3lyp_6-31g(d).nwchem.inp (generated) 004530855.b3lyp_6-31g(d).log.xz 004530855.td-b3lyp_6-31g+(d).inp 004530855.td-b3lyp_6-31g+(d).log.xz

004530855.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530855.td-b3lyp_6-31+g(d).gjf (generated)

004530855.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530855.mol 004530855.PUBCHEM 004530855.mol (via Jmol)
004530976.b3lyp_6-31g(d).inp

004530976.b3lyp_6-31g(d).qchem.inp (generated)

004530976.b3lyp_6-31g(d).gjf (generated)

004530976.b3lyp_6-31g(d).firefly.inp (generated)

004530976.b3lyp_6-31g(d).smash.inp (generated)

004530976.b3lyp_6-31g(d).nwchem.inp (generated) 004530976.b3lyp_6-31g(d).log.xz 004530976.td-b3lyp_6-31g+(d).inp 004530976.td-b3lyp_6-31g+(d).log.xz

004530976.td-b3lyp_6-31+g(d).qchem.inp (generated)

004530976.td-b3lyp_6-31+g(d).gjf (generated)

004530976.td-b3lyp_6-31+g(d).firefly.inp (generated)

004530976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004530976.mol 004530976.PUBCHEM 004530976.mol (via Jmol)
004531042.b3lyp_6-31g(d).inp

004531042.b3lyp_6-31g(d).qchem.inp (generated)

004531042.b3lyp_6-31g(d).gjf (generated)

004531042.b3lyp_6-31g(d).firefly.inp (generated)

004531042.b3lyp_6-31g(d).smash.inp (generated)

004531042.b3lyp_6-31g(d).nwchem.inp (generated) 004531042.b3lyp_6-31g(d).log.xz 004531042.td-b3lyp_6-31g+(d).inp 004531042.td-b3lyp_6-31g+(d).log.xz

004531042.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531042.td-b3lyp_6-31+g(d).gjf (generated)

004531042.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531042.mol 004531042.PUBCHEM 004531042.mol (via Jmol)
004531047.b3lyp_6-31g(d).inp

004531047.b3lyp_6-31g(d).qchem.inp (generated)

004531047.b3lyp_6-31g(d).gjf (generated)

004531047.b3lyp_6-31g(d).firefly.inp (generated)

004531047.b3lyp_6-31g(d).smash.inp (generated)

004531047.b3lyp_6-31g(d).nwchem.inp (generated) 004531047.b3lyp_6-31g(d).log.xz 004531047.mol 004531047.PUBCHEM 004531047.mol (via Jmol)
004531066.b3lyp_6-31g(d).inp

004531066.b3lyp_6-31g(d).qchem.inp (generated)

004531066.b3lyp_6-31g(d).gjf (generated)

004531066.b3lyp_6-31g(d).firefly.inp (generated)

004531066.b3lyp_6-31g(d).smash.inp (generated)

004531066.b3lyp_6-31g(d).nwchem.inp (generated) 004531066.b3lyp_6-31g(d).log.xz 004531066.td-b3lyp_6-31g+(d).inp 004531066.td-b3lyp_6-31g+(d).log.xz

004531066.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531066.td-b3lyp_6-31+g(d).gjf (generated)

004531066.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531066.mol 004531066.PUBCHEM 004531066.mol (via Jmol)
004531075.b3lyp_6-31g(d).inp

004531075.b3lyp_6-31g(d).qchem.inp (generated)

004531075.b3lyp_6-31g(d).gjf (generated)

004531075.b3lyp_6-31g(d).firefly.inp (generated)

004531075.b3lyp_6-31g(d).smash.inp (generated)

004531075.b3lyp_6-31g(d).nwchem.inp (generated) 004531075.b3lyp_6-31g(d).log.xz 004531075.td-b3lyp_6-31g+(d).inp 004531075.td-b3lyp_6-31g+(d).log.xz

004531075.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531075.td-b3lyp_6-31+g(d).gjf (generated)

004531075.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531075.mol 004531075.PUBCHEM 004531075.mol (via Jmol)
004531145.b3lyp_6-31g(d).inp

004531145.b3lyp_6-31g(d).qchem.inp (generated)

004531145.b3lyp_6-31g(d).gjf (generated)

004531145.b3lyp_6-31g(d).firefly.inp (generated)

004531145.b3lyp_6-31g(d).smash.inp (generated)

004531145.b3lyp_6-31g(d).nwchem.inp (generated) 004531145.b3lyp_6-31g(d).log.xz 004531145.mol 004531145.PUBCHEM 004531145.mol (via Jmol)
004531147.b3lyp_6-31g(d).inp

004531147.b3lyp_6-31g(d).qchem.inp (generated)

004531147.b3lyp_6-31g(d).gjf (generated)

004531147.b3lyp_6-31g(d).firefly.inp (generated)

004531147.b3lyp_6-31g(d).smash.inp (generated)

004531147.b3lyp_6-31g(d).nwchem.inp (generated) 004531147.b3lyp_6-31g(d).log.xz 004531147.td-b3lyp_6-31g+(d).inp 004531147.td-b3lyp_6-31g+(d).log.xz

004531147.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531147.td-b3lyp_6-31+g(d).gjf (generated)

004531147.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531147.mol 004531147.PUBCHEM 004531147.mol (via Jmol)
004531187.b3lyp_6-31g(d).inp

004531187.b3lyp_6-31g(d).qchem.inp (generated)

004531187.b3lyp_6-31g(d).gjf (generated)

004531187.b3lyp_6-31g(d).firefly.inp (generated)

004531187.b3lyp_6-31g(d).smash.inp (generated)

004531187.b3lyp_6-31g(d).nwchem.inp (generated) 004531187.b3lyp_6-31g(d).log.xz 004531187.td-b3lyp_6-31g+(d).inp 004531187.td-b3lyp_6-31g+(d).log.xz

004531187.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531187.td-b3lyp_6-31+g(d).gjf (generated)

004531187.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531187.mol 004531187.PUBCHEM 004531187.mol (via Jmol)
004531188.b3lyp_6-31g(d).inp

004531188.b3lyp_6-31g(d).qchem.inp (generated)

004531188.b3lyp_6-31g(d).gjf (generated)

004531188.b3lyp_6-31g(d).firefly.inp (generated)

004531188.b3lyp_6-31g(d).smash.inp (generated)

004531188.b3lyp_6-31g(d).nwchem.inp (generated) 004531188.b3lyp_6-31g(d).log.xz 004531188.td-b3lyp_6-31g+(d).inp 004531188.td-b3lyp_6-31g+(d).log.xz

004531188.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531188.td-b3lyp_6-31+g(d).gjf (generated)

004531188.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531188.mol 004531188.PUBCHEM 004531188.mol (via Jmol)
004531219.b3lyp_6-31g(d).inp

004531219.b3lyp_6-31g(d).qchem.inp (generated)

004531219.b3lyp_6-31g(d).gjf (generated)

004531219.b3lyp_6-31g(d).firefly.inp (generated)

004531219.b3lyp_6-31g(d).smash.inp (generated)

004531219.b3lyp_6-31g(d).nwchem.inp (generated) 004531219.b3lyp_6-31g(d).log.xz 004531219.td-b3lyp_6-31g+(d).inp 004531219.td-b3lyp_6-31g+(d).log.xz

004531219.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531219.td-b3lyp_6-31+g(d).gjf (generated)

004531219.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531219.mol 004531219.PUBCHEM 004531219.mol (via Jmol)
004531340.b3lyp_6-31g(d).inp

004531340.b3lyp_6-31g(d).qchem.inp (generated)

004531340.b3lyp_6-31g(d).gjf (generated)

004531340.b3lyp_6-31g(d).firefly.inp (generated)

004531340.b3lyp_6-31g(d).smash.inp (generated)

004531340.b3lyp_6-31g(d).nwchem.inp (generated) 004531340.b3lyp_6-31g(d).log.xz 004531340.td-b3lyp_6-31g+(d).inp 004531340.td-b3lyp_6-31g+(d).log.xz

004531340.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531340.td-b3lyp_6-31+g(d).gjf (generated)

004531340.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531340.mol 004531340.PUBCHEM 004531340.mol (via Jmol)
004531357.b3lyp_6-31g(d).inp

004531357.b3lyp_6-31g(d).qchem.inp (generated)

004531357.b3lyp_6-31g(d).gjf (generated)

004531357.b3lyp_6-31g(d).firefly.inp (generated)

004531357.b3lyp_6-31g(d).smash.inp (generated)

004531357.b3lyp_6-31g(d).nwchem.inp (generated) 004531357.b3lyp_6-31g(d).log.xz 004531357.td-b3lyp_6-31g+(d).inp 004531357.td-b3lyp_6-31g+(d).log.xz

004531357.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531357.td-b3lyp_6-31+g(d).gjf (generated)

004531357.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531357.mol 004531357.PUBCHEM 004531357.mol (via Jmol)
004531437.b3lyp_6-31g(d).inp

004531437.b3lyp_6-31g(d).qchem.inp (generated)

004531437.b3lyp_6-31g(d).gjf (generated)

004531437.b3lyp_6-31g(d).firefly.inp (generated)

004531437.b3lyp_6-31g(d).smash.inp (generated)

004531437.b3lyp_6-31g(d).nwchem.inp (generated) 004531437.b3lyp_6-31g(d).log.xz 004531437.td-b3lyp_6-31g+(d).inp 004531437.td-b3lyp_6-31g+(d).log.xz

004531437.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531437.td-b3lyp_6-31+g(d).gjf (generated)

004531437.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531437.mol 004531437.PUBCHEM 004531437.mol (via Jmol)
004531450.b3lyp_6-31g(d).inp

004531450.b3lyp_6-31g(d).qchem.inp (generated)

004531450.b3lyp_6-31g(d).gjf (generated)

004531450.b3lyp_6-31g(d).firefly.inp (generated)

004531450.b3lyp_6-31g(d).smash.inp (generated)

004531450.b3lyp_6-31g(d).nwchem.inp (generated) 004531450.b3lyp_6-31g(d).log.xz 004531450.td-b3lyp_6-31g+(d).inp 004531450.td-b3lyp_6-31g+(d).log.xz

004531450.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531450.td-b3lyp_6-31+g(d).gjf (generated)

004531450.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531450.mol 004531450.PUBCHEM 004531450.mol (via Jmol)
004531481.b3lyp_6-31g(d).inp

004531481.b3lyp_6-31g(d).qchem.inp (generated)

004531481.b3lyp_6-31g(d).gjf (generated)

004531481.b3lyp_6-31g(d).firefly.inp (generated)

004531481.b3lyp_6-31g(d).smash.inp (generated)

004531481.b3lyp_6-31g(d).nwchem.inp (generated) 004531481.b3lyp_6-31g(d).log.xz 004531481.mol 004531481.PUBCHEM 004531481.mol (via Jmol)
004531500.b3lyp_6-31g(d).inp

004531500.b3lyp_6-31g(d).qchem.inp (generated)

004531500.b3lyp_6-31g(d).gjf (generated)

004531500.b3lyp_6-31g(d).firefly.inp (generated)

004531500.b3lyp_6-31g(d).smash.inp (generated)

004531500.b3lyp_6-31g(d).nwchem.inp (generated) 004531500.b3lyp_6-31g(d).log.xz 004531500.td-b3lyp_6-31g+(d).inp 004531500.td-b3lyp_6-31g+(d).log.xz

004531500.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531500.td-b3lyp_6-31+g(d).gjf (generated)

004531500.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531500.mol 004531500.PUBCHEM 004531500.mol (via Jmol)
004531516.b3lyp_6-31g(d).inp

004531516.b3lyp_6-31g(d).qchem.inp (generated)

004531516.b3lyp_6-31g(d).gjf (generated)

004531516.b3lyp_6-31g(d).firefly.inp (generated)

004531516.b3lyp_6-31g(d).smash.inp (generated)

004531516.b3lyp_6-31g(d).nwchem.inp (generated) 004531516.b3lyp_6-31g(d).log.xz 004531516.td-b3lyp_6-31g+(d).inp 004531516.td-b3lyp_6-31g+(d).log.xz

004531516.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531516.td-b3lyp_6-31+g(d).gjf (generated)

004531516.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531516.mol 004531516.PUBCHEM 004531516.mol (via Jmol)
004531531.b3lyp_6-31g(d).inp

004531531.b3lyp_6-31g(d).qchem.inp (generated)

004531531.b3lyp_6-31g(d).gjf (generated)

004531531.b3lyp_6-31g(d).firefly.inp (generated)

004531531.b3lyp_6-31g(d).smash.inp (generated)

004531531.b3lyp_6-31g(d).nwchem.inp (generated) 004531531.b3lyp_6-31g(d).log.xz 004531531.td-b3lyp_6-31g+(d).inp 004531531.td-b3lyp_6-31g+(d).log.xz

004531531.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531531.td-b3lyp_6-31+g(d).gjf (generated)

004531531.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531531.mol 004531531.PUBCHEM 004531531.mol (via Jmol)
004531538.b3lyp_6-31g(d).inp

004531538.b3lyp_6-31g(d).qchem.inp (generated)

004531538.b3lyp_6-31g(d).gjf (generated)

004531538.b3lyp_6-31g(d).firefly.inp (generated)

004531538.b3lyp_6-31g(d).smash.inp (generated)

004531538.b3lyp_6-31g(d).nwchem.inp (generated) 004531538.b3lyp_6-31g(d).log.xz 004531538.td-b3lyp_6-31g+(d).inp 004531538.td-b3lyp_6-31g+(d).log.xz

004531538.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531538.td-b3lyp_6-31+g(d).gjf (generated)

004531538.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531538.mol 004531538.PUBCHEM 004531538.mol (via Jmol)
004531620.b3lyp_6-31g(d).inp

004531620.b3lyp_6-31g(d).qchem.inp (generated)

004531620.b3lyp_6-31g(d).gjf (generated)

004531620.b3lyp_6-31g(d).firefly.inp (generated)

004531620.b3lyp_6-31g(d).smash.inp (generated)

004531620.b3lyp_6-31g(d).nwchem.inp (generated) 004531620.b3lyp_6-31g(d).log.xz 004531620.td-b3lyp_6-31g+(d).inp 004531620.td-b3lyp_6-31g+(d).log.xz

004531620.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531620.td-b3lyp_6-31+g(d).gjf (generated)

004531620.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531620.mol 004531620.PUBCHEM 004531620.mol (via Jmol)
004531702.b3lyp_6-31g(d).inp

004531702.b3lyp_6-31g(d).qchem.inp (generated)

004531702.b3lyp_6-31g(d).gjf (generated)

004531702.b3lyp_6-31g(d).firefly.inp (generated)

004531702.b3lyp_6-31g(d).smash.inp (generated)

004531702.b3lyp_6-31g(d).nwchem.inp (generated) 004531702.b3lyp_6-31g(d).log.xz 004531702.td-b3lyp_6-31g+(d).inp 004531702.td-b3lyp_6-31g+(d).log.xz

004531702.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531702.td-b3lyp_6-31+g(d).gjf (generated)

004531702.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531702.mol 004531702.PUBCHEM 004531702.mol (via Jmol)
004531741.b3lyp_6-31g(d).inp

004531741.b3lyp_6-31g(d).qchem.inp (generated)

004531741.b3lyp_6-31g(d).gjf (generated)

004531741.b3lyp_6-31g(d).firefly.inp (generated)

004531741.b3lyp_6-31g(d).smash.inp (generated)

004531741.b3lyp_6-31g(d).nwchem.inp (generated) 004531741.b3lyp_6-31g(d).log.xz 004531741.td-b3lyp_6-31g+(d).inp 004531741.td-b3lyp_6-31g+(d).log.xz

004531741.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531741.td-b3lyp_6-31+g(d).gjf (generated)

004531741.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531741.mol 004531741.PUBCHEM 004531741.mol (via Jmol)
004531765.b3lyp_6-31g(d).inp

004531765.b3lyp_6-31g(d).qchem.inp (generated)

004531765.b3lyp_6-31g(d).gjf (generated)

004531765.b3lyp_6-31g(d).firefly.inp (generated)

004531765.b3lyp_6-31g(d).smash.inp (generated)

004531765.b3lyp_6-31g(d).nwchem.inp (generated) 004531765.b3lyp_6-31g(d).log.xz 004531765.td-b3lyp_6-31g+(d).inp 004531765.td-b3lyp_6-31g+(d).log.xz

004531765.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531765.td-b3lyp_6-31+g(d).gjf (generated)

004531765.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531765.mol 004531765.PUBCHEM 004531765.mol (via Jmol)
004531771.b3lyp_6-31g(d).inp

004531771.b3lyp_6-31g(d).qchem.inp (generated)

004531771.b3lyp_6-31g(d).gjf (generated)

004531771.b3lyp_6-31g(d).firefly.inp (generated)

004531771.b3lyp_6-31g(d).smash.inp (generated)

004531771.b3lyp_6-31g(d).nwchem.inp (generated) 004531771.b3lyp_6-31g(d).log.xz 004531771.td-b3lyp_6-31g+(d).inp 004531771.td-b3lyp_6-31g+(d).log.xz

004531771.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531771.td-b3lyp_6-31+g(d).gjf (generated)

004531771.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531771.mol 004531771.PUBCHEM 004531771.mol (via Jmol)
004531877.b3lyp_6-31g(d).inp

004531877.b3lyp_6-31g(d).qchem.inp (generated)

004531877.b3lyp_6-31g(d).gjf (generated)

004531877.b3lyp_6-31g(d).firefly.inp (generated)

004531877.b3lyp_6-31g(d).smash.inp (generated)

004531877.b3lyp_6-31g(d).nwchem.inp (generated) 004531877.b3lyp_6-31g(d).log.xz 004531877.td-b3lyp_6-31g+(d).inp 004531877.td-b3lyp_6-31g+(d).log.xz

004531877.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531877.td-b3lyp_6-31+g(d).gjf (generated)

004531877.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531877.mol 004531877.PUBCHEM 004531877.mol (via Jmol)
004531896.b3lyp_6-31g(d).inp

004531896.b3lyp_6-31g(d).qchem.inp (generated)

004531896.b3lyp_6-31g(d).gjf (generated)

004531896.b3lyp_6-31g(d).firefly.inp (generated)

004531896.b3lyp_6-31g(d).smash.inp (generated)

004531896.b3lyp_6-31g(d).nwchem.inp (generated) 004531896.b3lyp_6-31g(d).log.xz 004531896.td-b3lyp_6-31g+(d).inp 004531896.td-b3lyp_6-31g+(d).log.xz

004531896.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531896.td-b3lyp_6-31+g(d).gjf (generated)

004531896.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531896.mol 004531896.PUBCHEM 004531896.mol (via Jmol)
004531916.b3lyp_6-31g(d).inp

004531916.b3lyp_6-31g(d).qchem.inp (generated)

004531916.b3lyp_6-31g(d).gjf (generated)

004531916.b3lyp_6-31g(d).firefly.inp (generated)

004531916.b3lyp_6-31g(d).smash.inp (generated)

004531916.b3lyp_6-31g(d).nwchem.inp (generated) 004531916.b3lyp_6-31g(d).log.xz 004531916.td-b3lyp_6-31g+(d).inp 004531916.td-b3lyp_6-31g+(d).log.xz

004531916.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531916.td-b3lyp_6-31+g(d).gjf (generated)

004531916.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531916.mol 004531916.PUBCHEM 004531916.mol (via Jmol)
004531918.b3lyp_6-31g(d).inp

004531918.b3lyp_6-31g(d).qchem.inp (generated)

004531918.b3lyp_6-31g(d).gjf (generated)

004531918.b3lyp_6-31g(d).firefly.inp (generated)

004531918.b3lyp_6-31g(d).smash.inp (generated)

004531918.b3lyp_6-31g(d).nwchem.inp (generated) 004531918.b3lyp_6-31g(d).log.xz 004531918.td-b3lyp_6-31g+(d).inp 004531918.td-b3lyp_6-31g+(d).log.xz

004531918.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531918.td-b3lyp_6-31+g(d).gjf (generated)

004531918.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531918.mol 004531918.PUBCHEM 004531918.mol (via Jmol)
004531925.b3lyp_6-31g(d).inp

004531925.b3lyp_6-31g(d).qchem.inp (generated)

004531925.b3lyp_6-31g(d).gjf (generated)

004531925.b3lyp_6-31g(d).firefly.inp (generated)

004531925.b3lyp_6-31g(d).smash.inp (generated)

004531925.b3lyp_6-31g(d).nwchem.inp (generated) 004531925.b3lyp_6-31g(d).log.xz 004531925.td-b3lyp_6-31g+(d).inp 004531925.td-b3lyp_6-31g+(d).log.xz

004531925.td-b3lyp_6-31+g(d).qchem.inp (generated)

004531925.td-b3lyp_6-31+g(d).gjf (generated)

004531925.td-b3lyp_6-31+g(d).firefly.inp (generated)

004531925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004531925.mol 004531925.PUBCHEM 004531925.mol (via Jmol)
004532027.b3lyp_6-31g(d).inp

004532027.b3lyp_6-31g(d).qchem.inp (generated)

004532027.b3lyp_6-31g(d).gjf (generated)

004532027.b3lyp_6-31g(d).firefly.inp (generated)

004532027.b3lyp_6-31g(d).smash.inp (generated)

004532027.b3lyp_6-31g(d).nwchem.inp (generated) 004532027.b3lyp_6-31g(d).log.xz 004532027.td-b3lyp_6-31g+(d).inp 004532027.td-b3lyp_6-31g+(d).log.xz

004532027.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532027.td-b3lyp_6-31+g(d).gjf (generated)

004532027.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532027.mol 004532027.PUBCHEM 004532027.mol (via Jmol)
004532030.b3lyp_6-31g(d).inp

004532030.b3lyp_6-31g(d).qchem.inp (generated)

004532030.b3lyp_6-31g(d).gjf (generated)

004532030.b3lyp_6-31g(d).firefly.inp (generated)

004532030.b3lyp_6-31g(d).smash.inp (generated)

004532030.b3lyp_6-31g(d).nwchem.inp (generated) 004532030.b3lyp_6-31g(d).log.xz 004532030.td-b3lyp_6-31g+(d).inp 004532030.td-b3lyp_6-31g+(d).log.xz

004532030.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532030.td-b3lyp_6-31+g(d).gjf (generated)

004532030.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532030.mol 004532030.PUBCHEM 004532030.mol (via Jmol)
004532059.b3lyp_6-31g(d).inp

004532059.b3lyp_6-31g(d).qchem.inp (generated)

004532059.b3lyp_6-31g(d).gjf (generated)

004532059.b3lyp_6-31g(d).firefly.inp (generated)

004532059.b3lyp_6-31g(d).smash.inp (generated)

004532059.b3lyp_6-31g(d).nwchem.inp (generated) 004532059.b3lyp_6-31g(d).log.xz 004532059.td-b3lyp_6-31g+(d).inp 004532059.td-b3lyp_6-31g+(d).log.xz

004532059.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532059.td-b3lyp_6-31+g(d).gjf (generated)

004532059.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532059.mol 004532059.PUBCHEM 004532059.mol (via Jmol)
004532091.b3lyp_6-31g(d).inp

004532091.b3lyp_6-31g(d).qchem.inp (generated)

004532091.b3lyp_6-31g(d).gjf (generated)

004532091.b3lyp_6-31g(d).firefly.inp (generated)

004532091.b3lyp_6-31g(d).smash.inp (generated)

004532091.b3lyp_6-31g(d).nwchem.inp (generated) 004532091.b3lyp_6-31g(d).log.xz 004532091.td-b3lyp_6-31g+(d).inp 004532091.td-b3lyp_6-31g+(d).log.xz

004532091.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532091.td-b3lyp_6-31+g(d).gjf (generated)

004532091.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532091.mol 004532091.PUBCHEM 004532091.mol (via Jmol)
004532123.b3lyp_6-31g(d).inp

004532123.b3lyp_6-31g(d).qchem.inp (generated)

004532123.b3lyp_6-31g(d).gjf (generated)

004532123.b3lyp_6-31g(d).firefly.inp (generated)

004532123.b3lyp_6-31g(d).smash.inp (generated)

004532123.b3lyp_6-31g(d).nwchem.inp (generated) 004532123.b3lyp_6-31g(d).log.xz 004532123.td-b3lyp_6-31g+(d).inp 004532123.td-b3lyp_6-31g+(d).log.xz

004532123.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532123.td-b3lyp_6-31+g(d).gjf (generated)

004532123.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532123.mol 004532123.PUBCHEM 004532123.mol (via Jmol)
004532167.b3lyp_6-31g(d).inp

004532167.b3lyp_6-31g(d).qchem.inp (generated)

004532167.b3lyp_6-31g(d).gjf (generated)

004532167.b3lyp_6-31g(d).firefly.inp (generated)

004532167.b3lyp_6-31g(d).smash.inp (generated)

004532167.b3lyp_6-31g(d).nwchem.inp (generated) 004532167.b3lyp_6-31g(d).log.xz 004532167.td-b3lyp_6-31g+(d).inp 004532167.td-b3lyp_6-31g+(d).log.xz

004532167.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532167.td-b3lyp_6-31+g(d).gjf (generated)

004532167.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532167.mol 004532167.PUBCHEM 004532167.mol (via Jmol)
004532218.b3lyp_6-31g(d).inp

004532218.b3lyp_6-31g(d).qchem.inp (generated)

004532218.b3lyp_6-31g(d).gjf (generated)

004532218.b3lyp_6-31g(d).firefly.inp (generated)

004532218.b3lyp_6-31g(d).smash.inp (generated)

004532218.b3lyp_6-31g(d).nwchem.inp (generated) 004532218.b3lyp_6-31g(d).log.xz 004532218.td-b3lyp_6-31g+(d).inp 004532218.td-b3lyp_6-31g+(d).log.xz

004532218.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532218.td-b3lyp_6-31+g(d).gjf (generated)

004532218.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532218.mol 004532218.PUBCHEM 004532218.mol (via Jmol)
004532220.b3lyp_6-31g(d).inp

004532220.b3lyp_6-31g(d).qchem.inp (generated)

004532220.b3lyp_6-31g(d).gjf (generated)

004532220.b3lyp_6-31g(d).firefly.inp (generated)

004532220.b3lyp_6-31g(d).smash.inp (generated)

004532220.b3lyp_6-31g(d).nwchem.inp (generated) 004532220.b3lyp_6-31g(d).log.xz 004532220.td-b3lyp_6-31g+(d).inp 004532220.td-b3lyp_6-31g+(d).log.xz

004532220.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532220.td-b3lyp_6-31+g(d).gjf (generated)

004532220.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532220.mol 004532220.PUBCHEM 004532220.mol (via Jmol)
004532224.b3lyp_6-31g(d).inp

004532224.b3lyp_6-31g(d).qchem.inp (generated)

004532224.b3lyp_6-31g(d).gjf (generated)

004532224.b3lyp_6-31g(d).firefly.inp (generated)

004532224.b3lyp_6-31g(d).smash.inp (generated)

004532224.b3lyp_6-31g(d).nwchem.inp (generated) 004532224.b3lyp_6-31g(d).log.xz 004532224.td-b3lyp_6-31g+(d).inp 004532224.td-b3lyp_6-31g+(d).log.xz

004532224.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532224.td-b3lyp_6-31+g(d).gjf (generated)

004532224.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532224.mol 004532224.PUBCHEM 004532224.mol (via Jmol)
004532242.b3lyp_6-31g(d).inp

004532242.b3lyp_6-31g(d).qchem.inp (generated)

004532242.b3lyp_6-31g(d).gjf (generated)

004532242.b3lyp_6-31g(d).firefly.inp (generated)

004532242.b3lyp_6-31g(d).smash.inp (generated)

004532242.b3lyp_6-31g(d).nwchem.inp (generated) 004532242.b3lyp_6-31g(d).log.xz 004532242.td-b3lyp_6-31g+(d).inp 004532242.td-b3lyp_6-31g+(d).log.xz

004532242.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532242.td-b3lyp_6-31+g(d).gjf (generated)

004532242.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532242.mol 004532242.PUBCHEM 004532242.mol (via Jmol)
004532294.b3lyp_6-31g(d).inp

004532294.b3lyp_6-31g(d).qchem.inp (generated)

004532294.b3lyp_6-31g(d).gjf (generated)

004532294.b3lyp_6-31g(d).firefly.inp (generated)

004532294.b3lyp_6-31g(d).smash.inp (generated)

004532294.b3lyp_6-31g(d).nwchem.inp (generated) 004532294.b3lyp_6-31g(d).log.xz 004532294.td-b3lyp_6-31g+(d).inp 004532294.td-b3lyp_6-31g+(d).log.xz

004532294.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532294.td-b3lyp_6-31+g(d).gjf (generated)

004532294.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532294.mol 004532294.PUBCHEM 004532294.mol (via Jmol)
004532444.b3lyp_6-31g(d).inp

004532444.b3lyp_6-31g(d).qchem.inp (generated)

004532444.b3lyp_6-31g(d).gjf (generated)

004532444.b3lyp_6-31g(d).firefly.inp (generated)

004532444.b3lyp_6-31g(d).smash.inp (generated)

004532444.b3lyp_6-31g(d).nwchem.inp (generated) 004532444.b3lyp_6-31g(d).log.xz 004532444.td-b3lyp_6-31g+(d).inp 004532444.td-b3lyp_6-31g+(d).log.xz

004532444.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532444.td-b3lyp_6-31+g(d).gjf (generated)

004532444.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532444.mol 004532444.PUBCHEM 004532444.mol (via Jmol)
004532577.b3lyp_6-31g(d).inp

004532577.b3lyp_6-31g(d).qchem.inp (generated)

004532577.b3lyp_6-31g(d).gjf (generated)

004532577.b3lyp_6-31g(d).firefly.inp (generated)

004532577.b3lyp_6-31g(d).smash.inp (generated)

004532577.b3lyp_6-31g(d).nwchem.inp (generated) 004532577.b3lyp_6-31g(d).log.xz 004532577.td-b3lyp_6-31g+(d).inp 004532577.td-b3lyp_6-31g+(d).log.xz

004532577.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532577.td-b3lyp_6-31+g(d).gjf (generated)

004532577.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532577.mol 004532577.PUBCHEM 004532577.mol (via Jmol)
004532672.b3lyp_6-31g(d).inp

004532672.b3lyp_6-31g(d).qchem.inp (generated)

004532672.b3lyp_6-31g(d).gjf (generated)

004532672.b3lyp_6-31g(d).firefly.inp (generated)

004532672.b3lyp_6-31g(d).smash.inp (generated)

004532672.b3lyp_6-31g(d).nwchem.inp (generated) 004532672.b3lyp_6-31g(d).log.xz 004532672.td-b3lyp_6-31g+(d).inp 004532672.td-b3lyp_6-31g+(d).log.xz

004532672.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532672.td-b3lyp_6-31+g(d).gjf (generated)

004532672.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532672.mol 004532672.PUBCHEM 004532672.mol (via Jmol)
004532673.b3lyp_6-31g(d).inp

004532673.b3lyp_6-31g(d).qchem.inp (generated)

004532673.b3lyp_6-31g(d).gjf (generated)

004532673.b3lyp_6-31g(d).firefly.inp (generated)

004532673.b3lyp_6-31g(d).smash.inp (generated)

004532673.b3lyp_6-31g(d).nwchem.inp (generated) 004532673.b3lyp_6-31g(d).log.xz 004532673.td-b3lyp_6-31g+(d).inp 004532673.td-b3lyp_6-31g+(d).log.xz

004532673.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532673.td-b3lyp_6-31+g(d).gjf (generated)

004532673.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532673.mol 004532673.PUBCHEM 004532673.mol (via Jmol)
004532724.b3lyp_6-31g(d).inp

004532724.b3lyp_6-31g(d).qchem.inp (generated)

004532724.b3lyp_6-31g(d).gjf (generated)

004532724.b3lyp_6-31g(d).firefly.inp (generated)

004532724.b3lyp_6-31g(d).smash.inp (generated)

004532724.b3lyp_6-31g(d).nwchem.inp (generated) 004532724.b3lyp_6-31g(d).log.xz 004532724.td-b3lyp_6-31g+(d).inp 004532724.td-b3lyp_6-31g+(d).log.xz

004532724.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532724.td-b3lyp_6-31+g(d).gjf (generated)

004532724.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532724.mol 004532724.PUBCHEM 004532724.mol (via Jmol)
004532730.b3lyp_6-31g(d).inp

004532730.b3lyp_6-31g(d).qchem.inp (generated)

004532730.b3lyp_6-31g(d).gjf (generated)

004532730.b3lyp_6-31g(d).firefly.inp (generated)

004532730.b3lyp_6-31g(d).smash.inp (generated)

004532730.b3lyp_6-31g(d).nwchem.inp (generated) 004532730.b3lyp_6-31g(d).log.xz 004532730.td-b3lyp_6-31g+(d).inp 004532730.td-b3lyp_6-31g+(d).log.xz

004532730.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532730.td-b3lyp_6-31+g(d).gjf (generated)

004532730.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532730.mol 004532730.PUBCHEM 004532730.mol (via Jmol)
004532742.b3lyp_6-31g(d).inp

004532742.b3lyp_6-31g(d).qchem.inp (generated)

004532742.b3lyp_6-31g(d).gjf (generated)

004532742.b3lyp_6-31g(d).firefly.inp (generated)

004532742.b3lyp_6-31g(d).smash.inp (generated)

004532742.b3lyp_6-31g(d).nwchem.inp (generated) 004532742.b3lyp_6-31g(d).log.xz 004532742.mol 004532742.PUBCHEM 004532742.mol (via Jmol)
004532762.b3lyp_6-31g(d).inp

004532762.b3lyp_6-31g(d).qchem.inp (generated)

004532762.b3lyp_6-31g(d).gjf (generated)

004532762.b3lyp_6-31g(d).firefly.inp (generated)

004532762.b3lyp_6-31g(d).smash.inp (generated)

004532762.b3lyp_6-31g(d).nwchem.inp (generated) 004532762.b3lyp_6-31g(d).log.xz 004532762.td-b3lyp_6-31g+(d).inp 004532762.td-b3lyp_6-31g+(d).log.xz

004532762.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532762.td-b3lyp_6-31+g(d).gjf (generated)

004532762.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532762.mol 004532762.PUBCHEM 004532762.mol (via Jmol)
004532846.b3lyp_6-31g(d).inp

004532846.b3lyp_6-31g(d).qchem.inp (generated)

004532846.b3lyp_6-31g(d).gjf (generated)

004532846.b3lyp_6-31g(d).firefly.inp (generated)

004532846.b3lyp_6-31g(d).smash.inp (generated)

004532846.b3lyp_6-31g(d).nwchem.inp (generated) 004532846.b3lyp_6-31g(d).log.xz 004532846.td-b3lyp_6-31g+(d).inp 004532846.td-b3lyp_6-31g+(d).log.xz

004532846.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532846.td-b3lyp_6-31+g(d).gjf (generated)

004532846.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532846.mol 004532846.PUBCHEM 004532846.mol (via Jmol)
004532905.b3lyp_6-31g(d).inp

004532905.b3lyp_6-31g(d).qchem.inp (generated)

004532905.b3lyp_6-31g(d).gjf (generated)

004532905.b3lyp_6-31g(d).firefly.inp (generated)

004532905.b3lyp_6-31g(d).smash.inp (generated)

004532905.b3lyp_6-31g(d).nwchem.inp (generated) 004532905.b3lyp_6-31g(d).log.xz 004532905.td-b3lyp_6-31g+(d).inp 004532905.td-b3lyp_6-31g+(d).log.xz

004532905.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532905.td-b3lyp_6-31+g(d).gjf (generated)

004532905.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532905.mol 004532905.PUBCHEM 004532905.mol (via Jmol)
004532906.b3lyp_6-31g(d).inp

004532906.b3lyp_6-31g(d).qchem.inp (generated)

004532906.b3lyp_6-31g(d).gjf (generated)

004532906.b3lyp_6-31g(d).firefly.inp (generated)

004532906.b3lyp_6-31g(d).smash.inp (generated)

004532906.b3lyp_6-31g(d).nwchem.inp (generated) 004532906.b3lyp_6-31g(d).log.xz 004532906.td-b3lyp_6-31g+(d).inp 004532906.td-b3lyp_6-31g+(d).log.xz

004532906.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532906.td-b3lyp_6-31+g(d).gjf (generated)

004532906.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532906.mol 004532906.PUBCHEM 004532906.mol (via Jmol)
004532937.b3lyp_6-31g(d).inp

004532937.b3lyp_6-31g(d).qchem.inp (generated)

004532937.b3lyp_6-31g(d).gjf (generated)

004532937.b3lyp_6-31g(d).firefly.inp (generated)

004532937.b3lyp_6-31g(d).smash.inp (generated)

004532937.b3lyp_6-31g(d).nwchem.inp (generated) 004532937.b3lyp_6-31g(d).log.xz 004532937.td-b3lyp_6-31g+(d).inp 004532937.td-b3lyp_6-31g+(d).log.xz

004532937.td-b3lyp_6-31+g(d).qchem.inp (generated)

004532937.td-b3lyp_6-31+g(d).gjf (generated)

004532937.td-b3lyp_6-31+g(d).firefly.inp (generated)

004532937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004532937.mol 004532937.PUBCHEM 004532937.mol (via Jmol)
004533006.b3lyp_6-31g(d).inp

004533006.b3lyp_6-31g(d).qchem.inp (generated)

004533006.b3lyp_6-31g(d).gjf (generated)

004533006.b3lyp_6-31g(d).firefly.inp (generated)

004533006.b3lyp_6-31g(d).smash.inp (generated)

004533006.b3lyp_6-31g(d).nwchem.inp (generated) 004533006.b3lyp_6-31g(d).log.xz 004533006.td-b3lyp_6-31g+(d).inp 004533006.td-b3lyp_6-31g+(d).log.xz

004533006.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533006.td-b3lyp_6-31+g(d).gjf (generated)

004533006.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533006.mol 004533006.PUBCHEM 004533006.mol (via Jmol)
004533183.b3lyp_6-31g(d).inp

004533183.b3lyp_6-31g(d).qchem.inp (generated)

004533183.b3lyp_6-31g(d).gjf (generated)

004533183.b3lyp_6-31g(d).firefly.inp (generated)

004533183.b3lyp_6-31g(d).smash.inp (generated)

004533183.b3lyp_6-31g(d).nwchem.inp (generated) 004533183.b3lyp_6-31g(d).log.xz 004533183.td-b3lyp_6-31g+(d).inp 004533183.td-b3lyp_6-31g+(d).log.xz

004533183.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533183.td-b3lyp_6-31+g(d).gjf (generated)

004533183.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533183.mol 004533183.PUBCHEM 004533183.mol (via Jmol)
004533184.b3lyp_6-31g(d).inp

004533184.b3lyp_6-31g(d).qchem.inp (generated)

004533184.b3lyp_6-31g(d).gjf (generated)

004533184.b3lyp_6-31g(d).firefly.inp (generated)

004533184.b3lyp_6-31g(d).smash.inp (generated)

004533184.b3lyp_6-31g(d).nwchem.inp (generated) 004533184.b3lyp_6-31g(d).log.xz 004533184.td-b3lyp_6-31g+(d).inp 004533184.td-b3lyp_6-31g+(d).log.xz

004533184.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533184.td-b3lyp_6-31+g(d).gjf (generated)

004533184.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533184.mol 004533184.PUBCHEM 004533184.mol (via Jmol)
004533215.b3lyp_6-31g(d).inp

004533215.b3lyp_6-31g(d).qchem.inp (generated)

004533215.b3lyp_6-31g(d).gjf (generated)

004533215.b3lyp_6-31g(d).firefly.inp (generated)

004533215.b3lyp_6-31g(d).smash.inp (generated)

004533215.b3lyp_6-31g(d).nwchem.inp (generated) 004533215.b3lyp_6-31g(d).log.xz 004533215.td-b3lyp_6-31g+(d).inp 004533215.td-b3lyp_6-31g+(d).log.xz

004533215.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533215.td-b3lyp_6-31+g(d).gjf (generated)

004533215.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533215.mol 004533215.PUBCHEM 004533215.mol (via Jmol)
004533216.b3lyp_6-31g(d).inp

004533216.b3lyp_6-31g(d).qchem.inp (generated)

004533216.b3lyp_6-31g(d).gjf (generated)

004533216.b3lyp_6-31g(d).firefly.inp (generated)

004533216.b3lyp_6-31g(d).smash.inp (generated)

004533216.b3lyp_6-31g(d).nwchem.inp (generated) 004533216.b3lyp_6-31g(d).log.xz 004533216.mol 004533216.PUBCHEM 004533216.mol (via Jmol)
004533217.b3lyp_6-31g(d).inp

004533217.b3lyp_6-31g(d).qchem.inp (generated)

004533217.b3lyp_6-31g(d).gjf (generated)

004533217.b3lyp_6-31g(d).firefly.inp (generated)

004533217.b3lyp_6-31g(d).smash.inp (generated)

004533217.b3lyp_6-31g(d).nwchem.inp (generated) 004533217.b3lyp_6-31g(d).log.xz 004533217.td-b3lyp_6-31g+(d).inp 004533217.td-b3lyp_6-31g+(d).log.xz

004533217.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533217.td-b3lyp_6-31+g(d).gjf (generated)

004533217.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533217.mol 004533217.PUBCHEM 004533217.mol (via Jmol)
004533218.b3lyp_6-31g(d).inp

004533218.b3lyp_6-31g(d).qchem.inp (generated)

004533218.b3lyp_6-31g(d).gjf (generated)

004533218.b3lyp_6-31g(d).firefly.inp (generated)

004533218.b3lyp_6-31g(d).smash.inp (generated)

004533218.b3lyp_6-31g(d).nwchem.inp (generated) 004533218.b3lyp_6-31g(d).log.xz 004533218.td-b3lyp_6-31g+(d).inp 004533218.td-b3lyp_6-31g+(d).log.xz

004533218.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533218.td-b3lyp_6-31+g(d).gjf (generated)

004533218.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533218.mol 004533218.PUBCHEM 004533218.mol (via Jmol)
004533232.b3lyp_6-31g(d).inp

004533232.b3lyp_6-31g(d).qchem.inp (generated)

004533232.b3lyp_6-31g(d).gjf (generated)

004533232.b3lyp_6-31g(d).firefly.inp (generated)

004533232.b3lyp_6-31g(d).smash.inp (generated)

004533232.b3lyp_6-31g(d).nwchem.inp (generated) 004533232.b3lyp_6-31g(d).log.xz 004533232.td-b3lyp_6-31g+(d).inp 004533232.td-b3lyp_6-31g+(d).log.xz

004533232.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533232.td-b3lyp_6-31+g(d).gjf (generated)

004533232.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533232.mol 004533232.PUBCHEM 004533232.mol (via Jmol)
004533267.b3lyp_6-31g(d).inp

004533267.b3lyp_6-31g(d).qchem.inp (generated)

004533267.b3lyp_6-31g(d).gjf (generated)

004533267.b3lyp_6-31g(d).firefly.inp (generated)

004533267.b3lyp_6-31g(d).smash.inp (generated)

004533267.b3lyp_6-31g(d).nwchem.inp (generated) 004533267.b3lyp_6-31g(d).log.xz 004533267.mol 004533267.PUBCHEM 004533267.mol (via Jmol)
004533299.b3lyp_6-31g(d).inp

004533299.b3lyp_6-31g(d).qchem.inp (generated)

004533299.b3lyp_6-31g(d).gjf (generated)

004533299.b3lyp_6-31g(d).firefly.inp (generated)

004533299.b3lyp_6-31g(d).smash.inp (generated)

004533299.b3lyp_6-31g(d).nwchem.inp (generated) 004533299.b3lyp_6-31g(d).log.xz 004533299.td-b3lyp_6-31g+(d).inp 004533299.td-b3lyp_6-31g+(d).log.xz

004533299.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533299.td-b3lyp_6-31+g(d).gjf (generated)

004533299.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533299.mol 004533299.PUBCHEM 004533299.mol (via Jmol)
004533316.b3lyp_6-31g(d).inp

004533316.b3lyp_6-31g(d).qchem.inp (generated)

004533316.b3lyp_6-31g(d).gjf (generated)

004533316.b3lyp_6-31g(d).firefly.inp (generated)

004533316.b3lyp_6-31g(d).smash.inp (generated)

004533316.b3lyp_6-31g(d).nwchem.inp (generated) 004533316.b3lyp_6-31g(d).log.xz 004533316.td-b3lyp_6-31g+(d).inp 004533316.td-b3lyp_6-31g+(d).log.xz

004533316.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533316.td-b3lyp_6-31+g(d).gjf (generated)

004533316.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533316.mol 004533316.PUBCHEM 004533316.mol (via Jmol)
004533346.b3lyp_6-31g(d).inp

004533346.b3lyp_6-31g(d).qchem.inp (generated)

004533346.b3lyp_6-31g(d).gjf (generated)

004533346.b3lyp_6-31g(d).firefly.inp (generated)

004533346.b3lyp_6-31g(d).smash.inp (generated)

004533346.b3lyp_6-31g(d).nwchem.inp (generated) 004533346.b3lyp_6-31g(d).log.xz 004533346.td-b3lyp_6-31g+(d).inp 004533346.td-b3lyp_6-31g+(d).log.xz

004533346.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533346.td-b3lyp_6-31+g(d).gjf (generated)

004533346.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533346.mol 004533346.PUBCHEM 004533346.mol (via Jmol)
004533349.b3lyp_6-31g(d).inp

004533349.b3lyp_6-31g(d).qchem.inp (generated)

004533349.b3lyp_6-31g(d).gjf (generated)

004533349.b3lyp_6-31g(d).firefly.inp (generated)

004533349.b3lyp_6-31g(d).smash.inp (generated)

004533349.b3lyp_6-31g(d).nwchem.inp (generated) 004533349.b3lyp_6-31g(d).log.xz 004533349.td-b3lyp_6-31g+(d).inp 004533349.td-b3lyp_6-31g+(d).log.xz

004533349.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533349.td-b3lyp_6-31+g(d).gjf (generated)

004533349.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533349.mol 004533349.PUBCHEM 004533349.mol (via Jmol)
004533352.b3lyp_6-31g(d).inp

004533352.b3lyp_6-31g(d).qchem.inp (generated)

004533352.b3lyp_6-31g(d).gjf (generated)

004533352.b3lyp_6-31g(d).firefly.inp (generated)

004533352.b3lyp_6-31g(d).smash.inp (generated)

004533352.b3lyp_6-31g(d).nwchem.inp (generated) 004533352.b3lyp_6-31g(d).log.xz 004533352.td-b3lyp_6-31g+(d).inp 004533352.td-b3lyp_6-31g+(d).log.xz

004533352.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533352.td-b3lyp_6-31+g(d).gjf (generated)

004533352.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533352.mol 004533352.PUBCHEM 004533352.mol (via Jmol)
004533364.b3lyp_6-31g(d).inp

004533364.b3lyp_6-31g(d).qchem.inp (generated)

004533364.b3lyp_6-31g(d).gjf (generated)

004533364.b3lyp_6-31g(d).firefly.inp (generated)

004533364.b3lyp_6-31g(d).smash.inp (generated)

004533364.b3lyp_6-31g(d).nwchem.inp (generated) 004533364.b3lyp_6-31g(d).log.xz 004533364.td-b3lyp_6-31g+(d).inp 004533364.td-b3lyp_6-31g+(d).log.xz

004533364.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533364.td-b3lyp_6-31+g(d).gjf (generated)

004533364.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533364.mol 004533364.PUBCHEM 004533364.mol (via Jmol)
004533465.b3lyp_6-31g(d).inp

004533465.b3lyp_6-31g(d).qchem.inp (generated)

004533465.b3lyp_6-31g(d).gjf (generated)

004533465.b3lyp_6-31g(d).firefly.inp (generated)

004533465.b3lyp_6-31g(d).smash.inp (generated)

004533465.b3lyp_6-31g(d).nwchem.inp (generated) 004533465.b3lyp_6-31g(d).log.xz 004533465.mol 004533465.PUBCHEM 004533465.mol (via Jmol)
004533529.b3lyp_6-31g(d).inp

004533529.b3lyp_6-31g(d).qchem.inp (generated)

004533529.b3lyp_6-31g(d).gjf (generated)

004533529.b3lyp_6-31g(d).firefly.inp (generated)

004533529.b3lyp_6-31g(d).smash.inp (generated)

004533529.b3lyp_6-31g(d).nwchem.inp (generated) 004533529.b3lyp_6-31g(d).log.xz 004533529.td-b3lyp_6-31g+(d).inp 004533529.td-b3lyp_6-31g+(d).log.xz

004533529.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533529.td-b3lyp_6-31+g(d).gjf (generated)

004533529.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533529.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533529.mol 004533529.PUBCHEM 004533529.mol (via Jmol)
004533559.b3lyp_6-31g(d).inp

004533559.b3lyp_6-31g(d).qchem.inp (generated)

004533559.b3lyp_6-31g(d).gjf (generated)

004533559.b3lyp_6-31g(d).firefly.inp (generated)

004533559.b3lyp_6-31g(d).smash.inp (generated)

004533559.b3lyp_6-31g(d).nwchem.inp (generated) 004533559.b3lyp_6-31g(d).log.xz 004533559.td-b3lyp_6-31g+(d).inp 004533559.td-b3lyp_6-31g+(d).log.xz

004533559.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533559.td-b3lyp_6-31+g(d).gjf (generated)

004533559.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533559.mol 004533559.PUBCHEM 004533559.mol (via Jmol)
004533588.b3lyp_6-31g(d).inp

004533588.b3lyp_6-31g(d).qchem.inp (generated)

004533588.b3lyp_6-31g(d).gjf (generated)

004533588.b3lyp_6-31g(d).firefly.inp (generated)

004533588.b3lyp_6-31g(d).smash.inp (generated)

004533588.b3lyp_6-31g(d).nwchem.inp (generated) 004533588.b3lyp_6-31g(d).log.xz 004533588.mol 004533588.PUBCHEM 004533588.mol (via Jmol)
004533624.b3lyp_6-31g(d).inp

004533624.b3lyp_6-31g(d).qchem.inp (generated)

004533624.b3lyp_6-31g(d).gjf (generated)

004533624.b3lyp_6-31g(d).firefly.inp (generated)

004533624.b3lyp_6-31g(d).smash.inp (generated)

004533624.b3lyp_6-31g(d).nwchem.inp (generated) 004533624.b3lyp_6-31g(d).log.xz 004533624.td-b3lyp_6-31g+(d).inp 004533624.td-b3lyp_6-31g+(d).log.xz

004533624.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533624.td-b3lyp_6-31+g(d).gjf (generated)

004533624.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533624.mol 004533624.PUBCHEM 004533624.mol (via Jmol)
004533664.b3lyp_6-31g(d).inp

004533664.b3lyp_6-31g(d).qchem.inp (generated)

004533664.b3lyp_6-31g(d).gjf (generated)

004533664.b3lyp_6-31g(d).firefly.inp (generated)

004533664.b3lyp_6-31g(d).smash.inp (generated)

004533664.b3lyp_6-31g(d).nwchem.inp (generated) 004533664.b3lyp_6-31g(d).log.xz 004533664.mol 004533664.PUBCHEM 004533664.mol (via Jmol)
004533672.b3lyp_6-31g(d).inp

004533672.b3lyp_6-31g(d).qchem.inp (generated)

004533672.b3lyp_6-31g(d).gjf (generated)

004533672.b3lyp_6-31g(d).firefly.inp (generated)

004533672.b3lyp_6-31g(d).smash.inp (generated)

004533672.b3lyp_6-31g(d).nwchem.inp (generated) 004533672.b3lyp_6-31g(d).log.xz 004533672.td-b3lyp_6-31g+(d).inp 004533672.td-b3lyp_6-31g+(d).log.xz

004533672.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533672.td-b3lyp_6-31+g(d).gjf (generated)

004533672.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533672.mol 004533672.PUBCHEM 004533672.mol (via Jmol)
004533681.b3lyp_6-31g(d).inp

004533681.b3lyp_6-31g(d).qchem.inp (generated)

004533681.b3lyp_6-31g(d).gjf (generated)

004533681.b3lyp_6-31g(d).firefly.inp (generated)

004533681.b3lyp_6-31g(d).smash.inp (generated)

004533681.b3lyp_6-31g(d).nwchem.inp (generated) 004533681.b3lyp_6-31g(d).log.xz 004533681.td-b3lyp_6-31g+(d).inp 004533681.td-b3lyp_6-31g+(d).log.xz

004533681.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533681.td-b3lyp_6-31+g(d).gjf (generated)

004533681.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533681.mol 004533681.PUBCHEM 004533681.mol (via Jmol)
004533769.b3lyp_6-31g(d).inp

004533769.b3lyp_6-31g(d).qchem.inp (generated)

004533769.b3lyp_6-31g(d).gjf (generated)

004533769.b3lyp_6-31g(d).firefly.inp (generated)

004533769.b3lyp_6-31g(d).smash.inp (generated)

004533769.b3lyp_6-31g(d).nwchem.inp (generated) 004533769.b3lyp_6-31g(d).log.xz 004533769.td-b3lyp_6-31g+(d).inp 004533769.td-b3lyp_6-31g+(d).log.xz

004533769.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533769.td-b3lyp_6-31+g(d).gjf (generated)

004533769.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533769.mol 004533769.PUBCHEM 004533769.mol (via Jmol)
004533861.b3lyp_6-31g(d).inp

004533861.b3lyp_6-31g(d).qchem.inp (generated)

004533861.b3lyp_6-31g(d).gjf (generated)

004533861.b3lyp_6-31g(d).firefly.inp (generated)

004533861.b3lyp_6-31g(d).smash.inp (generated)

004533861.b3lyp_6-31g(d).nwchem.inp (generated) 004533861.b3lyp_6-31g(d).log.xz 004533861.td-b3lyp_6-31g+(d).inp 004533861.td-b3lyp_6-31g+(d).log.xz

004533861.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533861.td-b3lyp_6-31+g(d).gjf (generated)

004533861.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533861.mol 004533861.PUBCHEM 004533861.mol (via Jmol)
004533889.b3lyp_6-31g(d).inp

004533889.b3lyp_6-31g(d).qchem.inp (generated)

004533889.b3lyp_6-31g(d).gjf (generated)

004533889.b3lyp_6-31g(d).firefly.inp (generated)

004533889.b3lyp_6-31g(d).smash.inp (generated)

004533889.b3lyp_6-31g(d).nwchem.inp (generated) 004533889.b3lyp_6-31g(d).log.xz 004533889.mol 004533889.PUBCHEM 004533889.mol (via Jmol)
004533893.b3lyp_6-31g(d).inp

004533893.b3lyp_6-31g(d).qchem.inp (generated)

004533893.b3lyp_6-31g(d).gjf (generated)

004533893.b3lyp_6-31g(d).firefly.inp (generated)

004533893.b3lyp_6-31g(d).smash.inp (generated)

004533893.b3lyp_6-31g(d).nwchem.inp (generated) 004533893.b3lyp_6-31g(d).log.xz 004533893.td-b3lyp_6-31g+(d).inp 004533893.td-b3lyp_6-31g+(d).log.xz

004533893.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533893.td-b3lyp_6-31+g(d).gjf (generated)

004533893.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533893.mol 004533893.PUBCHEM 004533893.mol (via Jmol)
004533985.b3lyp_6-31g(d).inp

004533985.b3lyp_6-31g(d).qchem.inp (generated)

004533985.b3lyp_6-31g(d).gjf (generated)

004533985.b3lyp_6-31g(d).firefly.inp (generated)

004533985.b3lyp_6-31g(d).smash.inp (generated)

004533985.b3lyp_6-31g(d).nwchem.inp (generated) 004533985.b3lyp_6-31g(d).log.xz 004533985.td-b3lyp_6-31g+(d).inp 004533985.td-b3lyp_6-31g+(d).log.xz

004533985.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533985.td-b3lyp_6-31+g(d).gjf (generated)

004533985.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533985.mol 004533985.PUBCHEM 004533985.mol (via Jmol)
004533994.b3lyp_6-31g(d).inp

004533994.b3lyp_6-31g(d).qchem.inp (generated)

004533994.b3lyp_6-31g(d).gjf (generated)

004533994.b3lyp_6-31g(d).firefly.inp (generated)

004533994.b3lyp_6-31g(d).smash.inp (generated)

004533994.b3lyp_6-31g(d).nwchem.inp (generated) 004533994.b3lyp_6-31g(d).log.xz 004533994.td-b3lyp_6-31g+(d).inp 004533994.td-b3lyp_6-31g+(d).log.xz

004533994.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533994.td-b3lyp_6-31+g(d).gjf (generated)

004533994.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533994.mol 004533994.PUBCHEM 004533994.mol (via Jmol)
004533999.b3lyp_6-31g(d).inp

004533999.b3lyp_6-31g(d).qchem.inp (generated)

004533999.b3lyp_6-31g(d).gjf (generated)

004533999.b3lyp_6-31g(d).firefly.inp (generated)

004533999.b3lyp_6-31g(d).smash.inp (generated)

004533999.b3lyp_6-31g(d).nwchem.inp (generated) 004533999.b3lyp_6-31g(d).log.xz 004533999.td-b3lyp_6-31g+(d).inp 004533999.td-b3lyp_6-31g+(d).log.xz

004533999.td-b3lyp_6-31+g(d).qchem.inp (generated)

004533999.td-b3lyp_6-31+g(d).gjf (generated)

004533999.td-b3lyp_6-31+g(d).firefly.inp (generated)

004533999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004533999.mol 004533999.PUBCHEM 004533999.mol (via Jmol)
004534015.b3lyp_6-31g(d).inp

004534015.b3lyp_6-31g(d).qchem.inp (generated)

004534015.b3lyp_6-31g(d).gjf (generated)

004534015.b3lyp_6-31g(d).firefly.inp (generated)

004534015.b3lyp_6-31g(d).smash.inp (generated)

004534015.b3lyp_6-31g(d).nwchem.inp (generated) 004534015.b3lyp_6-31g(d).log.xz 004534015.td-b3lyp_6-31g+(d).inp 004534015.td-b3lyp_6-31g+(d).log.xz

004534015.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534015.td-b3lyp_6-31+g(d).gjf (generated)

004534015.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534015.mol 004534015.PUBCHEM 004534015.mol (via Jmol)
004534130.b3lyp_6-31g(d).inp

004534130.b3lyp_6-31g(d).qchem.inp (generated)

004534130.b3lyp_6-31g(d).gjf (generated)

004534130.b3lyp_6-31g(d).firefly.inp (generated)

004534130.b3lyp_6-31g(d).smash.inp (generated)

004534130.b3lyp_6-31g(d).nwchem.inp (generated) 004534130.b3lyp_6-31g(d).log.xz 004534130.td-b3lyp_6-31g+(d).inp 004534130.td-b3lyp_6-31g+(d).log.xz

004534130.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534130.td-b3lyp_6-31+g(d).gjf (generated)

004534130.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534130.mol 004534130.PUBCHEM 004534130.mol (via Jmol)
004534139.b3lyp_6-31g(d).inp

004534139.b3lyp_6-31g(d).qchem.inp (generated)

004534139.b3lyp_6-31g(d).gjf (generated)

004534139.b3lyp_6-31g(d).firefly.inp (generated)

004534139.b3lyp_6-31g(d).smash.inp (generated)

004534139.b3lyp_6-31g(d).nwchem.inp (generated) 004534139.b3lyp_6-31g(d).log.xz 004534139.td-b3lyp_6-31g+(d).inp 004534139.td-b3lyp_6-31g+(d).log.xz

004534139.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534139.td-b3lyp_6-31+g(d).gjf (generated)

004534139.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534139.mol 004534139.PUBCHEM 004534139.mol (via Jmol)
004534158.b3lyp_6-31g(d).inp

004534158.b3lyp_6-31g(d).qchem.inp (generated)

004534158.b3lyp_6-31g(d).gjf (generated)

004534158.b3lyp_6-31g(d).firefly.inp (generated)

004534158.b3lyp_6-31g(d).smash.inp (generated)

004534158.b3lyp_6-31g(d).nwchem.inp (generated) 004534158.b3lyp_6-31g(d).log.xz 004534158.td-b3lyp_6-31g+(d).inp 004534158.td-b3lyp_6-31g+(d).log.xz

004534158.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534158.td-b3lyp_6-31+g(d).gjf (generated)

004534158.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534158.mol 004534158.PUBCHEM 004534158.mol (via Jmol)
004534162.b3lyp_6-31g(d).inp

004534162.b3lyp_6-31g(d).qchem.inp (generated)

004534162.b3lyp_6-31g(d).gjf (generated)

004534162.b3lyp_6-31g(d).firefly.inp (generated)

004534162.b3lyp_6-31g(d).smash.inp (generated)

004534162.b3lyp_6-31g(d).nwchem.inp (generated) 004534162.b3lyp_6-31g(d).log.xz 004534162.td-b3lyp_6-31g+(d).inp 004534162.td-b3lyp_6-31g+(d).log.xz

004534162.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534162.td-b3lyp_6-31+g(d).gjf (generated)

004534162.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534162.mol 004534162.PUBCHEM 004534162.mol (via Jmol)
004534163.b3lyp_6-31g(d).inp

004534163.b3lyp_6-31g(d).qchem.inp (generated)

004534163.b3lyp_6-31g(d).gjf (generated)

004534163.b3lyp_6-31g(d).firefly.inp (generated)

004534163.b3lyp_6-31g(d).smash.inp (generated)

004534163.b3lyp_6-31g(d).nwchem.inp (generated) 004534163.b3lyp_6-31g(d).log.xz 004534163.td-b3lyp_6-31g+(d).inp 004534163.td-b3lyp_6-31g+(d).log.xz

004534163.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534163.td-b3lyp_6-31+g(d).gjf (generated)

004534163.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534163.mol 004534163.PUBCHEM 004534163.mol (via Jmol)
004534239.b3lyp_6-31g(d).inp

004534239.b3lyp_6-31g(d).qchem.inp (generated)

004534239.b3lyp_6-31g(d).gjf (generated)

004534239.b3lyp_6-31g(d).firefly.inp (generated)

004534239.b3lyp_6-31g(d).smash.inp (generated)

004534239.b3lyp_6-31g(d).nwchem.inp (generated) 004534239.b3lyp_6-31g(d).log.xz 004534239.mol 004534239.PUBCHEM 004534239.mol (via Jmol)
004534247.b3lyp_6-31g(d).inp

004534247.b3lyp_6-31g(d).qchem.inp (generated)

004534247.b3lyp_6-31g(d).gjf (generated)

004534247.b3lyp_6-31g(d).firefly.inp (generated)

004534247.b3lyp_6-31g(d).smash.inp (generated)

004534247.b3lyp_6-31g(d).nwchem.inp (generated) 004534247.b3lyp_6-31g(d).log.xz 004534247.td-b3lyp_6-31g+(d).inp 004534247.td-b3lyp_6-31g+(d).log.xz

004534247.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534247.td-b3lyp_6-31+g(d).gjf (generated)

004534247.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534247.mol 004534247.PUBCHEM 004534247.mol (via Jmol)
004534318.b3lyp_6-31g(d).inp

004534318.b3lyp_6-31g(d).qchem.inp (generated)

004534318.b3lyp_6-31g(d).gjf (generated)

004534318.b3lyp_6-31g(d).firefly.inp (generated)

004534318.b3lyp_6-31g(d).smash.inp (generated)

004534318.b3lyp_6-31g(d).nwchem.inp (generated) 004534318.b3lyp_6-31g(d).log.xz 004534318.td-b3lyp_6-31g+(d).inp 004534318.td-b3lyp_6-31g+(d).log.xz

004534318.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534318.td-b3lyp_6-31+g(d).gjf (generated)

004534318.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534318.mol 004534318.PUBCHEM 004534318.mol (via Jmol)
004534319.b3lyp_6-31g(d).inp

004534319.b3lyp_6-31g(d).qchem.inp (generated)

004534319.b3lyp_6-31g(d).gjf (generated)

004534319.b3lyp_6-31g(d).firefly.inp (generated)

004534319.b3lyp_6-31g(d).smash.inp (generated)

004534319.b3lyp_6-31g(d).nwchem.inp (generated) 004534319.b3lyp_6-31g(d).log.xz 004534319.td-b3lyp_6-31g+(d).inp 004534319.td-b3lyp_6-31g+(d).log.xz

004534319.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534319.td-b3lyp_6-31+g(d).gjf (generated)

004534319.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534319.mol 004534319.PUBCHEM 004534319.mol (via Jmol)
004534395.b3lyp_6-31g(d).inp

004534395.b3lyp_6-31g(d).qchem.inp (generated)

004534395.b3lyp_6-31g(d).gjf (generated)

004534395.b3lyp_6-31g(d).firefly.inp (generated)

004534395.b3lyp_6-31g(d).smash.inp (generated)

004534395.b3lyp_6-31g(d).nwchem.inp (generated) 004534395.b3lyp_6-31g(d).log.xz 004534395.td-b3lyp_6-31g+(d).inp 004534395.td-b3lyp_6-31g+(d).log.xz

004534395.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534395.td-b3lyp_6-31+g(d).gjf (generated)

004534395.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534395.mol 004534395.PUBCHEM 004534395.mol (via Jmol)
004534409.b3lyp_6-31g(d).inp

004534409.b3lyp_6-31g(d).qchem.inp (generated)

004534409.b3lyp_6-31g(d).gjf (generated)

004534409.b3lyp_6-31g(d).firefly.inp (generated)

004534409.b3lyp_6-31g(d).smash.inp (generated)

004534409.b3lyp_6-31g(d).nwchem.inp (generated) 004534409.b3lyp_6-31g(d).log.xz 004534409.td-b3lyp_6-31g+(d).inp 004534409.td-b3lyp_6-31g+(d).log.xz

004534409.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534409.td-b3lyp_6-31+g(d).gjf (generated)

004534409.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534409.mol 004534409.PUBCHEM 004534409.mol (via Jmol)
004534430.b3lyp_6-31g(d).inp

004534430.b3lyp_6-31g(d).qchem.inp (generated)

004534430.b3lyp_6-31g(d).gjf (generated)

004534430.b3lyp_6-31g(d).firefly.inp (generated)

004534430.b3lyp_6-31g(d).smash.inp (generated)

004534430.b3lyp_6-31g(d).nwchem.inp (generated) 004534430.b3lyp_6-31g(d).log.xz 004534430.td-b3lyp_6-31g+(d).inp 004534430.td-b3lyp_6-31g+(d).log.xz

004534430.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534430.td-b3lyp_6-31+g(d).gjf (generated)

004534430.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534430.mol 004534430.PUBCHEM 004534430.mol (via Jmol)
004534441.b3lyp_6-31g(d).inp

004534441.b3lyp_6-31g(d).qchem.inp (generated)

004534441.b3lyp_6-31g(d).gjf (generated)

004534441.b3lyp_6-31g(d).firefly.inp (generated)

004534441.b3lyp_6-31g(d).smash.inp (generated)

004534441.b3lyp_6-31g(d).nwchem.inp (generated) 004534441.b3lyp_6-31g(d).log.xz 004534441.mol 004534441.PUBCHEM 004534441.mol (via Jmol)
004534442.b3lyp_6-31g(d).inp

004534442.b3lyp_6-31g(d).qchem.inp (generated)

004534442.b3lyp_6-31g(d).gjf (generated)

004534442.b3lyp_6-31g(d).firefly.inp (generated)

004534442.b3lyp_6-31g(d).smash.inp (generated)

004534442.b3lyp_6-31g(d).nwchem.inp (generated) 004534442.b3lyp_6-31g(d).log.xz 004534442.td-b3lyp_6-31g+(d).inp 004534442.td-b3lyp_6-31g+(d).log.xz

004534442.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534442.td-b3lyp_6-31+g(d).gjf (generated)

004534442.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534442.mol 004534442.PUBCHEM 004534442.mol (via Jmol)
004534500.b3lyp_6-31g(d).inp

004534500.b3lyp_6-31g(d).qchem.inp (generated)

004534500.b3lyp_6-31g(d).gjf (generated)

004534500.b3lyp_6-31g(d).firefly.inp (generated)

004534500.b3lyp_6-31g(d).smash.inp (generated)

004534500.b3lyp_6-31g(d).nwchem.inp (generated) 004534500.b3lyp_6-31g(d).log.xz 004534500.td-b3lyp_6-31g+(d).inp 004534500.td-b3lyp_6-31g+(d).log.xz

004534500.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534500.td-b3lyp_6-31+g(d).gjf (generated)

004534500.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534500.mol 004534500.PUBCHEM 004534500.mol (via Jmol)
004534582.b3lyp_6-31g(d).inp

004534582.b3lyp_6-31g(d).qchem.inp (generated)

004534582.b3lyp_6-31g(d).gjf (generated)

004534582.b3lyp_6-31g(d).firefly.inp (generated)

004534582.b3lyp_6-31g(d).smash.inp (generated)

004534582.b3lyp_6-31g(d).nwchem.inp (generated) 004534582.b3lyp_6-31g(d).log.xz 004534582.td-b3lyp_6-31g+(d).inp 004534582.td-b3lyp_6-31g+(d).log.xz

004534582.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534582.td-b3lyp_6-31+g(d).gjf (generated)

004534582.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534582.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534582.mol 004534582.PUBCHEM 004534582.mol (via Jmol)
004534659.b3lyp_6-31g(d).inp

004534659.b3lyp_6-31g(d).qchem.inp (generated)

004534659.b3lyp_6-31g(d).gjf (generated)

004534659.b3lyp_6-31g(d).firefly.inp (generated)

004534659.b3lyp_6-31g(d).smash.inp (generated)

004534659.b3lyp_6-31g(d).nwchem.inp (generated) 004534659.b3lyp_6-31g(d).log.xz 004534659.td-b3lyp_6-31g+(d).inp 004534659.td-b3lyp_6-31g+(d).log.xz

004534659.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534659.td-b3lyp_6-31+g(d).gjf (generated)

004534659.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534659.mol 004534659.PUBCHEM 004534659.mol (via Jmol)
004534660.b3lyp_6-31g(d).inp

004534660.b3lyp_6-31g(d).qchem.inp (generated)

004534660.b3lyp_6-31g(d).gjf (generated)

004534660.b3lyp_6-31g(d).firefly.inp (generated)

004534660.b3lyp_6-31g(d).smash.inp (generated)

004534660.b3lyp_6-31g(d).nwchem.inp (generated) 004534660.b3lyp_6-31g(d).log.xz 004534660.td-b3lyp_6-31g+(d).inp 004534660.td-b3lyp_6-31g+(d).log.xz

004534660.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534660.td-b3lyp_6-31+g(d).gjf (generated)

004534660.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534660.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534660.mol 004534660.PUBCHEM 004534660.mol (via Jmol)
004534661.b3lyp_6-31g(d).inp

004534661.b3lyp_6-31g(d).qchem.inp (generated)

004534661.b3lyp_6-31g(d).gjf (generated)

004534661.b3lyp_6-31g(d).firefly.inp (generated)

004534661.b3lyp_6-31g(d).smash.inp (generated)

004534661.b3lyp_6-31g(d).nwchem.inp (generated) 004534661.b3lyp_6-31g(d).log.xz 004534661.td-b3lyp_6-31g+(d).inp 004534661.td-b3lyp_6-31g+(d).log.xz

004534661.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534661.td-b3lyp_6-31+g(d).gjf (generated)

004534661.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534661.mol 004534661.PUBCHEM 004534661.mol (via Jmol)
004534664.b3lyp_6-31g(d).inp

004534664.b3lyp_6-31g(d).qchem.inp (generated)

004534664.b3lyp_6-31g(d).gjf (generated)

004534664.b3lyp_6-31g(d).firefly.inp (generated)

004534664.b3lyp_6-31g(d).smash.inp (generated)

004534664.b3lyp_6-31g(d).nwchem.inp (generated) 004534664.b3lyp_6-31g(d).log.xz 004534664.mol 004534664.PUBCHEM 004534664.mol (via Jmol)
004534665.b3lyp_6-31g(d).inp

004534665.b3lyp_6-31g(d).qchem.inp (generated)

004534665.b3lyp_6-31g(d).gjf (generated)

004534665.b3lyp_6-31g(d).firefly.inp (generated)

004534665.b3lyp_6-31g(d).smash.inp (generated)

004534665.b3lyp_6-31g(d).nwchem.inp (generated) 004534665.b3lyp_6-31g(d).log.xz 004534665.td-b3lyp_6-31g+(d).inp 004534665.td-b3lyp_6-31g+(d).log.xz

004534665.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534665.td-b3lyp_6-31+g(d).gjf (generated)

004534665.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534665.mol 004534665.PUBCHEM 004534665.mol (via Jmol)
004534671.b3lyp_6-31g(d).inp

004534671.b3lyp_6-31g(d).qchem.inp (generated)

004534671.b3lyp_6-31g(d).gjf (generated)

004534671.b3lyp_6-31g(d).firefly.inp (generated)

004534671.b3lyp_6-31g(d).smash.inp (generated)

004534671.b3lyp_6-31g(d).nwchem.inp (generated) 004534671.b3lyp_6-31g(d).log.xz 004534671.td-b3lyp_6-31g+(d).inp 004534671.td-b3lyp_6-31g+(d).log.xz

004534671.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534671.td-b3lyp_6-31+g(d).gjf (generated)

004534671.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534671.mol 004534671.PUBCHEM 004534671.mol (via Jmol)
004534683.b3lyp_6-31g(d).inp

004534683.b3lyp_6-31g(d).qchem.inp (generated)

004534683.b3lyp_6-31g(d).gjf (generated)

004534683.b3lyp_6-31g(d).firefly.inp (generated)

004534683.b3lyp_6-31g(d).smash.inp (generated)

004534683.b3lyp_6-31g(d).nwchem.inp (generated) 004534683.b3lyp_6-31g(d).log.xz 004534683.td-b3lyp_6-31g+(d).inp 004534683.td-b3lyp_6-31g+(d).log.xz

004534683.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534683.td-b3lyp_6-31+g(d).gjf (generated)

004534683.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534683.mol 004534683.PUBCHEM 004534683.mol (via Jmol)
004534693.b3lyp_6-31g(d).inp

004534693.b3lyp_6-31g(d).qchem.inp (generated)

004534693.b3lyp_6-31g(d).gjf (generated)

004534693.b3lyp_6-31g(d).firefly.inp (generated)

004534693.b3lyp_6-31g(d).smash.inp (generated)

004534693.b3lyp_6-31g(d).nwchem.inp (generated) 004534693.b3lyp_6-31g(d).log.xz 004534693.td-b3lyp_6-31g+(d).inp 004534693.td-b3lyp_6-31g+(d).log.xz

004534693.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534693.td-b3lyp_6-31+g(d).gjf (generated)

004534693.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534693.mol 004534693.PUBCHEM 004534693.mol (via Jmol)
004534752.b3lyp_6-31g(d).inp

004534752.b3lyp_6-31g(d).qchem.inp (generated)

004534752.b3lyp_6-31g(d).gjf (generated)

004534752.b3lyp_6-31g(d).firefly.inp (generated)

004534752.b3lyp_6-31g(d).smash.inp (generated)

004534752.b3lyp_6-31g(d).nwchem.inp (generated) 004534752.b3lyp_6-31g(d).log.xz 004534752.mol 004534752.PUBCHEM 004534752.mol (via Jmol)
004534797.b3lyp_6-31g(d).inp

004534797.b3lyp_6-31g(d).qchem.inp (generated)

004534797.b3lyp_6-31g(d).gjf (generated)

004534797.b3lyp_6-31g(d).firefly.inp (generated)

004534797.b3lyp_6-31g(d).smash.inp (generated)

004534797.b3lyp_6-31g(d).nwchem.inp (generated) 004534797.b3lyp_6-31g(d).log.xz 004534797.mol 004534797.PUBCHEM 004534797.mol (via Jmol)
004534833.b3lyp_6-31g(d).inp

004534833.b3lyp_6-31g(d).qchem.inp (generated)

004534833.b3lyp_6-31g(d).gjf (generated)

004534833.b3lyp_6-31g(d).firefly.inp (generated)

004534833.b3lyp_6-31g(d).smash.inp (generated)

004534833.b3lyp_6-31g(d).nwchem.inp (generated) 004534833.b3lyp_6-31g(d).log.xz 004534833.td-b3lyp_6-31g+(d).inp 004534833.td-b3lyp_6-31g+(d).log.xz

004534833.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534833.td-b3lyp_6-31+g(d).gjf (generated)

004534833.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534833.mol 004534833.PUBCHEM 004534833.mol (via Jmol)
004534940.b3lyp_6-31g(d).inp

004534940.b3lyp_6-31g(d).qchem.inp (generated)

004534940.b3lyp_6-31g(d).gjf (generated)

004534940.b3lyp_6-31g(d).firefly.inp (generated)

004534940.b3lyp_6-31g(d).smash.inp (generated)

004534940.b3lyp_6-31g(d).nwchem.inp (generated) 004534940.b3lyp_6-31g(d).log.xz 004534940.td-b3lyp_6-31g+(d).inp 004534940.td-b3lyp_6-31g+(d).log.xz

004534940.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534940.td-b3lyp_6-31+g(d).gjf (generated)

004534940.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534940.mol 004534940.PUBCHEM 004534940.mol (via Jmol)
004534941.b3lyp_6-31g(d).inp

004534941.b3lyp_6-31g(d).qchem.inp (generated)

004534941.b3lyp_6-31g(d).gjf (generated)

004534941.b3lyp_6-31g(d).firefly.inp (generated)

004534941.b3lyp_6-31g(d).smash.inp (generated)

004534941.b3lyp_6-31g(d).nwchem.inp (generated) 004534941.b3lyp_6-31g(d).log.xz 004534941.mol 004534941.PUBCHEM 004534941.mol (via Jmol)
004534964.b3lyp_6-31g(d).inp

004534964.b3lyp_6-31g(d).qchem.inp (generated)

004534964.b3lyp_6-31g(d).gjf (generated)

004534964.b3lyp_6-31g(d).firefly.inp (generated)

004534964.b3lyp_6-31g(d).smash.inp (generated)

004534964.b3lyp_6-31g(d).nwchem.inp (generated) 004534964.b3lyp_6-31g(d).log.xz 004534964.td-b3lyp_6-31g+(d).inp 004534964.td-b3lyp_6-31g+(d).log.xz

004534964.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534964.td-b3lyp_6-31+g(d).gjf (generated)

004534964.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534964.mol 004534964.PUBCHEM 004534964.mol (via Jmol)
004534980.b3lyp_6-31g(d).inp

004534980.b3lyp_6-31g(d).qchem.inp (generated)

004534980.b3lyp_6-31g(d).gjf (generated)

004534980.b3lyp_6-31g(d).firefly.inp (generated)

004534980.b3lyp_6-31g(d).smash.inp (generated)

004534980.b3lyp_6-31g(d).nwchem.inp (generated) 004534980.b3lyp_6-31g(d).log.xz 004534980.td-b3lyp_6-31g+(d).inp 004534980.td-b3lyp_6-31g+(d).log.xz

004534980.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534980.td-b3lyp_6-31+g(d).gjf (generated)

004534980.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534980.mol 004534980.PUBCHEM 004534980.mol (via Jmol)
004534981.b3lyp_6-31g(d).inp

004534981.b3lyp_6-31g(d).qchem.inp (generated)

004534981.b3lyp_6-31g(d).gjf (generated)

004534981.b3lyp_6-31g(d).firefly.inp (generated)

004534981.b3lyp_6-31g(d).smash.inp (generated)

004534981.b3lyp_6-31g(d).nwchem.inp (generated) 004534981.b3lyp_6-31g(d).log.xz 004534981.td-b3lyp_6-31g+(d).inp 004534981.td-b3lyp_6-31g+(d).log.xz

004534981.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534981.td-b3lyp_6-31+g(d).gjf (generated)

004534981.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534981.mol 004534981.PUBCHEM 004534981.mol (via Jmol)
004534982.b3lyp_6-31g(d).inp

004534982.b3lyp_6-31g(d).qchem.inp (generated)

004534982.b3lyp_6-31g(d).gjf (generated)

004534982.b3lyp_6-31g(d).firefly.inp (generated)

004534982.b3lyp_6-31g(d).smash.inp (generated)

004534982.b3lyp_6-31g(d).nwchem.inp (generated) 004534982.b3lyp_6-31g(d).log.xz 004534982.td-b3lyp_6-31g+(d).inp 004534982.td-b3lyp_6-31g+(d).log.xz

004534982.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534982.td-b3lyp_6-31+g(d).gjf (generated)

004534982.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534982.mol 004534982.PUBCHEM 004534982.mol (via Jmol)
004534983.b3lyp_6-31g(d).inp

004534983.b3lyp_6-31g(d).qchem.inp (generated)

004534983.b3lyp_6-31g(d).gjf (generated)

004534983.b3lyp_6-31g(d).firefly.inp (generated)

004534983.b3lyp_6-31g(d).smash.inp (generated)

004534983.b3lyp_6-31g(d).nwchem.inp (generated) 004534983.b3lyp_6-31g(d).log.xz 004534983.td-b3lyp_6-31g+(d).inp 004534983.td-b3lyp_6-31g+(d).log.xz

004534983.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534983.td-b3lyp_6-31+g(d).gjf (generated)

004534983.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534983.mol 004534983.PUBCHEM 004534983.mol (via Jmol)
004534985.b3lyp_6-31g(d).inp

004534985.b3lyp_6-31g(d).qchem.inp (generated)

004534985.b3lyp_6-31g(d).gjf (generated)

004534985.b3lyp_6-31g(d).firefly.inp (generated)

004534985.b3lyp_6-31g(d).smash.inp (generated)

004534985.b3lyp_6-31g(d).nwchem.inp (generated) 004534985.b3lyp_6-31g(d).log.xz 004534985.td-b3lyp_6-31g+(d).inp 004534985.td-b3lyp_6-31g+(d).log.xz

004534985.td-b3lyp_6-31+g(d).qchem.inp (generated)

004534985.td-b3lyp_6-31+g(d).gjf (generated)

004534985.td-b3lyp_6-31+g(d).firefly.inp (generated)

004534985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004534985.mol 004534985.PUBCHEM 004534985.mol (via Jmol)
004534988.b3lyp_6-31g(d).inp

004534988.b3lyp_6-31g(d).qchem.inp (generated)

004534988.b3lyp_6-31g(d).gjf (generated)

004534988.b3lyp_6-31g(d).firefly.inp (generated)

004534988.b3lyp_6-31g(d).smash.inp (generated)

004534988.b3lyp_6-31g(d).nwchem.inp (generated) 004534988.b3lyp_6-31g(d).log.xz 004534988.mol 004534988.PUBCHEM 004534988.mol (via Jmol)
004535080.b3lyp_6-31g(d).inp

004535080.b3lyp_6-31g(d).qchem.inp (generated)

004535080.b3lyp_6-31g(d).gjf (generated)

004535080.b3lyp_6-31g(d).firefly.inp (generated)

004535080.b3lyp_6-31g(d).smash.inp (generated)

004535080.b3lyp_6-31g(d).nwchem.inp (generated) 004535080.b3lyp_6-31g(d).log.xz 004535080.td-b3lyp_6-31g+(d).inp 004535080.td-b3lyp_6-31g+(d).log.xz

004535080.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535080.td-b3lyp_6-31+g(d).gjf (generated)

004535080.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535080.mol 004535080.PUBCHEM 004535080.mol (via Jmol)
004535170.b3lyp_6-31g(d).inp

004535170.b3lyp_6-31g(d).qchem.inp (generated)

004535170.b3lyp_6-31g(d).gjf (generated)

004535170.b3lyp_6-31g(d).firefly.inp (generated)

004535170.b3lyp_6-31g(d).smash.inp (generated)

004535170.b3lyp_6-31g(d).nwchem.inp (generated) 004535170.b3lyp_6-31g(d).log.xz 004535170.td-b3lyp_6-31g+(d).inp 004535170.td-b3lyp_6-31g+(d).log.xz

004535170.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535170.td-b3lyp_6-31+g(d).gjf (generated)

004535170.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535170.mol 004535170.PUBCHEM 004535170.mol (via Jmol)
004535180.b3lyp_6-31g(d).inp

004535180.b3lyp_6-31g(d).qchem.inp (generated)

004535180.b3lyp_6-31g(d).gjf (generated)

004535180.b3lyp_6-31g(d).firefly.inp (generated)

004535180.b3lyp_6-31g(d).smash.inp (generated)

004535180.b3lyp_6-31g(d).nwchem.inp (generated) 004535180.b3lyp_6-31g(d).log.xz 004535180.td-b3lyp_6-31g+(d).inp 004535180.td-b3lyp_6-31g+(d).log.xz

004535180.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535180.td-b3lyp_6-31+g(d).gjf (generated)

004535180.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535180.mol 004535180.PUBCHEM 004535180.mol (via Jmol)
004535183.b3lyp_6-31g(d).inp

004535183.b3lyp_6-31g(d).qchem.inp (generated)

004535183.b3lyp_6-31g(d).gjf (generated)

004535183.b3lyp_6-31g(d).firefly.inp (generated)

004535183.b3lyp_6-31g(d).smash.inp (generated)

004535183.b3lyp_6-31g(d).nwchem.inp (generated) 004535183.b3lyp_6-31g(d).log.xz 004535183.td-b3lyp_6-31g+(d).inp 004535183.td-b3lyp_6-31g+(d).log.xz

004535183.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535183.td-b3lyp_6-31+g(d).gjf (generated)

004535183.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535183.mol 004535183.PUBCHEM 004535183.mol (via Jmol)
004535195.b3lyp_6-31g(d).inp

004535195.b3lyp_6-31g(d).qchem.inp (generated)

004535195.b3lyp_6-31g(d).gjf (generated)

004535195.b3lyp_6-31g(d).firefly.inp (generated)

004535195.b3lyp_6-31g(d).smash.inp (generated)

004535195.b3lyp_6-31g(d).nwchem.inp (generated) 004535195.b3lyp_6-31g(d).log.xz 004535195.td-b3lyp_6-31g+(d).inp 004535195.td-b3lyp_6-31g+(d).log.xz

004535195.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535195.td-b3lyp_6-31+g(d).gjf (generated)

004535195.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535195.mol 004535195.PUBCHEM 004535195.mol (via Jmol)
004535238.b3lyp_6-31g(d).inp

004535238.b3lyp_6-31g(d).qchem.inp (generated)

004535238.b3lyp_6-31g(d).gjf (generated)

004535238.b3lyp_6-31g(d).firefly.inp (generated)

004535238.b3lyp_6-31g(d).smash.inp (generated)

004535238.b3lyp_6-31g(d).nwchem.inp (generated) 004535238.b3lyp_6-31g(d).log.xz 004535238.mol 004535238.PUBCHEM 004535238.mol (via Jmol)
004535239.b3lyp_6-31g(d).inp

004535239.b3lyp_6-31g(d).qchem.inp (generated)

004535239.b3lyp_6-31g(d).gjf (generated)

004535239.b3lyp_6-31g(d).firefly.inp (generated)

004535239.b3lyp_6-31g(d).smash.inp (generated)

004535239.b3lyp_6-31g(d).nwchem.inp (generated) 004535239.b3lyp_6-31g(d).log.xz 004535239.td-b3lyp_6-31g+(d).inp 004535239.td-b3lyp_6-31g+(d).log.xz

004535239.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535239.td-b3lyp_6-31+g(d).gjf (generated)

004535239.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535239.mol 004535239.PUBCHEM 004535239.mol (via Jmol)
004535306.b3lyp_6-31g(d).inp

004535306.b3lyp_6-31g(d).qchem.inp (generated)

004535306.b3lyp_6-31g(d).gjf (generated)

004535306.b3lyp_6-31g(d).firefly.inp (generated)

004535306.b3lyp_6-31g(d).smash.inp (generated)

004535306.b3lyp_6-31g(d).nwchem.inp (generated) 004535306.b3lyp_6-31g(d).log.xz 004535306.td-b3lyp_6-31g+(d).inp 004535306.td-b3lyp_6-31g+(d).log.xz

004535306.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535306.td-b3lyp_6-31+g(d).gjf (generated)

004535306.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535306.mol 004535306.PUBCHEM 004535306.mol (via Jmol)
004535331.b3lyp_6-31g(d).inp

004535331.b3lyp_6-31g(d).qchem.inp (generated)

004535331.b3lyp_6-31g(d).gjf (generated)

004535331.b3lyp_6-31g(d).firefly.inp (generated)

004535331.b3lyp_6-31g(d).smash.inp (generated)

004535331.b3lyp_6-31g(d).nwchem.inp (generated) 004535331.b3lyp_6-31g(d).log.xz 004535331.td-b3lyp_6-31g+(d).inp 004535331.td-b3lyp_6-31g+(d).log.xz

004535331.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535331.td-b3lyp_6-31+g(d).gjf (generated)

004535331.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535331.mol 004535331.PUBCHEM 004535331.mol (via Jmol)
004535333.b3lyp_6-31g(d).inp

004535333.b3lyp_6-31g(d).qchem.inp (generated)

004535333.b3lyp_6-31g(d).gjf (generated)

004535333.b3lyp_6-31g(d).firefly.inp (generated)

004535333.b3lyp_6-31g(d).smash.inp (generated)

004535333.b3lyp_6-31g(d).nwchem.inp (generated) 004535333.b3lyp_6-31g(d).log.xz 004535333.td-b3lyp_6-31g+(d).inp 004535333.td-b3lyp_6-31g+(d).log.xz

004535333.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535333.td-b3lyp_6-31+g(d).gjf (generated)

004535333.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535333.mol 004535333.PUBCHEM 004535333.mol (via Jmol)
004535391.b3lyp_6-31g(d).inp

004535391.b3lyp_6-31g(d).qchem.inp (generated)

004535391.b3lyp_6-31g(d).gjf (generated)

004535391.b3lyp_6-31g(d).firefly.inp (generated)

004535391.b3lyp_6-31g(d).smash.inp (generated)

004535391.b3lyp_6-31g(d).nwchem.inp (generated) 004535391.b3lyp_6-31g(d).log.xz 004535391.td-b3lyp_6-31g+(d).inp 004535391.td-b3lyp_6-31g+(d).log.xz

004535391.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535391.td-b3lyp_6-31+g(d).gjf (generated)

004535391.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535391.mol 004535391.PUBCHEM 004535391.mol (via Jmol)
004535412.b3lyp_6-31g(d).inp

004535412.b3lyp_6-31g(d).qchem.inp (generated)

004535412.b3lyp_6-31g(d).gjf (generated)

004535412.b3lyp_6-31g(d).firefly.inp (generated)

004535412.b3lyp_6-31g(d).smash.inp (generated)

004535412.b3lyp_6-31g(d).nwchem.inp (generated) 004535412.b3lyp_6-31g(d).log.xz 004535412.td-b3lyp_6-31g+(d).inp 004535412.td-b3lyp_6-31g+(d).log.xz

004535412.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535412.td-b3lyp_6-31+g(d).gjf (generated)

004535412.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535412.mol 004535412.PUBCHEM 004535412.mol (via Jmol)
004535507.b3lyp_6-31g(d).inp

004535507.b3lyp_6-31g(d).qchem.inp (generated)

004535507.b3lyp_6-31g(d).gjf (generated)

004535507.b3lyp_6-31g(d).firefly.inp (generated)

004535507.b3lyp_6-31g(d).smash.inp (generated)

004535507.b3lyp_6-31g(d).nwchem.inp (generated) 004535507.b3lyp_6-31g(d).log.xz 004535507.td-b3lyp_6-31g+(d).inp 004535507.td-b3lyp_6-31g+(d).log.xz

004535507.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535507.td-b3lyp_6-31+g(d).gjf (generated)

004535507.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535507.mol 004535507.PUBCHEM 004535507.mol (via Jmol)
004535578.b3lyp_6-31g(d).inp

004535578.b3lyp_6-31g(d).qchem.inp (generated)

004535578.b3lyp_6-31g(d).gjf (generated)

004535578.b3lyp_6-31g(d).firefly.inp (generated)

004535578.b3lyp_6-31g(d).smash.inp (generated)

004535578.b3lyp_6-31g(d).nwchem.inp (generated) 004535578.b3lyp_6-31g(d).log.xz 004535578.td-b3lyp_6-31g+(d).inp 004535578.td-b3lyp_6-31g+(d).log.xz

004535578.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535578.td-b3lyp_6-31+g(d).gjf (generated)

004535578.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535578.mol 004535578.PUBCHEM 004535578.mol (via Jmol)
004535716.b3lyp_6-31g(d).inp

004535716.b3lyp_6-31g(d).qchem.inp (generated)

004535716.b3lyp_6-31g(d).gjf (generated)

004535716.b3lyp_6-31g(d).firefly.inp (generated)

004535716.b3lyp_6-31g(d).smash.inp (generated)

004535716.b3lyp_6-31g(d).nwchem.inp (generated) 004535716.b3lyp_6-31g(d).log.xz 004535716.td-b3lyp_6-31g+(d).inp 004535716.td-b3lyp_6-31g+(d).log.xz

004535716.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535716.td-b3lyp_6-31+g(d).gjf (generated)

004535716.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535716.mol 004535716.PUBCHEM 004535716.mol (via Jmol)
004535842.b3lyp_6-31g(d).inp

004535842.b3lyp_6-31g(d).qchem.inp (generated)

004535842.b3lyp_6-31g(d).gjf (generated)

004535842.b3lyp_6-31g(d).firefly.inp (generated)

004535842.b3lyp_6-31g(d).smash.inp (generated)

004535842.b3lyp_6-31g(d).nwchem.inp (generated) 004535842.b3lyp_6-31g(d).log.xz 004535842.td-b3lyp_6-31g+(d).inp 004535842.td-b3lyp_6-31g+(d).log.xz

004535842.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535842.td-b3lyp_6-31+g(d).gjf (generated)

004535842.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535842.mol 004535842.PUBCHEM 004535842.mol (via Jmol)
004535960.b3lyp_6-31g(d).inp

004535960.b3lyp_6-31g(d).qchem.inp (generated)

004535960.b3lyp_6-31g(d).gjf (generated)

004535960.b3lyp_6-31g(d).firefly.inp (generated)

004535960.b3lyp_6-31g(d).smash.inp (generated)

004535960.b3lyp_6-31g(d).nwchem.inp (generated) 004535960.b3lyp_6-31g(d).log.xz 004535960.td-b3lyp_6-31g+(d).inp 004535960.td-b3lyp_6-31g+(d).log.xz

004535960.td-b3lyp_6-31+g(d).qchem.inp (generated)

004535960.td-b3lyp_6-31+g(d).gjf (generated)

004535960.td-b3lyp_6-31+g(d).firefly.inp (generated)

004535960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004535960.mol 004535960.PUBCHEM 004535960.mol (via Jmol)
004536045.b3lyp_6-31g(d).inp

004536045.b3lyp_6-31g(d).qchem.inp (generated)

004536045.b3lyp_6-31g(d).gjf (generated)

004536045.b3lyp_6-31g(d).firefly.inp (generated)

004536045.b3lyp_6-31g(d).smash.inp (generated)

004536045.b3lyp_6-31g(d).nwchem.inp (generated) 004536045.b3lyp_6-31g(d).log.xz 004536045.td-b3lyp_6-31g+(d).inp 004536045.td-b3lyp_6-31g+(d).log.xz

004536045.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536045.td-b3lyp_6-31+g(d).gjf (generated)

004536045.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536045.mol 004536045.PUBCHEM 004536045.mol (via Jmol)
004536051.b3lyp_6-31g(d).inp

004536051.b3lyp_6-31g(d).qchem.inp (generated)

004536051.b3lyp_6-31g(d).gjf (generated)

004536051.b3lyp_6-31g(d).firefly.inp (generated)

004536051.b3lyp_6-31g(d).smash.inp (generated)

004536051.b3lyp_6-31g(d).nwchem.inp (generated) 004536051.b3lyp_6-31g(d).log.xz 004536051.td-b3lyp_6-31g+(d).inp 004536051.td-b3lyp_6-31g+(d).log.xz

004536051.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536051.td-b3lyp_6-31+g(d).gjf (generated)

004536051.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536051.mol 004536051.PUBCHEM 004536051.mol (via Jmol)
004536058.b3lyp_6-31g(d).inp

004536058.b3lyp_6-31g(d).qchem.inp (generated)

004536058.b3lyp_6-31g(d).gjf (generated)

004536058.b3lyp_6-31g(d).firefly.inp (generated)

004536058.b3lyp_6-31g(d).smash.inp (generated)

004536058.b3lyp_6-31g(d).nwchem.inp (generated) 004536058.b3lyp_6-31g(d).log.xz 004536058.td-b3lyp_6-31g+(d).inp 004536058.td-b3lyp_6-31g+(d).log.xz

004536058.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536058.td-b3lyp_6-31+g(d).gjf (generated)

004536058.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536058.mol 004536058.PUBCHEM 004536058.mol (via Jmol)
004536077.b3lyp_6-31g(d).inp

004536077.b3lyp_6-31g(d).qchem.inp (generated)

004536077.b3lyp_6-31g(d).gjf (generated)

004536077.b3lyp_6-31g(d).firefly.inp (generated)

004536077.b3lyp_6-31g(d).smash.inp (generated)

004536077.b3lyp_6-31g(d).nwchem.inp (generated) 004536077.b3lyp_6-31g(d).log.xz 004536077.td-b3lyp_6-31g+(d).inp 004536077.td-b3lyp_6-31g+(d).log.xz

004536077.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536077.td-b3lyp_6-31+g(d).gjf (generated)

004536077.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536077.mol 004536077.PUBCHEM 004536077.mol (via Jmol)
004536078.b3lyp_6-31g(d).inp

004536078.b3lyp_6-31g(d).qchem.inp (generated)

004536078.b3lyp_6-31g(d).gjf (generated)

004536078.b3lyp_6-31g(d).firefly.inp (generated)

004536078.b3lyp_6-31g(d).smash.inp (generated)

004536078.b3lyp_6-31g(d).nwchem.inp (generated) 004536078.b3lyp_6-31g(d).log.xz 004536078.td-b3lyp_6-31g+(d).inp 004536078.td-b3lyp_6-31g+(d).log.xz

004536078.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536078.td-b3lyp_6-31+g(d).gjf (generated)

004536078.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536078.mol 004536078.PUBCHEM 004536078.mol (via Jmol)
004536079.b3lyp_6-31g(d).inp

004536079.b3lyp_6-31g(d).qchem.inp (generated)

004536079.b3lyp_6-31g(d).gjf (generated)

004536079.b3lyp_6-31g(d).firefly.inp (generated)

004536079.b3lyp_6-31g(d).smash.inp (generated)

004536079.b3lyp_6-31g(d).nwchem.inp (generated) 004536079.b3lyp_6-31g(d).log.xz 004536079.td-b3lyp_6-31g+(d).inp 004536079.td-b3lyp_6-31g+(d).log.xz

004536079.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536079.td-b3lyp_6-31+g(d).gjf (generated)

004536079.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536079.mol 004536079.PUBCHEM 004536079.mol (via Jmol)
004536185.b3lyp_6-31g(d).inp

004536185.b3lyp_6-31g(d).qchem.inp (generated)

004536185.b3lyp_6-31g(d).gjf (generated)

004536185.b3lyp_6-31g(d).firefly.inp (generated)

004536185.b3lyp_6-31g(d).smash.inp (generated)

004536185.b3lyp_6-31g(d).nwchem.inp (generated) 004536185.b3lyp_6-31g(d).log.xz 004536185.td-b3lyp_6-31g+(d).inp 004536185.td-b3lyp_6-31g+(d).log.xz

004536185.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536185.td-b3lyp_6-31+g(d).gjf (generated)

004536185.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536185.mol 004536185.PUBCHEM 004536185.mol (via Jmol)
004536216.b3lyp_6-31g(d).inp

004536216.b3lyp_6-31g(d).qchem.inp (generated)

004536216.b3lyp_6-31g(d).gjf (generated)

004536216.b3lyp_6-31g(d).firefly.inp (generated)

004536216.b3lyp_6-31g(d).smash.inp (generated)

004536216.b3lyp_6-31g(d).nwchem.inp (generated) 004536216.b3lyp_6-31g(d).log.xz 004536216.td-b3lyp_6-31g+(d).inp 004536216.td-b3lyp_6-31g+(d).log.xz

004536216.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536216.td-b3lyp_6-31+g(d).gjf (generated)

004536216.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536216.mol 004536216.PUBCHEM 004536216.mol (via Jmol)
004536405.b3lyp_6-31g(d).inp

004536405.b3lyp_6-31g(d).qchem.inp (generated)

004536405.b3lyp_6-31g(d).gjf (generated)

004536405.b3lyp_6-31g(d).firefly.inp (generated)

004536405.b3lyp_6-31g(d).smash.inp (generated)

004536405.b3lyp_6-31g(d).nwchem.inp (generated) 004536405.b3lyp_6-31g(d).log.xz 004536405.td-b3lyp_6-31g+(d).inp 004536405.td-b3lyp_6-31g+(d).log.xz

004536405.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536405.td-b3lyp_6-31+g(d).gjf (generated)

004536405.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536405.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536405.mol 004536405.PUBCHEM 004536405.mol (via Jmol)
004536442.b3lyp_6-31g(d).inp

004536442.b3lyp_6-31g(d).qchem.inp (generated)

004536442.b3lyp_6-31g(d).gjf (generated)

004536442.b3lyp_6-31g(d).firefly.inp (generated)

004536442.b3lyp_6-31g(d).smash.inp (generated)

004536442.b3lyp_6-31g(d).nwchem.inp (generated) 004536442.b3lyp_6-31g(d).log.xz 004536442.td-b3lyp_6-31g+(d).inp 004536442.td-b3lyp_6-31g+(d).log.xz

004536442.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536442.td-b3lyp_6-31+g(d).gjf (generated)

004536442.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536442.mol 004536442.PUBCHEM 004536442.mol (via Jmol)
004536463.b3lyp_6-31g(d).inp

004536463.b3lyp_6-31g(d).qchem.inp (generated)

004536463.b3lyp_6-31g(d).gjf (generated)

004536463.b3lyp_6-31g(d).firefly.inp (generated)

004536463.b3lyp_6-31g(d).smash.inp (generated)

004536463.b3lyp_6-31g(d).nwchem.inp (generated) 004536463.b3lyp_6-31g(d).log.xz 004536463.mol 004536463.PUBCHEM 004536463.mol (via Jmol)
004536481.b3lyp_6-31g(d).inp

004536481.b3lyp_6-31g(d).qchem.inp (generated)

004536481.b3lyp_6-31g(d).gjf (generated)

004536481.b3lyp_6-31g(d).firefly.inp (generated)

004536481.b3lyp_6-31g(d).smash.inp (generated)

004536481.b3lyp_6-31g(d).nwchem.inp (generated) 004536481.b3lyp_6-31g(d).log.xz 004536481.td-b3lyp_6-31g+(d).inp 004536481.td-b3lyp_6-31g+(d).log.xz

004536481.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536481.td-b3lyp_6-31+g(d).gjf (generated)

004536481.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536481.mol 004536481.PUBCHEM 004536481.mol (via Jmol)
004536524.b3lyp_6-31g(d).inp

004536524.b3lyp_6-31g(d).qchem.inp (generated)

004536524.b3lyp_6-31g(d).gjf (generated)

004536524.b3lyp_6-31g(d).firefly.inp (generated)

004536524.b3lyp_6-31g(d).smash.inp (generated)

004536524.b3lyp_6-31g(d).nwchem.inp (generated) 004536524.b3lyp_6-31g(d).log.xz 004536524.td-b3lyp_6-31g+(d).inp 004536524.td-b3lyp_6-31g+(d).log.xz

004536524.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536524.td-b3lyp_6-31+g(d).gjf (generated)

004536524.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536524.mol 004536524.PUBCHEM 004536524.mol (via Jmol)
004536557.b3lyp_6-31g(d).inp

004536557.b3lyp_6-31g(d).qchem.inp (generated)

004536557.b3lyp_6-31g(d).gjf (generated)

004536557.b3lyp_6-31g(d).firefly.inp (generated)

004536557.b3lyp_6-31g(d).smash.inp (generated)

004536557.b3lyp_6-31g(d).nwchem.inp (generated) 004536557.b3lyp_6-31g(d).log.xz 004536557.td-b3lyp_6-31g+(d).inp 004536557.td-b3lyp_6-31g+(d).log.xz

004536557.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536557.td-b3lyp_6-31+g(d).gjf (generated)

004536557.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536557.mol 004536557.PUBCHEM 004536557.mol (via Jmol)
004536610.b3lyp_6-31g(d).inp

004536610.b3lyp_6-31g(d).qchem.inp (generated)

004536610.b3lyp_6-31g(d).gjf (generated)

004536610.b3lyp_6-31g(d).firefly.inp (generated)

004536610.b3lyp_6-31g(d).smash.inp (generated)

004536610.b3lyp_6-31g(d).nwchem.inp (generated) 004536610.b3lyp_6-31g(d).log.xz 004536610.td-b3lyp_6-31g+(d).inp 004536610.td-b3lyp_6-31g+(d).log.xz

004536610.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536610.td-b3lyp_6-31+g(d).gjf (generated)

004536610.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536610.mol 004536610.PUBCHEM 004536610.mol (via Jmol)
004536611.b3lyp_6-31g(d).inp

004536611.b3lyp_6-31g(d).qchem.inp (generated)

004536611.b3lyp_6-31g(d).gjf (generated)

004536611.b3lyp_6-31g(d).firefly.inp (generated)

004536611.b3lyp_6-31g(d).smash.inp (generated)

004536611.b3lyp_6-31g(d).nwchem.inp (generated) 004536611.b3lyp_6-31g(d).log.xz 004536611.td-b3lyp_6-31g+(d).inp 004536611.td-b3lyp_6-31g+(d).log.xz

004536611.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536611.td-b3lyp_6-31+g(d).gjf (generated)

004536611.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536611.mol 004536611.PUBCHEM 004536611.mol (via Jmol)
004536613.b3lyp_6-31g(d).inp

004536613.b3lyp_6-31g(d).qchem.inp (generated)

004536613.b3lyp_6-31g(d).gjf (generated)

004536613.b3lyp_6-31g(d).firefly.inp (generated)

004536613.b3lyp_6-31g(d).smash.inp (generated)

004536613.b3lyp_6-31g(d).nwchem.inp (generated) 004536613.b3lyp_6-31g(d).log.xz 004536613.td-b3lyp_6-31g+(d).inp 004536613.td-b3lyp_6-31g+(d).log.xz

004536613.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536613.td-b3lyp_6-31+g(d).gjf (generated)

004536613.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536613.mol 004536613.PUBCHEM 004536613.mol (via Jmol)
004536621.b3lyp_6-31g(d).inp

004536621.b3lyp_6-31g(d).qchem.inp (generated)

004536621.b3lyp_6-31g(d).gjf (generated)

004536621.b3lyp_6-31g(d).firefly.inp (generated)

004536621.b3lyp_6-31g(d).smash.inp (generated)

004536621.b3lyp_6-31g(d).nwchem.inp (generated) 004536621.b3lyp_6-31g(d).log.xz 004536621.td-b3lyp_6-31g+(d).inp 004536621.td-b3lyp_6-31g+(d).log.xz

004536621.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536621.td-b3lyp_6-31+g(d).gjf (generated)

004536621.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536621.mol 004536621.PUBCHEM 004536621.mol (via Jmol)
004536766.b3lyp_6-31g(d).inp

004536766.b3lyp_6-31g(d).qchem.inp (generated)

004536766.b3lyp_6-31g(d).gjf (generated)

004536766.b3lyp_6-31g(d).firefly.inp (generated)

004536766.b3lyp_6-31g(d).smash.inp (generated)

004536766.b3lyp_6-31g(d).nwchem.inp (generated) 004536766.b3lyp_6-31g(d).log.xz 004536766.td-b3lyp_6-31g+(d).inp 004536766.td-b3lyp_6-31g+(d).log.xz

004536766.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536766.td-b3lyp_6-31+g(d).gjf (generated)

004536766.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536766.mol 004536766.PUBCHEM 004536766.mol (via Jmol)
004536781.b3lyp_6-31g(d).inp

004536781.b3lyp_6-31g(d).qchem.inp (generated)

004536781.b3lyp_6-31g(d).gjf (generated)

004536781.b3lyp_6-31g(d).firefly.inp (generated)

004536781.b3lyp_6-31g(d).smash.inp (generated)

004536781.b3lyp_6-31g(d).nwchem.inp (generated) 004536781.b3lyp_6-31g(d).log.xz 004536781.td-b3lyp_6-31g+(d).inp 004536781.td-b3lyp_6-31g+(d).log.xz

004536781.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536781.td-b3lyp_6-31+g(d).gjf (generated)

004536781.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536781.mol 004536781.PUBCHEM 004536781.mol (via Jmol)
004536784.b3lyp_6-31g(d).inp

004536784.b3lyp_6-31g(d).qchem.inp (generated)

004536784.b3lyp_6-31g(d).gjf (generated)

004536784.b3lyp_6-31g(d).firefly.inp (generated)

004536784.b3lyp_6-31g(d).smash.inp (generated)

004536784.b3lyp_6-31g(d).nwchem.inp (generated) 004536784.b3lyp_6-31g(d).log.xz 004536784.td-b3lyp_6-31g+(d).inp 004536784.td-b3lyp_6-31g+(d).log.xz

004536784.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536784.td-b3lyp_6-31+g(d).gjf (generated)

004536784.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536784.mol 004536784.PUBCHEM 004536784.mol (via Jmol)
004536789.b3lyp_6-31g(d).inp

004536789.b3lyp_6-31g(d).qchem.inp (generated)

004536789.b3lyp_6-31g(d).gjf (generated)

004536789.b3lyp_6-31g(d).firefly.inp (generated)

004536789.b3lyp_6-31g(d).smash.inp (generated)

004536789.b3lyp_6-31g(d).nwchem.inp (generated) 004536789.b3lyp_6-31g(d).log.xz 004536789.td-b3lyp_6-31g+(d).inp 004536789.td-b3lyp_6-31g+(d).log.xz

004536789.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536789.td-b3lyp_6-31+g(d).gjf (generated)

004536789.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536789.mol 004536789.PUBCHEM 004536789.mol (via Jmol)
004536854.b3lyp_6-31g(d).inp

004536854.b3lyp_6-31g(d).qchem.inp (generated)

004536854.b3lyp_6-31g(d).gjf (generated)

004536854.b3lyp_6-31g(d).firefly.inp (generated)

004536854.b3lyp_6-31g(d).smash.inp (generated)

004536854.b3lyp_6-31g(d).nwchem.inp (generated) 004536854.b3lyp_6-31g(d).log.xz 004536854.td-b3lyp_6-31g+(d).inp 004536854.td-b3lyp_6-31g+(d).log.xz

004536854.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536854.td-b3lyp_6-31+g(d).gjf (generated)

004536854.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536854.mol 004536854.PUBCHEM 004536854.mol (via Jmol)
004536914.b3lyp_6-31g(d).inp

004536914.b3lyp_6-31g(d).qchem.inp (generated)

004536914.b3lyp_6-31g(d).gjf (generated)

004536914.b3lyp_6-31g(d).firefly.inp (generated)

004536914.b3lyp_6-31g(d).smash.inp (generated)

004536914.b3lyp_6-31g(d).nwchem.inp (generated) 004536914.b3lyp_6-31g(d).log.xz 004536914.mol 004536914.PUBCHEM 004536914.mol (via Jmol)
004536915.b3lyp_6-31g(d).inp

004536915.b3lyp_6-31g(d).qchem.inp (generated)

004536915.b3lyp_6-31g(d).gjf (generated)

004536915.b3lyp_6-31g(d).firefly.inp (generated)

004536915.b3lyp_6-31g(d).smash.inp (generated)

004536915.b3lyp_6-31g(d).nwchem.inp (generated) 004536915.b3lyp_6-31g(d).log.xz 004536915.td-b3lyp_6-31g+(d).inp 004536915.td-b3lyp_6-31g+(d).log.xz

004536915.td-b3lyp_6-31+g(d).qchem.inp (generated)

004536915.td-b3lyp_6-31+g(d).gjf (generated)

004536915.td-b3lyp_6-31+g(d).firefly.inp (generated)

004536915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004536915.mol 004536915.PUBCHEM 004536915.mol (via Jmol)
004537087.b3lyp_6-31g(d).inp

004537087.b3lyp_6-31g(d).qchem.inp (generated)

004537087.b3lyp_6-31g(d).gjf (generated)

004537087.b3lyp_6-31g(d).firefly.inp (generated)

004537087.b3lyp_6-31g(d).smash.inp (generated)

004537087.b3lyp_6-31g(d).nwchem.inp (generated) 004537087.b3lyp_6-31g(d).log.xz 004537087.td-b3lyp_6-31g+(d).inp 004537087.td-b3lyp_6-31g+(d).log.xz

004537087.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537087.td-b3lyp_6-31+g(d).gjf (generated)

004537087.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537087.mol 004537087.PUBCHEM 004537087.mol (via Jmol)
004537118.b3lyp_6-31g(d).inp

004537118.b3lyp_6-31g(d).qchem.inp (generated)

004537118.b3lyp_6-31g(d).gjf (generated)

004537118.b3lyp_6-31g(d).firefly.inp (generated)

004537118.b3lyp_6-31g(d).smash.inp (generated)

004537118.b3lyp_6-31g(d).nwchem.inp (generated) 004537118.b3lyp_6-31g(d).log.xz 004537118.td-b3lyp_6-31g+(d).inp 004537118.td-b3lyp_6-31g+(d).log.xz

004537118.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537118.td-b3lyp_6-31+g(d).gjf (generated)

004537118.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537118.mol 004537118.PUBCHEM 004537118.mol (via Jmol)
004537301.b3lyp_6-31g(d).inp

004537301.b3lyp_6-31g(d).qchem.inp (generated)

004537301.b3lyp_6-31g(d).gjf (generated)

004537301.b3lyp_6-31g(d).firefly.inp (generated)

004537301.b3lyp_6-31g(d).smash.inp (generated)

004537301.b3lyp_6-31g(d).nwchem.inp (generated) 004537301.b3lyp_6-31g(d).log.xz 004537301.td-b3lyp_6-31g+(d).inp 004537301.td-b3lyp_6-31g+(d).log.xz

004537301.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537301.td-b3lyp_6-31+g(d).gjf (generated)

004537301.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537301.mol 004537301.PUBCHEM 004537301.mol (via Jmol)
004537319.b3lyp_6-31g(d).inp

004537319.b3lyp_6-31g(d).qchem.inp (generated)

004537319.b3lyp_6-31g(d).gjf (generated)

004537319.b3lyp_6-31g(d).firefly.inp (generated)

004537319.b3lyp_6-31g(d).smash.inp (generated)

004537319.b3lyp_6-31g(d).nwchem.inp (generated) 004537319.b3lyp_6-31g(d).log.xz 004537319.td-b3lyp_6-31g+(d).inp 004537319.td-b3lyp_6-31g+(d).log.xz

004537319.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537319.td-b3lyp_6-31+g(d).gjf (generated)

004537319.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537319.mol 004537319.PUBCHEM 004537319.mol (via Jmol)
004537361.b3lyp_6-31g(d).inp

004537361.b3lyp_6-31g(d).qchem.inp (generated)

004537361.b3lyp_6-31g(d).gjf (generated)

004537361.b3lyp_6-31g(d).firefly.inp (generated)

004537361.b3lyp_6-31g(d).smash.inp (generated)

004537361.b3lyp_6-31g(d).nwchem.inp (generated) 004537361.b3lyp_6-31g(d).log.xz 004537361.td-b3lyp_6-31g+(d).inp 004537361.td-b3lyp_6-31g+(d).log.xz

004537361.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537361.td-b3lyp_6-31+g(d).gjf (generated)

004537361.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537361.mol 004537361.PUBCHEM 004537361.mol (via Jmol)
004537362.b3lyp_6-31g(d).inp

004537362.b3lyp_6-31g(d).qchem.inp (generated)

004537362.b3lyp_6-31g(d).gjf (generated)

004537362.b3lyp_6-31g(d).firefly.inp (generated)

004537362.b3lyp_6-31g(d).smash.inp (generated)

004537362.b3lyp_6-31g(d).nwchem.inp (generated) 004537362.b3lyp_6-31g(d).log.xz 004537362.td-b3lyp_6-31g+(d).inp 004537362.td-b3lyp_6-31g+(d).log.xz

004537362.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537362.td-b3lyp_6-31+g(d).gjf (generated)

004537362.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537362.mol 004537362.PUBCHEM 004537362.mol (via Jmol)
004537395.b3lyp_6-31g(d).inp

004537395.b3lyp_6-31g(d).qchem.inp (generated)

004537395.b3lyp_6-31g(d).gjf (generated)

004537395.b3lyp_6-31g(d).firefly.inp (generated)

004537395.b3lyp_6-31g(d).smash.inp (generated)

004537395.b3lyp_6-31g(d).nwchem.inp (generated) 004537395.b3lyp_6-31g(d).log.xz 004537395.td-b3lyp_6-31g+(d).inp 004537395.td-b3lyp_6-31g+(d).log.xz

004537395.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537395.td-b3lyp_6-31+g(d).gjf (generated)

004537395.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537395.mol 004537395.PUBCHEM 004537395.mol (via Jmol)
004537499.b3lyp_6-31g(d).inp

004537499.b3lyp_6-31g(d).qchem.inp (generated)

004537499.b3lyp_6-31g(d).gjf (generated)

004537499.b3lyp_6-31g(d).firefly.inp (generated)

004537499.b3lyp_6-31g(d).smash.inp (generated)

004537499.b3lyp_6-31g(d).nwchem.inp (generated) 004537499.b3lyp_6-31g(d).log.xz 004537499.td-b3lyp_6-31g+(d).inp 004537499.td-b3lyp_6-31g+(d).log.xz

004537499.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537499.td-b3lyp_6-31+g(d).gjf (generated)

004537499.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537499.mol 004537499.PUBCHEM 004537499.mol (via Jmol)
004537501.b3lyp_6-31g(d).inp

004537501.b3lyp_6-31g(d).qchem.inp (generated)

004537501.b3lyp_6-31g(d).gjf (generated)

004537501.b3lyp_6-31g(d).firefly.inp (generated)

004537501.b3lyp_6-31g(d).smash.inp (generated)

004537501.b3lyp_6-31g(d).nwchem.inp (generated) 004537501.b3lyp_6-31g(d).log.xz 004537501.td-b3lyp_6-31g+(d).inp 004537501.td-b3lyp_6-31g+(d).log.xz

004537501.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537501.td-b3lyp_6-31+g(d).gjf (generated)

004537501.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537501.mol 004537501.PUBCHEM 004537501.mol (via Jmol)
004537569.b3lyp_6-31g(d).inp

004537569.b3lyp_6-31g(d).qchem.inp (generated)

004537569.b3lyp_6-31g(d).gjf (generated)

004537569.b3lyp_6-31g(d).firefly.inp (generated)

004537569.b3lyp_6-31g(d).smash.inp (generated)

004537569.b3lyp_6-31g(d).nwchem.inp (generated) 004537569.b3lyp_6-31g(d).log.xz 004537569.td-b3lyp_6-31g+(d).inp 004537569.td-b3lyp_6-31g+(d).log.xz

004537569.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537569.td-b3lyp_6-31+g(d).gjf (generated)

004537569.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537569.mol 004537569.PUBCHEM 004537569.mol (via Jmol)
004537633.b3lyp_6-31g(d).inp

004537633.b3lyp_6-31g(d).qchem.inp (generated)

004537633.b3lyp_6-31g(d).gjf (generated)

004537633.b3lyp_6-31g(d).firefly.inp (generated)

004537633.b3lyp_6-31g(d).smash.inp (generated)

004537633.b3lyp_6-31g(d).nwchem.inp (generated) 004537633.b3lyp_6-31g(d).log.xz 004537633.td-b3lyp_6-31g+(d).inp 004537633.td-b3lyp_6-31g+(d).log.xz

004537633.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537633.td-b3lyp_6-31+g(d).gjf (generated)

004537633.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537633.mol 004537633.PUBCHEM 004537633.mol (via Jmol)
004537639.b3lyp_6-31g(d).inp

004537639.b3lyp_6-31g(d).qchem.inp (generated)

004537639.b3lyp_6-31g(d).gjf (generated)

004537639.b3lyp_6-31g(d).firefly.inp (generated)

004537639.b3lyp_6-31g(d).smash.inp (generated)

004537639.b3lyp_6-31g(d).nwchem.inp (generated) 004537639.b3lyp_6-31g(d).log.xz 004537639.td-b3lyp_6-31g+(d).inp 004537639.td-b3lyp_6-31g+(d).log.xz

004537639.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537639.td-b3lyp_6-31+g(d).gjf (generated)

004537639.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537639.mol 004537639.PUBCHEM 004537639.mol (via Jmol)
004537748.b3lyp_6-31g(d).inp

004537748.b3lyp_6-31g(d).qchem.inp (generated)

004537748.b3lyp_6-31g(d).gjf (generated)

004537748.b3lyp_6-31g(d).firefly.inp (generated)

004537748.b3lyp_6-31g(d).smash.inp (generated)

004537748.b3lyp_6-31g(d).nwchem.inp (generated) 004537748.b3lyp_6-31g(d).log.xz 004537748.td-b3lyp_6-31g+(d).inp 004537748.td-b3lyp_6-31g+(d).log.xz

004537748.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537748.td-b3lyp_6-31+g(d).gjf (generated)

004537748.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537748.mol 004537748.PUBCHEM 004537748.mol (via Jmol)
004537781.b3lyp_6-31g(d).inp

004537781.b3lyp_6-31g(d).qchem.inp (generated)

004537781.b3lyp_6-31g(d).gjf (generated)

004537781.b3lyp_6-31g(d).firefly.inp (generated)

004537781.b3lyp_6-31g(d).smash.inp (generated)

004537781.b3lyp_6-31g(d).nwchem.inp (generated) 004537781.b3lyp_6-31g(d).log.xz 004537781.td-b3lyp_6-31g+(d).inp 004537781.td-b3lyp_6-31g+(d).log.xz

004537781.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537781.td-b3lyp_6-31+g(d).gjf (generated)

004537781.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537781.mol 004537781.PUBCHEM 004537781.mol (via Jmol)
004537869.b3lyp_6-31g(d).inp

004537869.b3lyp_6-31g(d).qchem.inp (generated)

004537869.b3lyp_6-31g(d).gjf (generated)

004537869.b3lyp_6-31g(d).firefly.inp (generated)

004537869.b3lyp_6-31g(d).smash.inp (generated)

004537869.b3lyp_6-31g(d).nwchem.inp (generated) 004537869.b3lyp_6-31g(d).log.xz 004537869.td-b3lyp_6-31g+(d).inp 004537869.td-b3lyp_6-31g+(d).log.xz

004537869.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537869.td-b3lyp_6-31+g(d).gjf (generated)

004537869.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537869.mol 004537869.PUBCHEM 004537869.mol (via Jmol)
004537991.b3lyp_6-31g(d).inp

004537991.b3lyp_6-31g(d).qchem.inp (generated)

004537991.b3lyp_6-31g(d).gjf (generated)

004537991.b3lyp_6-31g(d).firefly.inp (generated)

004537991.b3lyp_6-31g(d).smash.inp (generated)

004537991.b3lyp_6-31g(d).nwchem.inp (generated) 004537991.b3lyp_6-31g(d).log.xz 004537991.td-b3lyp_6-31g+(d).inp 004537991.td-b3lyp_6-31g+(d).log.xz

004537991.td-b3lyp_6-31+g(d).qchem.inp (generated)

004537991.td-b3lyp_6-31+g(d).gjf (generated)

004537991.td-b3lyp_6-31+g(d).firefly.inp (generated)

004537991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004537991.mol 004537991.PUBCHEM 004537991.mol (via Jmol)
004538026.b3lyp_6-31g(d).inp

004538026.b3lyp_6-31g(d).qchem.inp (generated)

004538026.b3lyp_6-31g(d).gjf (generated)

004538026.b3lyp_6-31g(d).firefly.inp (generated)

004538026.b3lyp_6-31g(d).smash.inp (generated)

004538026.b3lyp_6-31g(d).nwchem.inp (generated) 004538026.b3lyp_6-31g(d).log.xz 004538026.td-b3lyp_6-31g+(d).inp 004538026.td-b3lyp_6-31g+(d).log.xz

004538026.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538026.td-b3lyp_6-31+g(d).gjf (generated)

004538026.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538026.mol 004538026.PUBCHEM 004538026.mol (via Jmol)
004538071.b3lyp_6-31g(d).inp

004538071.b3lyp_6-31g(d).qchem.inp (generated)

004538071.b3lyp_6-31g(d).gjf (generated)

004538071.b3lyp_6-31g(d).firefly.inp (generated)

004538071.b3lyp_6-31g(d).smash.inp (generated)

004538071.b3lyp_6-31g(d).nwchem.inp (generated) 004538071.b3lyp_6-31g(d).log.xz 004538071.td-b3lyp_6-31g+(d).inp 004538071.td-b3lyp_6-31g+(d).log.xz

004538071.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538071.td-b3lyp_6-31+g(d).gjf (generated)

004538071.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538071.mol 004538071.PUBCHEM 004538071.mol (via Jmol)
004538125.b3lyp_6-31g(d).inp

004538125.b3lyp_6-31g(d).qchem.inp (generated)

004538125.b3lyp_6-31g(d).gjf (generated)

004538125.b3lyp_6-31g(d).firefly.inp (generated)

004538125.b3lyp_6-31g(d).smash.inp (generated)

004538125.b3lyp_6-31g(d).nwchem.inp (generated) 004538125.b3lyp_6-31g(d).log.xz 004538125.td-b3lyp_6-31g+(d).inp 004538125.td-b3lyp_6-31g+(d).log.xz

004538125.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538125.td-b3lyp_6-31+g(d).gjf (generated)

004538125.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538125.mol 004538125.PUBCHEM 004538125.mol (via Jmol)
004538147.b3lyp_6-31g(d).inp

004538147.b3lyp_6-31g(d).qchem.inp (generated)

004538147.b3lyp_6-31g(d).gjf (generated)

004538147.b3lyp_6-31g(d).firefly.inp (generated)

004538147.b3lyp_6-31g(d).smash.inp (generated)

004538147.b3lyp_6-31g(d).nwchem.inp (generated) 004538147.b3lyp_6-31g(d).log.xz 004538147.mol 004538147.PUBCHEM 004538147.mol (via Jmol)
004538149.b3lyp_6-31g(d).inp

004538149.b3lyp_6-31g(d).qchem.inp (generated)

004538149.b3lyp_6-31g(d).gjf (generated)

004538149.b3lyp_6-31g(d).firefly.inp (generated)

004538149.b3lyp_6-31g(d).smash.inp (generated)

004538149.b3lyp_6-31g(d).nwchem.inp (generated) 004538149.b3lyp_6-31g(d).log.xz 004538149.td-b3lyp_6-31g+(d).inp 004538149.td-b3lyp_6-31g+(d).log.xz

004538149.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538149.td-b3lyp_6-31+g(d).gjf (generated)

004538149.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538149.mol 004538149.PUBCHEM 004538149.mol (via Jmol)
004538235.b3lyp_6-31g(d).inp

004538235.b3lyp_6-31g(d).qchem.inp (generated)

004538235.b3lyp_6-31g(d).gjf (generated)

004538235.b3lyp_6-31g(d).firefly.inp (generated)

004538235.b3lyp_6-31g(d).smash.inp (generated)

004538235.b3lyp_6-31g(d).nwchem.inp (generated) 004538235.b3lyp_6-31g(d).log.xz 004538235.td-b3lyp_6-31g+(d).inp 004538235.td-b3lyp_6-31g+(d).log.xz

004538235.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538235.td-b3lyp_6-31+g(d).gjf (generated)

004538235.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538235.mol 004538235.PUBCHEM 004538235.mol (via Jmol)
004538236.b3lyp_6-31g(d).inp

004538236.b3lyp_6-31g(d).qchem.inp (generated)

004538236.b3lyp_6-31g(d).gjf (generated)

004538236.b3lyp_6-31g(d).firefly.inp (generated)

004538236.b3lyp_6-31g(d).smash.inp (generated)

004538236.b3lyp_6-31g(d).nwchem.inp (generated) 004538236.b3lyp_6-31g(d).log.xz 004538236.td-b3lyp_6-31g+(d).inp 004538236.td-b3lyp_6-31g+(d).log.xz

004538236.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538236.td-b3lyp_6-31+g(d).gjf (generated)

004538236.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538236.mol 004538236.PUBCHEM 004538236.mol (via Jmol)
004538257.b3lyp_6-31g(d).inp

004538257.b3lyp_6-31g(d).qchem.inp (generated)

004538257.b3lyp_6-31g(d).gjf (generated)

004538257.b3lyp_6-31g(d).firefly.inp (generated)

004538257.b3lyp_6-31g(d).smash.inp (generated)

004538257.b3lyp_6-31g(d).nwchem.inp (generated) 004538257.b3lyp_6-31g(d).log.xz 004538257.td-b3lyp_6-31g+(d).inp 004538257.td-b3lyp_6-31g+(d).log.xz

004538257.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538257.td-b3lyp_6-31+g(d).gjf (generated)

004538257.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538257.mol 004538257.PUBCHEM 004538257.mol (via Jmol)
004538304.b3lyp_6-31g(d).inp

004538304.b3lyp_6-31g(d).qchem.inp (generated)

004538304.b3lyp_6-31g(d).gjf (generated)

004538304.b3lyp_6-31g(d).firefly.inp (generated)

004538304.b3lyp_6-31g(d).smash.inp (generated)

004538304.b3lyp_6-31g(d).nwchem.inp (generated) 004538304.b3lyp_6-31g(d).log.xz 004538304.td-b3lyp_6-31g+(d).inp 004538304.td-b3lyp_6-31g+(d).log.xz

004538304.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538304.td-b3lyp_6-31+g(d).gjf (generated)

004538304.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538304.mol 004538304.PUBCHEM 004538304.mol (via Jmol)
004538324.b3lyp_6-31g(d).inp

004538324.b3lyp_6-31g(d).qchem.inp (generated)

004538324.b3lyp_6-31g(d).gjf (generated)

004538324.b3lyp_6-31g(d).firefly.inp (generated)

004538324.b3lyp_6-31g(d).smash.inp (generated)

004538324.b3lyp_6-31g(d).nwchem.inp (generated) 004538324.b3lyp_6-31g(d).log.xz 004538324.td-b3lyp_6-31g+(d).inp 004538324.td-b3lyp_6-31g+(d).log.xz

004538324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538324.td-b3lyp_6-31+g(d).gjf (generated)

004538324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538324.mol 004538324.PUBCHEM 004538324.mol (via Jmol)
004538325.b3lyp_6-31g(d).inp

004538325.b3lyp_6-31g(d).qchem.inp (generated)

004538325.b3lyp_6-31g(d).gjf (generated)

004538325.b3lyp_6-31g(d).firefly.inp (generated)

004538325.b3lyp_6-31g(d).smash.inp (generated)

004538325.b3lyp_6-31g(d).nwchem.inp (generated) 004538325.b3lyp_6-31g(d).log.xz 004538325.td-b3lyp_6-31g+(d).inp 004538325.td-b3lyp_6-31g+(d).log.xz

004538325.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538325.td-b3lyp_6-31+g(d).gjf (generated)

004538325.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538325.mol 004538325.PUBCHEM 004538325.mol (via Jmol)
004538347.b3lyp_6-31g(d).inp

004538347.b3lyp_6-31g(d).qchem.inp (generated)

004538347.b3lyp_6-31g(d).gjf (generated)

004538347.b3lyp_6-31g(d).firefly.inp (generated)

004538347.b3lyp_6-31g(d).smash.inp (generated)

004538347.b3lyp_6-31g(d).nwchem.inp (generated) 004538347.b3lyp_6-31g(d).log.xz 004538347.td-b3lyp_6-31g+(d).inp 004538347.td-b3lyp_6-31g+(d).log.xz

004538347.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538347.td-b3lyp_6-31+g(d).gjf (generated)

004538347.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538347.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538347.mol 004538347.PUBCHEM 004538347.mol (via Jmol)
004538348.b3lyp_6-31g(d).inp

004538348.b3lyp_6-31g(d).qchem.inp (generated)

004538348.b3lyp_6-31g(d).gjf (generated)

004538348.b3lyp_6-31g(d).firefly.inp (generated)

004538348.b3lyp_6-31g(d).smash.inp (generated)

004538348.b3lyp_6-31g(d).nwchem.inp (generated) 004538348.b3lyp_6-31g(d).log.xz 004538348.mol 004538348.PUBCHEM 004538348.mol (via Jmol)
004538368.b3lyp_6-31g(d).inp

004538368.b3lyp_6-31g(d).qchem.inp (generated)

004538368.b3lyp_6-31g(d).gjf (generated)

004538368.b3lyp_6-31g(d).firefly.inp (generated)

004538368.b3lyp_6-31g(d).smash.inp (generated)

004538368.b3lyp_6-31g(d).nwchem.inp (generated) 004538368.b3lyp_6-31g(d).log.xz 004538368.td-b3lyp_6-31g+(d).inp 004538368.td-b3lyp_6-31g+(d).log.xz

004538368.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538368.td-b3lyp_6-31+g(d).gjf (generated)

004538368.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538368.mol 004538368.PUBCHEM 004538368.mol (via Jmol)
004538409.b3lyp_6-31g(d).inp

004538409.b3lyp_6-31g(d).qchem.inp (generated)

004538409.b3lyp_6-31g(d).gjf (generated)

004538409.b3lyp_6-31g(d).firefly.inp (generated)

004538409.b3lyp_6-31g(d).smash.inp (generated)

004538409.b3lyp_6-31g(d).nwchem.inp (generated) 004538409.b3lyp_6-31g(d).log.xz 004538409.td-b3lyp_6-31g+(d).inp 004538409.td-b3lyp_6-31g+(d).log.xz

004538409.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538409.td-b3lyp_6-31+g(d).gjf (generated)

004538409.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538409.mol 004538409.PUBCHEM 004538409.mol (via Jmol)
004538623.b3lyp_6-31g(d).inp

004538623.b3lyp_6-31g(d).qchem.inp (generated)

004538623.b3lyp_6-31g(d).gjf (generated)

004538623.b3lyp_6-31g(d).firefly.inp (generated)

004538623.b3lyp_6-31g(d).smash.inp (generated)

004538623.b3lyp_6-31g(d).nwchem.inp (generated) 004538623.b3lyp_6-31g(d).log.xz 004538623.td-b3lyp_6-31g+(d).inp 004538623.td-b3lyp_6-31g+(d).log.xz

004538623.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538623.td-b3lyp_6-31+g(d).gjf (generated)

004538623.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538623.mol 004538623.PUBCHEM 004538623.mol (via Jmol)
004538688.b3lyp_6-31g(d).inp

004538688.b3lyp_6-31g(d).qchem.inp (generated)

004538688.b3lyp_6-31g(d).gjf (generated)

004538688.b3lyp_6-31g(d).firefly.inp (generated)

004538688.b3lyp_6-31g(d).smash.inp (generated)

004538688.b3lyp_6-31g(d).nwchem.inp (generated) 004538688.b3lyp_6-31g(d).log.xz 004538688.mol 004538688.PUBCHEM 004538688.mol (via Jmol)
004538796.b3lyp_6-31g(d).inp

004538796.b3lyp_6-31g(d).qchem.inp (generated)

004538796.b3lyp_6-31g(d).gjf (generated)

004538796.b3lyp_6-31g(d).firefly.inp (generated)

004538796.b3lyp_6-31g(d).smash.inp (generated)

004538796.b3lyp_6-31g(d).nwchem.inp (generated) 004538796.b3lyp_6-31g(d).log.xz 004538796.td-b3lyp_6-31g+(d).inp 004538796.td-b3lyp_6-31g+(d).log.xz

004538796.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538796.td-b3lyp_6-31+g(d).gjf (generated)

004538796.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538796.mol 004538796.PUBCHEM 004538796.mol (via Jmol)
004538799.b3lyp_6-31g(d).inp

004538799.b3lyp_6-31g(d).qchem.inp (generated)

004538799.b3lyp_6-31g(d).gjf (generated)

004538799.b3lyp_6-31g(d).firefly.inp (generated)

004538799.b3lyp_6-31g(d).smash.inp (generated)

004538799.b3lyp_6-31g(d).nwchem.inp (generated) 004538799.b3lyp_6-31g(d).log.xz 004538799.mol 004538799.PUBCHEM 004538799.mol (via Jmol)
004538809.b3lyp_6-31g(d).inp

004538809.b3lyp_6-31g(d).qchem.inp (generated)

004538809.b3lyp_6-31g(d).gjf (generated)

004538809.b3lyp_6-31g(d).firefly.inp (generated)

004538809.b3lyp_6-31g(d).smash.inp (generated)

004538809.b3lyp_6-31g(d).nwchem.inp (generated) 004538809.b3lyp_6-31g(d).log.xz 004538809.td-b3lyp_6-31g+(d).inp 004538809.td-b3lyp_6-31g+(d).log.xz

004538809.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538809.td-b3lyp_6-31+g(d).gjf (generated)

004538809.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538809.mol 004538809.PUBCHEM 004538809.mol (via Jmol)
004538810.b3lyp_6-31g(d).inp

004538810.b3lyp_6-31g(d).qchem.inp (generated)

004538810.b3lyp_6-31g(d).gjf (generated)

004538810.b3lyp_6-31g(d).firefly.inp (generated)

004538810.b3lyp_6-31g(d).smash.inp (generated)

004538810.b3lyp_6-31g(d).nwchem.inp (generated) 004538810.b3lyp_6-31g(d).log.xz 004538810.td-b3lyp_6-31g+(d).inp 004538810.td-b3lyp_6-31g+(d).log.xz

004538810.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538810.td-b3lyp_6-31+g(d).gjf (generated)

004538810.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538810.mol 004538810.PUBCHEM 004538810.mol (via Jmol)
004538824.b3lyp_6-31g(d).inp

004538824.b3lyp_6-31g(d).qchem.inp (generated)

004538824.b3lyp_6-31g(d).gjf (generated)

004538824.b3lyp_6-31g(d).firefly.inp (generated)

004538824.b3lyp_6-31g(d).smash.inp (generated)

004538824.b3lyp_6-31g(d).nwchem.inp (generated) 004538824.b3lyp_6-31g(d).log.xz 004538824.td-b3lyp_6-31g+(d).inp 004538824.td-b3lyp_6-31g+(d).log.xz

004538824.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538824.td-b3lyp_6-31+g(d).gjf (generated)

004538824.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538824.mol 004538824.PUBCHEM 004538824.mol (via Jmol)
004538902.b3lyp_6-31g(d).inp

004538902.b3lyp_6-31g(d).qchem.inp (generated)

004538902.b3lyp_6-31g(d).gjf (generated)

004538902.b3lyp_6-31g(d).firefly.inp (generated)

004538902.b3lyp_6-31g(d).smash.inp (generated)

004538902.b3lyp_6-31g(d).nwchem.inp (generated) 004538902.b3lyp_6-31g(d).log.xz 004538902.td-b3lyp_6-31g+(d).inp 004538902.td-b3lyp_6-31g+(d).log.xz

004538902.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538902.td-b3lyp_6-31+g(d).gjf (generated)

004538902.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538902.mol 004538902.PUBCHEM 004538902.mol (via Jmol)
004538904.b3lyp_6-31g(d).inp

004538904.b3lyp_6-31g(d).qchem.inp (generated)

004538904.b3lyp_6-31g(d).gjf (generated)

004538904.b3lyp_6-31g(d).firefly.inp (generated)

004538904.b3lyp_6-31g(d).smash.inp (generated)

004538904.b3lyp_6-31g(d).nwchem.inp (generated) 004538904.b3lyp_6-31g(d).log.xz 004538904.td-b3lyp_6-31g+(d).inp 004538904.td-b3lyp_6-31g+(d).log.xz

004538904.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538904.td-b3lyp_6-31+g(d).gjf (generated)

004538904.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538904.mol 004538904.PUBCHEM 004538904.mol (via Jmol)
004538906.b3lyp_6-31g(d).inp

004538906.b3lyp_6-31g(d).qchem.inp (generated)

004538906.b3lyp_6-31g(d).gjf (generated)

004538906.b3lyp_6-31g(d).firefly.inp (generated)

004538906.b3lyp_6-31g(d).smash.inp (generated)

004538906.b3lyp_6-31g(d).nwchem.inp (generated) 004538906.b3lyp_6-31g(d).log.xz 004538906.mol 004538906.PUBCHEM 004538906.mol (via Jmol)
004538917.b3lyp_6-31g(d).inp

004538917.b3lyp_6-31g(d).qchem.inp (generated)

004538917.b3lyp_6-31g(d).gjf (generated)

004538917.b3lyp_6-31g(d).firefly.inp (generated)

004538917.b3lyp_6-31g(d).smash.inp (generated)

004538917.b3lyp_6-31g(d).nwchem.inp (generated) 004538917.b3lyp_6-31g(d).log.xz 004538917.td-b3lyp_6-31g+(d).inp 004538917.td-b3lyp_6-31g+(d).log.xz

004538917.td-b3lyp_6-31+g(d).qchem.inp (generated)

004538917.td-b3lyp_6-31+g(d).gjf (generated)

004538917.td-b3lyp_6-31+g(d).firefly.inp (generated)

004538917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004538917.mol 004538917.PUBCHEM 004538917.mol (via Jmol)
004539026.b3lyp_6-31g(d).inp

004539026.b3lyp_6-31g(d).qchem.inp (generated)

004539026.b3lyp_6-31g(d).gjf (generated)

004539026.b3lyp_6-31g(d).firefly.inp (generated)

004539026.b3lyp_6-31g(d).smash.inp (generated)

004539026.b3lyp_6-31g(d).nwchem.inp (generated) 004539026.b3lyp_6-31g(d).log.xz 004539026.td-b3lyp_6-31g+(d).inp 004539026.td-b3lyp_6-31g+(d).log.xz

004539026.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539026.td-b3lyp_6-31+g(d).gjf (generated)

004539026.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539026.mol 004539026.PUBCHEM 004539026.mol (via Jmol)
004539069.b3lyp_6-31g(d).inp

004539069.b3lyp_6-31g(d).qchem.inp (generated)

004539069.b3lyp_6-31g(d).gjf (generated)

004539069.b3lyp_6-31g(d).firefly.inp (generated)

004539069.b3lyp_6-31g(d).smash.inp (generated)

004539069.b3lyp_6-31g(d).nwchem.inp (generated) 004539069.b3lyp_6-31g(d).log.xz 004539069.td-b3lyp_6-31g+(d).inp 004539069.td-b3lyp_6-31g+(d).log.xz

004539069.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539069.td-b3lyp_6-31+g(d).gjf (generated)

004539069.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539069.mol 004539069.PUBCHEM 004539069.mol (via Jmol)
004539100.b3lyp_6-31g(d).inp

004539100.b3lyp_6-31g(d).qchem.inp (generated)

004539100.b3lyp_6-31g(d).gjf (generated)

004539100.b3lyp_6-31g(d).firefly.inp (generated)

004539100.b3lyp_6-31g(d).smash.inp (generated)

004539100.b3lyp_6-31g(d).nwchem.inp (generated) 004539100.b3lyp_6-31g(d).log.xz 004539100.mol 004539100.PUBCHEM 004539100.mol (via Jmol)
004539189.b3lyp_6-31g(d).inp

004539189.b3lyp_6-31g(d).qchem.inp (generated)

004539189.b3lyp_6-31g(d).gjf (generated)

004539189.b3lyp_6-31g(d).firefly.inp (generated)

004539189.b3lyp_6-31g(d).smash.inp (generated)

004539189.b3lyp_6-31g(d).nwchem.inp (generated) 004539189.b3lyp_6-31g(d).log.xz 004539189.td-b3lyp_6-31g+(d).inp 004539189.td-b3lyp_6-31g+(d).log.xz

004539189.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539189.td-b3lyp_6-31+g(d).gjf (generated)

004539189.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539189.mol 004539189.PUBCHEM 004539189.mol (via Jmol)
004539245.b3lyp_6-31g(d).inp

004539245.b3lyp_6-31g(d).qchem.inp (generated)

004539245.b3lyp_6-31g(d).gjf (generated)

004539245.b3lyp_6-31g(d).firefly.inp (generated)

004539245.b3lyp_6-31g(d).smash.inp (generated)

004539245.b3lyp_6-31g(d).nwchem.inp (generated) 004539245.b3lyp_6-31g(d).log.xz 004539245.td-b3lyp_6-31g+(d).inp 004539245.td-b3lyp_6-31g+(d).log.xz

004539245.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539245.td-b3lyp_6-31+g(d).gjf (generated)

004539245.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539245.mol 004539245.PUBCHEM 004539245.mol (via Jmol)
004539288.b3lyp_6-31g(d).inp

004539288.b3lyp_6-31g(d).qchem.inp (generated)

004539288.b3lyp_6-31g(d).gjf (generated)

004539288.b3lyp_6-31g(d).firefly.inp (generated)

004539288.b3lyp_6-31g(d).smash.inp (generated)

004539288.b3lyp_6-31g(d).nwchem.inp (generated) 004539288.b3lyp_6-31g(d).log.xz 004539288.td-b3lyp_6-31g+(d).inp 004539288.td-b3lyp_6-31g+(d).log.xz

004539288.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539288.td-b3lyp_6-31+g(d).gjf (generated)

004539288.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539288.mol 004539288.PUBCHEM 004539288.mol (via Jmol)
004539339.b3lyp_6-31g(d).inp

004539339.b3lyp_6-31g(d).qchem.inp (generated)

004539339.b3lyp_6-31g(d).gjf (generated)

004539339.b3lyp_6-31g(d).firefly.inp (generated)

004539339.b3lyp_6-31g(d).smash.inp (generated)

004539339.b3lyp_6-31g(d).nwchem.inp (generated) 004539339.b3lyp_6-31g(d).log.xz 004539339.td-b3lyp_6-31g+(d).inp 004539339.td-b3lyp_6-31g+(d).log.xz

004539339.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539339.td-b3lyp_6-31+g(d).gjf (generated)

004539339.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539339.mol 004539339.PUBCHEM 004539339.mol (via Jmol)
004539340.b3lyp_6-31g(d).inp

004539340.b3lyp_6-31g(d).qchem.inp (generated)

004539340.b3lyp_6-31g(d).gjf (generated)

004539340.b3lyp_6-31g(d).firefly.inp (generated)

004539340.b3lyp_6-31g(d).smash.inp (generated)

004539340.b3lyp_6-31g(d).nwchem.inp (generated) 004539340.b3lyp_6-31g(d).log.xz 004539340.td-b3lyp_6-31g+(d).inp 004539340.td-b3lyp_6-31g+(d).log.xz

004539340.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539340.td-b3lyp_6-31+g(d).gjf (generated)

004539340.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539340.mol 004539340.PUBCHEM 004539340.mol (via Jmol)
004539562.b3lyp_6-31g(d).inp

004539562.b3lyp_6-31g(d).qchem.inp (generated)

004539562.b3lyp_6-31g(d).gjf (generated)

004539562.b3lyp_6-31g(d).firefly.inp (generated)

004539562.b3lyp_6-31g(d).smash.inp (generated)

004539562.b3lyp_6-31g(d).nwchem.inp (generated) 004539562.b3lyp_6-31g(d).log.xz 004539562.td-b3lyp_6-31g+(d).inp 004539562.td-b3lyp_6-31g+(d).log.xz

004539562.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539562.td-b3lyp_6-31+g(d).gjf (generated)

004539562.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539562.mol 004539562.PUBCHEM 004539562.mol (via Jmol)
004539563.b3lyp_6-31g(d).inp

004539563.b3lyp_6-31g(d).qchem.inp (generated)

004539563.b3lyp_6-31g(d).gjf (generated)

004539563.b3lyp_6-31g(d).firefly.inp (generated)

004539563.b3lyp_6-31g(d).smash.inp (generated)

004539563.b3lyp_6-31g(d).nwchem.inp (generated) 004539563.b3lyp_6-31g(d).log.xz 004539563.td-b3lyp_6-31g+(d).inp 004539563.td-b3lyp_6-31g+(d).log.xz

004539563.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539563.td-b3lyp_6-31+g(d).gjf (generated)

004539563.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539563.mol 004539563.PUBCHEM 004539563.mol (via Jmol)
004539618.b3lyp_6-31g(d).inp

004539618.b3lyp_6-31g(d).qchem.inp (generated)

004539618.b3lyp_6-31g(d).gjf (generated)

004539618.b3lyp_6-31g(d).firefly.inp (generated)

004539618.b3lyp_6-31g(d).smash.inp (generated)

004539618.b3lyp_6-31g(d).nwchem.inp (generated) 004539618.b3lyp_6-31g(d).log.xz 004539618.td-b3lyp_6-31g+(d).inp 004539618.td-b3lyp_6-31g+(d).log.xz

004539618.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539618.td-b3lyp_6-31+g(d).gjf (generated)

004539618.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539618.mol 004539618.PUBCHEM 004539618.mol (via Jmol)
004539666.b3lyp_6-31g(d).inp

004539666.b3lyp_6-31g(d).qchem.inp (generated)

004539666.b3lyp_6-31g(d).gjf (generated)

004539666.b3lyp_6-31g(d).firefly.inp (generated)

004539666.b3lyp_6-31g(d).smash.inp (generated)

004539666.b3lyp_6-31g(d).nwchem.inp (generated) 004539666.b3lyp_6-31g(d).log.xz 004539666.td-b3lyp_6-31g+(d).inp 004539666.td-b3lyp_6-31g+(d).log.xz

004539666.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539666.td-b3lyp_6-31+g(d).gjf (generated)

004539666.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539666.mol 004539666.PUBCHEM 004539666.mol (via Jmol)
004539683.b3lyp_6-31g(d).inp

004539683.b3lyp_6-31g(d).qchem.inp (generated)

004539683.b3lyp_6-31g(d).gjf (generated)

004539683.b3lyp_6-31g(d).firefly.inp (generated)

004539683.b3lyp_6-31g(d).smash.inp (generated)

004539683.b3lyp_6-31g(d).nwchem.inp (generated) 004539683.b3lyp_6-31g(d).log.xz 004539683.td-b3lyp_6-31g+(d).inp 004539683.td-b3lyp_6-31g+(d).log.xz

004539683.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539683.td-b3lyp_6-31+g(d).gjf (generated)

004539683.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539683.mol 004539683.PUBCHEM 004539683.mol (via Jmol)
004539710.b3lyp_6-31g(d).inp

004539710.b3lyp_6-31g(d).qchem.inp (generated)

004539710.b3lyp_6-31g(d).gjf (generated)

004539710.b3lyp_6-31g(d).firefly.inp (generated)

004539710.b3lyp_6-31g(d).smash.inp (generated)

004539710.b3lyp_6-31g(d).nwchem.inp (generated) 004539710.b3lyp_6-31g(d).log.xz 004539710.td-b3lyp_6-31g+(d).inp 004539710.td-b3lyp_6-31g+(d).log.xz

004539710.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539710.td-b3lyp_6-31+g(d).gjf (generated)

004539710.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539710.mol 004539710.PUBCHEM 004539710.mol (via Jmol)
004539826.b3lyp_6-31g(d).inp

004539826.b3lyp_6-31g(d).qchem.inp (generated)

004539826.b3lyp_6-31g(d).gjf (generated)

004539826.b3lyp_6-31g(d).firefly.inp (generated)

004539826.b3lyp_6-31g(d).smash.inp (generated)

004539826.b3lyp_6-31g(d).nwchem.inp (generated) 004539826.b3lyp_6-31g(d).log.xz 004539826.td-b3lyp_6-31g+(d).inp 004539826.td-b3lyp_6-31g+(d).log.xz

004539826.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539826.td-b3lyp_6-31+g(d).gjf (generated)

004539826.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539826.mol 004539826.PUBCHEM 004539826.mol (via Jmol)
004539897.b3lyp_6-31g(d).inp

004539897.b3lyp_6-31g(d).qchem.inp (generated)

004539897.b3lyp_6-31g(d).gjf (generated)

004539897.b3lyp_6-31g(d).firefly.inp (generated)

004539897.b3lyp_6-31g(d).smash.inp (generated)

004539897.b3lyp_6-31g(d).nwchem.inp (generated) 004539897.b3lyp_6-31g(d).log.xz 004539897.td-b3lyp_6-31g+(d).inp 004539897.td-b3lyp_6-31g+(d).log.xz

004539897.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539897.td-b3lyp_6-31+g(d).gjf (generated)

004539897.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539897.mol 004539897.PUBCHEM 004539897.mol (via Jmol)
004539922.b3lyp_6-31g(d).inp

004539922.b3lyp_6-31g(d).qchem.inp (generated)

004539922.b3lyp_6-31g(d).gjf (generated)

004539922.b3lyp_6-31g(d).firefly.inp (generated)

004539922.b3lyp_6-31g(d).smash.inp (generated)

004539922.b3lyp_6-31g(d).nwchem.inp (generated) 004539922.b3lyp_6-31g(d).log.xz 004539922.td-b3lyp_6-31g+(d).inp 004539922.td-b3lyp_6-31g+(d).log.xz

004539922.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539922.td-b3lyp_6-31+g(d).gjf (generated)

004539922.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539922.mol 004539922.PUBCHEM 004539922.mol (via Jmol)
004539932.b3lyp_6-31g(d).inp

004539932.b3lyp_6-31g(d).qchem.inp (generated)

004539932.b3lyp_6-31g(d).gjf (generated)

004539932.b3lyp_6-31g(d).firefly.inp (generated)

004539932.b3lyp_6-31g(d).smash.inp (generated)

004539932.b3lyp_6-31g(d).nwchem.inp (generated) 004539932.b3lyp_6-31g(d).log.xz 004539932.td-b3lyp_6-31g+(d).inp 004539932.td-b3lyp_6-31g+(d).log.xz

004539932.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539932.td-b3lyp_6-31+g(d).gjf (generated)

004539932.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539932.mol 004539932.PUBCHEM 004539932.mol (via Jmol)
004539933.b3lyp_6-31g(d).inp

004539933.b3lyp_6-31g(d).qchem.inp (generated)

004539933.b3lyp_6-31g(d).gjf (generated)

004539933.b3lyp_6-31g(d).firefly.inp (generated)

004539933.b3lyp_6-31g(d).smash.inp (generated)

004539933.b3lyp_6-31g(d).nwchem.inp (generated) 004539933.b3lyp_6-31g(d).log.xz 004539933.td-b3lyp_6-31g+(d).inp 004539933.td-b3lyp_6-31g+(d).log.xz

004539933.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539933.td-b3lyp_6-31+g(d).gjf (generated)

004539933.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539933.mol 004539933.PUBCHEM 004539933.mol (via Jmol)
004539934.b3lyp_6-31g(d).inp

004539934.b3lyp_6-31g(d).qchem.inp (generated)

004539934.b3lyp_6-31g(d).gjf (generated)

004539934.b3lyp_6-31g(d).firefly.inp (generated)

004539934.b3lyp_6-31g(d).smash.inp (generated)

004539934.b3lyp_6-31g(d).nwchem.inp (generated) 004539934.b3lyp_6-31g(d).log.xz 004539934.td-b3lyp_6-31g+(d).inp 004539934.td-b3lyp_6-31g+(d).log.xz

004539934.td-b3lyp_6-31+g(d).qchem.inp (generated)

004539934.td-b3lyp_6-31+g(d).gjf (generated)

004539934.td-b3lyp_6-31+g(d).firefly.inp (generated)

004539934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004539934.mol 004539934.PUBCHEM 004539934.mol (via Jmol)
004540223.b3lyp_6-31g(d).inp

004540223.b3lyp_6-31g(d).qchem.inp (generated)

004540223.b3lyp_6-31g(d).gjf (generated)

004540223.b3lyp_6-31g(d).firefly.inp (generated)

004540223.b3lyp_6-31g(d).smash.inp (generated)

004540223.b3lyp_6-31g(d).nwchem.inp (generated) 004540223.b3lyp_6-31g(d).log.xz 004540223.td-b3lyp_6-31g+(d).inp 004540223.td-b3lyp_6-31g+(d).log.xz

004540223.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540223.td-b3lyp_6-31+g(d).gjf (generated)

004540223.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540223.mol 004540223.PUBCHEM 004540223.mol (via Jmol)
004540233.b3lyp_6-31g(d).inp

004540233.b3lyp_6-31g(d).qchem.inp (generated)

004540233.b3lyp_6-31g(d).gjf (generated)

004540233.b3lyp_6-31g(d).firefly.inp (generated)

004540233.b3lyp_6-31g(d).smash.inp (generated)

004540233.b3lyp_6-31g(d).nwchem.inp (generated) 004540233.b3lyp_6-31g(d).log.xz 004540233.td-b3lyp_6-31g+(d).inp 004540233.td-b3lyp_6-31g+(d).log.xz

004540233.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540233.td-b3lyp_6-31+g(d).gjf (generated)

004540233.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540233.mol 004540233.PUBCHEM 004540233.mol (via Jmol)
004540250.b3lyp_6-31g(d).inp

004540250.b3lyp_6-31g(d).qchem.inp (generated)

004540250.b3lyp_6-31g(d).gjf (generated)

004540250.b3lyp_6-31g(d).firefly.inp (generated)

004540250.b3lyp_6-31g(d).smash.inp (generated)

004540250.b3lyp_6-31g(d).nwchem.inp (generated) 004540250.b3lyp_6-31g(d).log.xz 004540250.td-b3lyp_6-31g+(d).inp 004540250.td-b3lyp_6-31g+(d).log.xz

004540250.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540250.td-b3lyp_6-31+g(d).gjf (generated)

004540250.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540250.mol 004540250.PUBCHEM 004540250.mol (via Jmol)
004540381.b3lyp_6-31g(d).inp

004540381.b3lyp_6-31g(d).qchem.inp (generated)

004540381.b3lyp_6-31g(d).gjf (generated)

004540381.b3lyp_6-31g(d).firefly.inp (generated)

004540381.b3lyp_6-31g(d).smash.inp (generated)

004540381.b3lyp_6-31g(d).nwchem.inp (generated) 004540381.b3lyp_6-31g(d).log.xz 004540381.td-b3lyp_6-31g+(d).inp 004540381.td-b3lyp_6-31g+(d).log.xz

004540381.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540381.td-b3lyp_6-31+g(d).gjf (generated)

004540381.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540381.mol 004540381.PUBCHEM 004540381.mol (via Jmol)
004540402.b3lyp_6-31g(d).inp

004540402.b3lyp_6-31g(d).qchem.inp (generated)

004540402.b3lyp_6-31g(d).gjf (generated)

004540402.b3lyp_6-31g(d).firefly.inp (generated)

004540402.b3lyp_6-31g(d).smash.inp (generated)

004540402.b3lyp_6-31g(d).nwchem.inp (generated) 004540402.b3lyp_6-31g(d).log.xz 004540402.td-b3lyp_6-31g+(d).inp 004540402.td-b3lyp_6-31g+(d).log.xz

004540402.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540402.td-b3lyp_6-31+g(d).gjf (generated)

004540402.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540402.mol 004540402.PUBCHEM 004540402.mol (via Jmol)
004540465.b3lyp_6-31g(d).inp

004540465.b3lyp_6-31g(d).qchem.inp (generated)

004540465.b3lyp_6-31g(d).gjf (generated)

004540465.b3lyp_6-31g(d).firefly.inp (generated)

004540465.b3lyp_6-31g(d).smash.inp (generated)

004540465.b3lyp_6-31g(d).nwchem.inp (generated) 004540465.b3lyp_6-31g(d).log.xz 004540465.td-b3lyp_6-31g+(d).inp 004540465.td-b3lyp_6-31g+(d).log.xz

004540465.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540465.td-b3lyp_6-31+g(d).gjf (generated)

004540465.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540465.mol 004540465.PUBCHEM 004540465.mol (via Jmol)
004540483.b3lyp_6-31g(d).inp

004540483.b3lyp_6-31g(d).qchem.inp (generated)

004540483.b3lyp_6-31g(d).gjf (generated)

004540483.b3lyp_6-31g(d).firefly.inp (generated)

004540483.b3lyp_6-31g(d).smash.inp (generated)

004540483.b3lyp_6-31g(d).nwchem.inp (generated) 004540483.b3lyp_6-31g(d).log.xz 004540483.td-b3lyp_6-31g+(d).inp 004540483.td-b3lyp_6-31g+(d).log.xz

004540483.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540483.td-b3lyp_6-31+g(d).gjf (generated)

004540483.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540483.mol 004540483.PUBCHEM 004540483.mol (via Jmol)
004540732.b3lyp_6-31g(d).inp

004540732.b3lyp_6-31g(d).qchem.inp (generated)

004540732.b3lyp_6-31g(d).gjf (generated)

004540732.b3lyp_6-31g(d).firefly.inp (generated)

004540732.b3lyp_6-31g(d).smash.inp (generated)

004540732.b3lyp_6-31g(d).nwchem.inp (generated) 004540732.b3lyp_6-31g(d).log.xz 004540732.td-b3lyp_6-31g+(d).inp 004540732.td-b3lyp_6-31g+(d).log.xz

004540732.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540732.td-b3lyp_6-31+g(d).gjf (generated)

004540732.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540732.mol 004540732.PUBCHEM 004540732.mol (via Jmol)
004540740.b3lyp_6-31g(d).inp

004540740.b3lyp_6-31g(d).qchem.inp (generated)

004540740.b3lyp_6-31g(d).gjf (generated)

004540740.b3lyp_6-31g(d).firefly.inp (generated)

004540740.b3lyp_6-31g(d).smash.inp (generated)

004540740.b3lyp_6-31g(d).nwchem.inp (generated) 004540740.b3lyp_6-31g(d).log.xz 004540740.td-b3lyp_6-31g+(d).inp 004540740.td-b3lyp_6-31g+(d).log.xz

004540740.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540740.td-b3lyp_6-31+g(d).gjf (generated)

004540740.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540740.mol 004540740.PUBCHEM 004540740.mol (via Jmol)
004540898.b3lyp_6-31g(d).inp

004540898.b3lyp_6-31g(d).qchem.inp (generated)

004540898.b3lyp_6-31g(d).gjf (generated)

004540898.b3lyp_6-31g(d).firefly.inp (generated)

004540898.b3lyp_6-31g(d).smash.inp (generated)

004540898.b3lyp_6-31g(d).nwchem.inp (generated) 004540898.b3lyp_6-31g(d).log.xz 004540898.td-b3lyp_6-31g+(d).inp 004540898.td-b3lyp_6-31g+(d).log.xz

004540898.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540898.td-b3lyp_6-31+g(d).gjf (generated)

004540898.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540898.mol 004540898.PUBCHEM 004540898.mol (via Jmol)
004540970.b3lyp_6-31g(d).inp

004540970.b3lyp_6-31g(d).qchem.inp (generated)

004540970.b3lyp_6-31g(d).gjf (generated)

004540970.b3lyp_6-31g(d).firefly.inp (generated)

004540970.b3lyp_6-31g(d).smash.inp (generated)

004540970.b3lyp_6-31g(d).nwchem.inp (generated) 004540970.b3lyp_6-31g(d).log.xz 004540970.td-b3lyp_6-31g+(d).inp 004540970.td-b3lyp_6-31g+(d).log.xz

004540970.td-b3lyp_6-31+g(d).qchem.inp (generated)

004540970.td-b3lyp_6-31+g(d).gjf (generated)

004540970.td-b3lyp_6-31+g(d).firefly.inp (generated)

004540970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004540970.mol 004540970.PUBCHEM 004540970.mol (via Jmol)
004541077.b3lyp_6-31g(d).inp

004541077.b3lyp_6-31g(d).qchem.inp (generated)

004541077.b3lyp_6-31g(d).gjf (generated)

004541077.b3lyp_6-31g(d).firefly.inp (generated)

004541077.b3lyp_6-31g(d).smash.inp (generated)

004541077.b3lyp_6-31g(d).nwchem.inp (generated) 004541077.b3lyp_6-31g(d).log.xz 004541077.td-b3lyp_6-31g+(d).inp 004541077.td-b3lyp_6-31g+(d).log.xz

004541077.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541077.td-b3lyp_6-31+g(d).gjf (generated)

004541077.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541077.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541077.mol 004541077.PUBCHEM 004541077.mol (via Jmol)
004541093.b3lyp_6-31g(d).inp

004541093.b3lyp_6-31g(d).qchem.inp (generated)

004541093.b3lyp_6-31g(d).gjf (generated)

004541093.b3lyp_6-31g(d).firefly.inp (generated)

004541093.b3lyp_6-31g(d).smash.inp (generated)

004541093.b3lyp_6-31g(d).nwchem.inp (generated) 004541093.b3lyp_6-31g(d).log.xz 004541093.td-b3lyp_6-31g+(d).inp 004541093.td-b3lyp_6-31g+(d).log.xz

004541093.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541093.td-b3lyp_6-31+g(d).gjf (generated)

004541093.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541093.mol 004541093.PUBCHEM 004541093.mol (via Jmol)
004541423.b3lyp_6-31g(d).inp

004541423.b3lyp_6-31g(d).qchem.inp (generated)

004541423.b3lyp_6-31g(d).gjf (generated)

004541423.b3lyp_6-31g(d).firefly.inp (generated)

004541423.b3lyp_6-31g(d).smash.inp (generated)

004541423.b3lyp_6-31g(d).nwchem.inp (generated) 004541423.b3lyp_6-31g(d).log.xz 004541423.td-b3lyp_6-31g+(d).inp 004541423.td-b3lyp_6-31g+(d).log.xz

004541423.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541423.td-b3lyp_6-31+g(d).gjf (generated)

004541423.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541423.mol 004541423.PUBCHEM 004541423.mol (via Jmol)
004541454.b3lyp_6-31g(d).inp

004541454.b3lyp_6-31g(d).qchem.inp (generated)

004541454.b3lyp_6-31g(d).gjf (generated)

004541454.b3lyp_6-31g(d).firefly.inp (generated)

004541454.b3lyp_6-31g(d).smash.inp (generated)

004541454.b3lyp_6-31g(d).nwchem.inp (generated) 004541454.b3lyp_6-31g(d).log.xz 004541454.td-b3lyp_6-31g+(d).inp 004541454.td-b3lyp_6-31g+(d).log.xz

004541454.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541454.td-b3lyp_6-31+g(d).gjf (generated)

004541454.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541454.mol 004541454.PUBCHEM 004541454.mol (via Jmol)
004541619.b3lyp_6-31g(d).inp

004541619.b3lyp_6-31g(d).qchem.inp (generated)

004541619.b3lyp_6-31g(d).gjf (generated)

004541619.b3lyp_6-31g(d).firefly.inp (generated)

004541619.b3lyp_6-31g(d).smash.inp (generated)

004541619.b3lyp_6-31g(d).nwchem.inp (generated) 004541619.b3lyp_6-31g(d).log.xz 004541619.td-b3lyp_6-31g+(d).inp 004541619.td-b3lyp_6-31g+(d).log.xz

004541619.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541619.td-b3lyp_6-31+g(d).gjf (generated)

004541619.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541619.mol 004541619.PUBCHEM 004541619.mol (via Jmol)
004541638.b3lyp_6-31g(d).inp

004541638.b3lyp_6-31g(d).qchem.inp (generated)

004541638.b3lyp_6-31g(d).gjf (generated)

004541638.b3lyp_6-31g(d).firefly.inp (generated)

004541638.b3lyp_6-31g(d).smash.inp (generated)

004541638.b3lyp_6-31g(d).nwchem.inp (generated) 004541638.b3lyp_6-31g(d).log.xz 004541638.td-b3lyp_6-31g+(d).inp 004541638.td-b3lyp_6-31g+(d).log.xz

004541638.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541638.td-b3lyp_6-31+g(d).gjf (generated)

004541638.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541638.mol 004541638.PUBCHEM 004541638.mol (via Jmol)
004541701.b3lyp_6-31g(d).inp

004541701.b3lyp_6-31g(d).qchem.inp (generated)

004541701.b3lyp_6-31g(d).gjf (generated)

004541701.b3lyp_6-31g(d).firefly.inp (generated)

004541701.b3lyp_6-31g(d).smash.inp (generated)

004541701.b3lyp_6-31g(d).nwchem.inp (generated) 004541701.b3lyp_6-31g(d).log.xz 004541701.td-b3lyp_6-31g+(d).inp 004541701.td-b3lyp_6-31g+(d).log.xz

004541701.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541701.td-b3lyp_6-31+g(d).gjf (generated)

004541701.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541701.mol 004541701.PUBCHEM 004541701.mol (via Jmol)
004541704.b3lyp_6-31g(d).inp

004541704.b3lyp_6-31g(d).qchem.inp (generated)

004541704.b3lyp_6-31g(d).gjf (generated)

004541704.b3lyp_6-31g(d).firefly.inp (generated)

004541704.b3lyp_6-31g(d).smash.inp (generated)

004541704.b3lyp_6-31g(d).nwchem.inp (generated) 004541704.b3lyp_6-31g(d).log.xz 004541704.td-b3lyp_6-31g+(d).inp 004541704.td-b3lyp_6-31g+(d).log.xz

004541704.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541704.td-b3lyp_6-31+g(d).gjf (generated)

004541704.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541704.mol 004541704.PUBCHEM 004541704.mol (via Jmol)
004541789.b3lyp_6-31g(d).inp

004541789.b3lyp_6-31g(d).qchem.inp (generated)

004541789.b3lyp_6-31g(d).gjf (generated)

004541789.b3lyp_6-31g(d).firefly.inp (generated)

004541789.b3lyp_6-31g(d).smash.inp (generated)

004541789.b3lyp_6-31g(d).nwchem.inp (generated) 004541789.b3lyp_6-31g(d).log.xz 004541789.td-b3lyp_6-31g+(d).inp 004541789.td-b3lyp_6-31g+(d).log.xz

004541789.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541789.td-b3lyp_6-31+g(d).gjf (generated)

004541789.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541789.mol 004541789.PUBCHEM 004541789.mol (via Jmol)
004541807.b3lyp_6-31g(d).inp

004541807.b3lyp_6-31g(d).qchem.inp (generated)

004541807.b3lyp_6-31g(d).gjf (generated)

004541807.b3lyp_6-31g(d).firefly.inp (generated)

004541807.b3lyp_6-31g(d).smash.inp (generated)

004541807.b3lyp_6-31g(d).nwchem.inp (generated) 004541807.b3lyp_6-31g(d).log.xz 004541807.td-b3lyp_6-31g+(d).inp 004541807.td-b3lyp_6-31g+(d).log.xz

004541807.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541807.td-b3lyp_6-31+g(d).gjf (generated)

004541807.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541807.mol 004541807.PUBCHEM 004541807.mol (via Jmol)
004541896.b3lyp_6-31g(d).inp

004541896.b3lyp_6-31g(d).qchem.inp (generated)

004541896.b3lyp_6-31g(d).gjf (generated)

004541896.b3lyp_6-31g(d).firefly.inp (generated)

004541896.b3lyp_6-31g(d).smash.inp (generated)

004541896.b3lyp_6-31g(d).nwchem.inp (generated) 004541896.b3lyp_6-31g(d).log.xz 004541896.td-b3lyp_6-31g+(d).inp 004541896.td-b3lyp_6-31g+(d).log.xz

004541896.td-b3lyp_6-31+g(d).qchem.inp (generated)

004541896.td-b3lyp_6-31+g(d).gjf (generated)

004541896.td-b3lyp_6-31+g(d).firefly.inp (generated)

004541896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004541896.mol 004541896.PUBCHEM 004541896.mol (via Jmol)
004542027.b3lyp_6-31g(d).inp

004542027.b3lyp_6-31g(d).qchem.inp (generated)

004542027.b3lyp_6-31g(d).gjf (generated)

004542027.b3lyp_6-31g(d).firefly.inp (generated)

004542027.b3lyp_6-31g(d).smash.inp (generated)

004542027.b3lyp_6-31g(d).nwchem.inp (generated) 004542027.b3lyp_6-31g(d).log.xz 004542027.td-b3lyp_6-31g+(d).inp 004542027.td-b3lyp_6-31g+(d).log.xz

004542027.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542027.td-b3lyp_6-31+g(d).gjf (generated)

004542027.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542027.mol 004542027.PUBCHEM 004542027.mol (via Jmol)
004542029.b3lyp_6-31g(d).inp

004542029.b3lyp_6-31g(d).qchem.inp (generated)

004542029.b3lyp_6-31g(d).gjf (generated)

004542029.b3lyp_6-31g(d).firefly.inp (generated)

004542029.b3lyp_6-31g(d).smash.inp (generated)

004542029.b3lyp_6-31g(d).nwchem.inp (generated) 004542029.b3lyp_6-31g(d).log.xz 004542029.td-b3lyp_6-31g+(d).inp 004542029.td-b3lyp_6-31g+(d).log.xz

004542029.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542029.td-b3lyp_6-31+g(d).gjf (generated)

004542029.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542029.mol 004542029.PUBCHEM 004542029.mol (via Jmol)
004542055.b3lyp_6-31g(d).inp

004542055.b3lyp_6-31g(d).qchem.inp (generated)

004542055.b3lyp_6-31g(d).gjf (generated)

004542055.b3lyp_6-31g(d).firefly.inp (generated)

004542055.b3lyp_6-31g(d).smash.inp (generated)

004542055.b3lyp_6-31g(d).nwchem.inp (generated) 004542055.b3lyp_6-31g(d).log.xz 004542055.td-b3lyp_6-31g+(d).inp 004542055.td-b3lyp_6-31g+(d).log.xz

004542055.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542055.td-b3lyp_6-31+g(d).gjf (generated)

004542055.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542055.mol 004542055.PUBCHEM 004542055.mol (via Jmol)
004542307.b3lyp_6-31g(d).inp

004542307.b3lyp_6-31g(d).qchem.inp (generated)

004542307.b3lyp_6-31g(d).gjf (generated)

004542307.b3lyp_6-31g(d).firefly.inp (generated)

004542307.b3lyp_6-31g(d).smash.inp (generated)

004542307.b3lyp_6-31g(d).nwchem.inp (generated) 004542307.b3lyp_6-31g(d).log.xz 004542307.td-b3lyp_6-31g+(d).inp 004542307.td-b3lyp_6-31g+(d).log.xz

004542307.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542307.td-b3lyp_6-31+g(d).gjf (generated)

004542307.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542307.mol 004542307.PUBCHEM 004542307.mol (via Jmol)
004542424.b3lyp_6-31g(d).inp

004542424.b3lyp_6-31g(d).qchem.inp (generated)

004542424.b3lyp_6-31g(d).gjf (generated)

004542424.b3lyp_6-31g(d).firefly.inp (generated)

004542424.b3lyp_6-31g(d).smash.inp (generated)

004542424.b3lyp_6-31g(d).nwchem.inp (generated) 004542424.b3lyp_6-31g(d).log.xz 004542424.td-b3lyp_6-31g+(d).inp 004542424.td-b3lyp_6-31g+(d).log.xz

004542424.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542424.td-b3lyp_6-31+g(d).gjf (generated)

004542424.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542424.mol 004542424.PUBCHEM 004542424.mol (via Jmol)
004542494.b3lyp_6-31g(d).inp

004542494.b3lyp_6-31g(d).qchem.inp (generated)

004542494.b3lyp_6-31g(d).gjf (generated)

004542494.b3lyp_6-31g(d).firefly.inp (generated)

004542494.b3lyp_6-31g(d).smash.inp (generated)

004542494.b3lyp_6-31g(d).nwchem.inp (generated) 004542494.b3lyp_6-31g(d).log.xz 004542494.td-b3lyp_6-31g+(d).inp 004542494.td-b3lyp_6-31g+(d).log.xz

004542494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542494.td-b3lyp_6-31+g(d).gjf (generated)

004542494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542494.mol 004542494.PUBCHEM 004542494.mol (via Jmol)
004542495.b3lyp_6-31g(d).inp

004542495.b3lyp_6-31g(d).qchem.inp (generated)

004542495.b3lyp_6-31g(d).gjf (generated)

004542495.b3lyp_6-31g(d).firefly.inp (generated)

004542495.b3lyp_6-31g(d).smash.inp (generated)

004542495.b3lyp_6-31g(d).nwchem.inp (generated) 004542495.b3lyp_6-31g(d).log.xz 004542495.td-b3lyp_6-31g+(d).inp 004542495.td-b3lyp_6-31g+(d).log.xz

004542495.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542495.td-b3lyp_6-31+g(d).gjf (generated)

004542495.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542495.mol 004542495.PUBCHEM 004542495.mol (via Jmol)
004542602.b3lyp_6-31g(d).inp

004542602.b3lyp_6-31g(d).qchem.inp (generated)

004542602.b3lyp_6-31g(d).gjf (generated)

004542602.b3lyp_6-31g(d).firefly.inp (generated)

004542602.b3lyp_6-31g(d).smash.inp (generated)

004542602.b3lyp_6-31g(d).nwchem.inp (generated) 004542602.b3lyp_6-31g(d).log.xz 004542602.mol 004542602.PUBCHEM 004542602.mol (via Jmol)
004542674.b3lyp_6-31g(d).inp

004542674.b3lyp_6-31g(d).qchem.inp (generated)

004542674.b3lyp_6-31g(d).gjf (generated)

004542674.b3lyp_6-31g(d).firefly.inp (generated)

004542674.b3lyp_6-31g(d).smash.inp (generated)

004542674.b3lyp_6-31g(d).nwchem.inp (generated) 004542674.b3lyp_6-31g(d).log.xz 004542674.td-b3lyp_6-31g+(d).inp 004542674.td-b3lyp_6-31g+(d).log.xz

004542674.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542674.td-b3lyp_6-31+g(d).gjf (generated)

004542674.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542674.mol 004542674.PUBCHEM 004542674.mol (via Jmol)
004542679.b3lyp_6-31g(d).inp

004542679.b3lyp_6-31g(d).qchem.inp (generated)

004542679.b3lyp_6-31g(d).gjf (generated)

004542679.b3lyp_6-31g(d).firefly.inp (generated)

004542679.b3lyp_6-31g(d).smash.inp (generated)

004542679.b3lyp_6-31g(d).nwchem.inp (generated) 004542679.b3lyp_6-31g(d).log.xz 004542679.td-b3lyp_6-31g+(d).inp 004542679.td-b3lyp_6-31g+(d).log.xz

004542679.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542679.td-b3lyp_6-31+g(d).gjf (generated)

004542679.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542679.mol 004542679.PUBCHEM 004542679.mol (via Jmol)
004542680.b3lyp_6-31g(d).inp

004542680.b3lyp_6-31g(d).qchem.inp (generated)

004542680.b3lyp_6-31g(d).gjf (generated)

004542680.b3lyp_6-31g(d).firefly.inp (generated)

004542680.b3lyp_6-31g(d).smash.inp (generated)

004542680.b3lyp_6-31g(d).nwchem.inp (generated) 004542680.b3lyp_6-31g(d).log.xz 004542680.td-b3lyp_6-31g+(d).inp 004542680.td-b3lyp_6-31g+(d).log.xz

004542680.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542680.td-b3lyp_6-31+g(d).gjf (generated)

004542680.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542680.mol 004542680.PUBCHEM 004542680.mol (via Jmol)
004542717.b3lyp_6-31g(d).inp

004542717.b3lyp_6-31g(d).qchem.inp (generated)

004542717.b3lyp_6-31g(d).gjf (generated)

004542717.b3lyp_6-31g(d).firefly.inp (generated)

004542717.b3lyp_6-31g(d).smash.inp (generated)

004542717.b3lyp_6-31g(d).nwchem.inp (generated) 004542717.b3lyp_6-31g(d).log.xz 004542717.td-b3lyp_6-31g+(d).inp 004542717.td-b3lyp_6-31g+(d).log.xz

004542717.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542717.td-b3lyp_6-31+g(d).gjf (generated)

004542717.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542717.mol 004542717.PUBCHEM 004542717.mol (via Jmol)
004542860.b3lyp_6-31g(d).inp

004542860.b3lyp_6-31g(d).qchem.inp (generated)

004542860.b3lyp_6-31g(d).gjf (generated)

004542860.b3lyp_6-31g(d).firefly.inp (generated)

004542860.b3lyp_6-31g(d).smash.inp (generated)

004542860.b3lyp_6-31g(d).nwchem.inp (generated) 004542860.b3lyp_6-31g(d).log.xz 004542860.td-b3lyp_6-31g+(d).inp 004542860.td-b3lyp_6-31g+(d).log.xz

004542860.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542860.td-b3lyp_6-31+g(d).gjf (generated)

004542860.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542860.mol 004542860.PUBCHEM 004542860.mol (via Jmol)
004542876.b3lyp_6-31g(d).inp

004542876.b3lyp_6-31g(d).qchem.inp (generated)

004542876.b3lyp_6-31g(d).gjf (generated)

004542876.b3lyp_6-31g(d).firefly.inp (generated)

004542876.b3lyp_6-31g(d).smash.inp (generated)

004542876.b3lyp_6-31g(d).nwchem.inp (generated) 004542876.b3lyp_6-31g(d).log.xz 004542876.td-b3lyp_6-31g+(d).inp 004542876.td-b3lyp_6-31g+(d).log.xz

004542876.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542876.td-b3lyp_6-31+g(d).gjf (generated)

004542876.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542876.mol 004542876.PUBCHEM 004542876.mol (via Jmol)
004542935.b3lyp_6-31g(d).inp

004542935.b3lyp_6-31g(d).qchem.inp (generated)

004542935.b3lyp_6-31g(d).gjf (generated)

004542935.b3lyp_6-31g(d).firefly.inp (generated)

004542935.b3lyp_6-31g(d).smash.inp (generated)

004542935.b3lyp_6-31g(d).nwchem.inp (generated) 004542935.b3lyp_6-31g(d).log.xz 004542935.mol 004542935.PUBCHEM 004542935.mol (via Jmol)
004542946.b3lyp_6-31g(d).inp

004542946.b3lyp_6-31g(d).qchem.inp (generated)

004542946.b3lyp_6-31g(d).gjf (generated)

004542946.b3lyp_6-31g(d).firefly.inp (generated)

004542946.b3lyp_6-31g(d).smash.inp (generated)

004542946.b3lyp_6-31g(d).nwchem.inp (generated) 004542946.b3lyp_6-31g(d).log.xz 004542946.mol 004542946.PUBCHEM 004542946.mol (via Jmol)
004542970.b3lyp_6-31g(d).inp

004542970.b3lyp_6-31g(d).qchem.inp (generated)

004542970.b3lyp_6-31g(d).gjf (generated)

004542970.b3lyp_6-31g(d).firefly.inp (generated)

004542970.b3lyp_6-31g(d).smash.inp (generated)

004542970.b3lyp_6-31g(d).nwchem.inp (generated) 004542970.b3lyp_6-31g(d).log.xz 004542970.td-b3lyp_6-31g+(d).inp 004542970.td-b3lyp_6-31g+(d).log.xz

004542970.td-b3lyp_6-31+g(d).qchem.inp (generated)

004542970.td-b3lyp_6-31+g(d).gjf (generated)

004542970.td-b3lyp_6-31+g(d).firefly.inp (generated)

004542970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004542970.mol 004542970.PUBCHEM 004542970.mol (via Jmol)
004543038.b3lyp_6-31g(d).inp

004543038.b3lyp_6-31g(d).qchem.inp (generated)

004543038.b3lyp_6-31g(d).gjf (generated)

004543038.b3lyp_6-31g(d).firefly.inp (generated)

004543038.b3lyp_6-31g(d).smash.inp (generated)

004543038.b3lyp_6-31g(d).nwchem.inp (generated) 004543038.b3lyp_6-31g(d).log.xz 004543038.td-b3lyp_6-31g+(d).inp 004543038.td-b3lyp_6-31g+(d).log.xz

004543038.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543038.td-b3lyp_6-31+g(d).gjf (generated)

004543038.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543038.mol 004543038.PUBCHEM 004543038.mol (via Jmol)
004543053.b3lyp_6-31g(d).inp

004543053.b3lyp_6-31g(d).qchem.inp (generated)

004543053.b3lyp_6-31g(d).gjf (generated)

004543053.b3lyp_6-31g(d).firefly.inp (generated)

004543053.b3lyp_6-31g(d).smash.inp (generated)

004543053.b3lyp_6-31g(d).nwchem.inp (generated) 004543053.b3lyp_6-31g(d).log.xz 004543053.td-b3lyp_6-31g+(d).inp 004543053.td-b3lyp_6-31g+(d).log.xz

004543053.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543053.td-b3lyp_6-31+g(d).gjf (generated)

004543053.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543053.mol 004543053.PUBCHEM 004543053.mol (via Jmol)
004543103.b3lyp_6-31g(d).inp

004543103.b3lyp_6-31g(d).qchem.inp (generated)

004543103.b3lyp_6-31g(d).gjf (generated)

004543103.b3lyp_6-31g(d).firefly.inp (generated)

004543103.b3lyp_6-31g(d).smash.inp (generated)

004543103.b3lyp_6-31g(d).nwchem.inp (generated) 004543103.b3lyp_6-31g(d).log.xz 004543103.mol 004543103.PUBCHEM 004543103.mol (via Jmol)
004543259.b3lyp_6-31g(d).inp

004543259.b3lyp_6-31g(d).qchem.inp (generated)

004543259.b3lyp_6-31g(d).gjf (generated)

004543259.b3lyp_6-31g(d).firefly.inp (generated)

004543259.b3lyp_6-31g(d).smash.inp (generated)

004543259.b3lyp_6-31g(d).nwchem.inp (generated) 004543259.b3lyp_6-31g(d).log.xz 004543259.td-b3lyp_6-31g+(d).inp 004543259.td-b3lyp_6-31g+(d).log.xz

004543259.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543259.td-b3lyp_6-31+g(d).gjf (generated)

004543259.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543259.mol 004543259.PUBCHEM 004543259.mol (via Jmol)
004543295.b3lyp_6-31g(d).inp

004543295.b3lyp_6-31g(d).qchem.inp (generated)

004543295.b3lyp_6-31g(d).gjf (generated)

004543295.b3lyp_6-31g(d).firefly.inp (generated)

004543295.b3lyp_6-31g(d).smash.inp (generated)

004543295.b3lyp_6-31g(d).nwchem.inp (generated) 004543295.b3lyp_6-31g(d).log.xz 004543295.td-b3lyp_6-31g+(d).inp 004543295.td-b3lyp_6-31g+(d).log.xz

004543295.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543295.td-b3lyp_6-31+g(d).gjf (generated)

004543295.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543295.mol 004543295.PUBCHEM 004543295.mol (via Jmol)
004543300.b3lyp_6-31g(d).inp

004543300.b3lyp_6-31g(d).qchem.inp (generated)

004543300.b3lyp_6-31g(d).gjf (generated)

004543300.b3lyp_6-31g(d).firefly.inp (generated)

004543300.b3lyp_6-31g(d).smash.inp (generated)

004543300.b3lyp_6-31g(d).nwchem.inp (generated) 004543300.b3lyp_6-31g(d).log.xz 004543300.td-b3lyp_6-31g+(d).inp 004543300.td-b3lyp_6-31g+(d).log.xz

004543300.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543300.td-b3lyp_6-31+g(d).gjf (generated)

004543300.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543300.mol 004543300.PUBCHEM 004543300.mol (via Jmol)
004543316.b3lyp_6-31g(d).inp

004543316.b3lyp_6-31g(d).qchem.inp (generated)

004543316.b3lyp_6-31g(d).gjf (generated)

004543316.b3lyp_6-31g(d).firefly.inp (generated)

004543316.b3lyp_6-31g(d).smash.inp (generated)

004543316.b3lyp_6-31g(d).nwchem.inp (generated) 004543316.b3lyp_6-31g(d).log.xz 004543316.td-b3lyp_6-31g+(d).inp 004543316.td-b3lyp_6-31g+(d).log.xz

004543316.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543316.td-b3lyp_6-31+g(d).gjf (generated)

004543316.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543316.mol 004543316.PUBCHEM 004543316.mol (via Jmol)
004543353.b3lyp_6-31g(d).inp

004543353.b3lyp_6-31g(d).qchem.inp (generated)

004543353.b3lyp_6-31g(d).gjf (generated)

004543353.b3lyp_6-31g(d).firefly.inp (generated)

004543353.b3lyp_6-31g(d).smash.inp (generated)

004543353.b3lyp_6-31g(d).nwchem.inp (generated) 004543353.b3lyp_6-31g(d).log.xz 004543353.td-b3lyp_6-31g+(d).inp 004543353.td-b3lyp_6-31g+(d).log.xz

004543353.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543353.td-b3lyp_6-31+g(d).gjf (generated)

004543353.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543353.mol 004543353.PUBCHEM 004543353.mol (via Jmol)
004543372.b3lyp_6-31g(d).inp

004543372.b3lyp_6-31g(d).qchem.inp (generated)

004543372.b3lyp_6-31g(d).gjf (generated)

004543372.b3lyp_6-31g(d).firefly.inp (generated)

004543372.b3lyp_6-31g(d).smash.inp (generated)

004543372.b3lyp_6-31g(d).nwchem.inp (generated) 004543372.b3lyp_6-31g(d).log.xz 004543372.td-b3lyp_6-31g+(d).inp 004543372.td-b3lyp_6-31g+(d).log.xz

004543372.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543372.td-b3lyp_6-31+g(d).gjf (generated)

004543372.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543372.mol 004543372.PUBCHEM 004543372.mol (via Jmol)
004543390.b3lyp_6-31g(d).inp

004543390.b3lyp_6-31g(d).qchem.inp (generated)

004543390.b3lyp_6-31g(d).gjf (generated)

004543390.b3lyp_6-31g(d).firefly.inp (generated)

004543390.b3lyp_6-31g(d).smash.inp (generated)

004543390.b3lyp_6-31g(d).nwchem.inp (generated) 004543390.b3lyp_6-31g(d).log.xz 004543390.td-b3lyp_6-31g+(d).inp 004543390.td-b3lyp_6-31g+(d).log.xz

004543390.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543390.td-b3lyp_6-31+g(d).gjf (generated)

004543390.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543390.mol 004543390.PUBCHEM 004543390.mol (via Jmol)
004543394.b3lyp_6-31g(d).inp

004543394.b3lyp_6-31g(d).qchem.inp (generated)

004543394.b3lyp_6-31g(d).gjf (generated)

004543394.b3lyp_6-31g(d).firefly.inp (generated)

004543394.b3lyp_6-31g(d).smash.inp (generated)

004543394.b3lyp_6-31g(d).nwchem.inp (generated) 004543394.b3lyp_6-31g(d).log.xz 004543394.td-b3lyp_6-31g+(d).inp 004543394.td-b3lyp_6-31g+(d).log.xz

004543394.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543394.td-b3lyp_6-31+g(d).gjf (generated)

004543394.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543394.mol 004543394.PUBCHEM 004543394.mol (via Jmol)
004543451.b3lyp_6-31g(d).inp

004543451.b3lyp_6-31g(d).qchem.inp (generated)

004543451.b3lyp_6-31g(d).gjf (generated)

004543451.b3lyp_6-31g(d).firefly.inp (generated)

004543451.b3lyp_6-31g(d).smash.inp (generated)

004543451.b3lyp_6-31g(d).nwchem.inp (generated) 004543451.b3lyp_6-31g(d).log.xz 004543451.td-b3lyp_6-31g+(d).inp 004543451.td-b3lyp_6-31g+(d).log.xz

004543451.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543451.td-b3lyp_6-31+g(d).gjf (generated)

004543451.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543451.mol 004543451.PUBCHEM 004543451.mol (via Jmol)
004543535.b3lyp_6-31g(d).inp

004543535.b3lyp_6-31g(d).qchem.inp (generated)

004543535.b3lyp_6-31g(d).gjf (generated)

004543535.b3lyp_6-31g(d).firefly.inp (generated)

004543535.b3lyp_6-31g(d).smash.inp (generated)

004543535.b3lyp_6-31g(d).nwchem.inp (generated) 004543535.b3lyp_6-31g(d).log.xz 004543535.mol 004543535.PUBCHEM 004543535.mol (via Jmol)
004543663.b3lyp_6-31g(d).inp

004543663.b3lyp_6-31g(d).qchem.inp (generated)

004543663.b3lyp_6-31g(d).gjf (generated)

004543663.b3lyp_6-31g(d).firefly.inp (generated)

004543663.b3lyp_6-31g(d).smash.inp (generated)

004543663.b3lyp_6-31g(d).nwchem.inp (generated) 004543663.b3lyp_6-31g(d).log.xz 004543663.td-b3lyp_6-31g+(d).inp 004543663.td-b3lyp_6-31g+(d).log.xz

004543663.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543663.td-b3lyp_6-31+g(d).gjf (generated)

004543663.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543663.mol 004543663.PUBCHEM 004543663.mol (via Jmol)
004543668.b3lyp_6-31g(d).inp

004543668.b3lyp_6-31g(d).qchem.inp (generated)

004543668.b3lyp_6-31g(d).gjf (generated)

004543668.b3lyp_6-31g(d).firefly.inp (generated)

004543668.b3lyp_6-31g(d).smash.inp (generated)

004543668.b3lyp_6-31g(d).nwchem.inp (generated) 004543668.b3lyp_6-31g(d).log.xz 004543668.td-b3lyp_6-31g+(d).inp 004543668.td-b3lyp_6-31g+(d).log.xz

004543668.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543668.td-b3lyp_6-31+g(d).gjf (generated)

004543668.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543668.mol 004543668.PUBCHEM 004543668.mol (via Jmol)
004543738.b3lyp_6-31g(d).inp

004543738.b3lyp_6-31g(d).qchem.inp (generated)

004543738.b3lyp_6-31g(d).gjf (generated)

004543738.b3lyp_6-31g(d).firefly.inp (generated)

004543738.b3lyp_6-31g(d).smash.inp (generated)

004543738.b3lyp_6-31g(d).nwchem.inp (generated) 004543738.b3lyp_6-31g(d).log.xz 004543738.mol 004543738.PUBCHEM 004543738.mol (via Jmol)
004543795.b3lyp_6-31g(d).inp

004543795.b3lyp_6-31g(d).qchem.inp (generated)

004543795.b3lyp_6-31g(d).gjf (generated)

004543795.b3lyp_6-31g(d).firefly.inp (generated)

004543795.b3lyp_6-31g(d).smash.inp (generated)

004543795.b3lyp_6-31g(d).nwchem.inp (generated) 004543795.b3lyp_6-31g(d).log.xz 004543795.td-b3lyp_6-31g+(d).inp 004543795.td-b3lyp_6-31g+(d).log.xz

004543795.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543795.td-b3lyp_6-31+g(d).gjf (generated)

004543795.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543795.mol 004543795.PUBCHEM 004543795.mol (via Jmol)
004543797.b3lyp_6-31g(d).inp

004543797.b3lyp_6-31g(d).qchem.inp (generated)

004543797.b3lyp_6-31g(d).gjf (generated)

004543797.b3lyp_6-31g(d).firefly.inp (generated)

004543797.b3lyp_6-31g(d).smash.inp (generated)

004543797.b3lyp_6-31g(d).nwchem.inp (generated) 004543797.b3lyp_6-31g(d).log.xz 004543797.td-b3lyp_6-31g+(d).inp 004543797.td-b3lyp_6-31g+(d).log.xz

004543797.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543797.td-b3lyp_6-31+g(d).gjf (generated)

004543797.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543797.mol 004543797.PUBCHEM 004543797.mol (via Jmol)
004543850.b3lyp_6-31g(d).inp

004543850.b3lyp_6-31g(d).qchem.inp (generated)

004543850.b3lyp_6-31g(d).gjf (generated)

004543850.b3lyp_6-31g(d).firefly.inp (generated)

004543850.b3lyp_6-31g(d).smash.inp (generated)

004543850.b3lyp_6-31g(d).nwchem.inp (generated) 004543850.b3lyp_6-31g(d).log.xz 004543850.td-b3lyp_6-31g+(d).inp 004543850.td-b3lyp_6-31g+(d).log.xz

004543850.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543850.td-b3lyp_6-31+g(d).gjf (generated)

004543850.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543850.mol 004543850.PUBCHEM 004543850.mol (via Jmol)
004543920.b3lyp_6-31g(d).inp

004543920.b3lyp_6-31g(d).qchem.inp (generated)

004543920.b3lyp_6-31g(d).gjf (generated)

004543920.b3lyp_6-31g(d).firefly.inp (generated)

004543920.b3lyp_6-31g(d).smash.inp (generated)

004543920.b3lyp_6-31g(d).nwchem.inp (generated) 004543920.b3lyp_6-31g(d).log.xz 004543920.td-b3lyp_6-31g+(d).inp 004543920.td-b3lyp_6-31g+(d).log.xz

004543920.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543920.td-b3lyp_6-31+g(d).gjf (generated)

004543920.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543920.mol 004543920.PUBCHEM 004543920.mol (via Jmol)
004543976.b3lyp_6-31g(d).inp

004543976.b3lyp_6-31g(d).qchem.inp (generated)

004543976.b3lyp_6-31g(d).gjf (generated)

004543976.b3lyp_6-31g(d).firefly.inp (generated)

004543976.b3lyp_6-31g(d).smash.inp (generated)

004543976.b3lyp_6-31g(d).nwchem.inp (generated) 004543976.b3lyp_6-31g(d).log.xz 004543976.td-b3lyp_6-31g+(d).inp 004543976.td-b3lyp_6-31g+(d).log.xz

004543976.td-b3lyp_6-31+g(d).qchem.inp (generated)

004543976.td-b3lyp_6-31+g(d).gjf (generated)

004543976.td-b3lyp_6-31+g(d).firefly.inp (generated)

004543976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004543976.mol 004543976.PUBCHEM 004543976.mol (via Jmol)
004544134.b3lyp_6-31g(d).inp

004544134.b3lyp_6-31g(d).qchem.inp (generated)

004544134.b3lyp_6-31g(d).gjf (generated)

004544134.b3lyp_6-31g(d).firefly.inp (generated)

004544134.b3lyp_6-31g(d).smash.inp (generated)

004544134.b3lyp_6-31g(d).nwchem.inp (generated) 004544134.b3lyp_6-31g(d).log.xz 004544134.td-b3lyp_6-31g+(d).inp 004544134.td-b3lyp_6-31g+(d).log.xz

004544134.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544134.td-b3lyp_6-31+g(d).gjf (generated)

004544134.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544134.mol 004544134.PUBCHEM 004544134.mol (via Jmol)
004544210.b3lyp_6-31g(d).inp

004544210.b3lyp_6-31g(d).qchem.inp (generated)

004544210.b3lyp_6-31g(d).gjf (generated)

004544210.b3lyp_6-31g(d).firefly.inp (generated)

004544210.b3lyp_6-31g(d).smash.inp (generated)

004544210.b3lyp_6-31g(d).nwchem.inp (generated) 004544210.b3lyp_6-31g(d).log.xz 004544210.td-b3lyp_6-31g+(d).inp 004544210.td-b3lyp_6-31g+(d).log.xz

004544210.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544210.td-b3lyp_6-31+g(d).gjf (generated)

004544210.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544210.mol 004544210.PUBCHEM 004544210.mol (via Jmol)
004544325.b3lyp_6-31g(d).inp

004544325.b3lyp_6-31g(d).qchem.inp (generated)

004544325.b3lyp_6-31g(d).gjf (generated)

004544325.b3lyp_6-31g(d).firefly.inp (generated)

004544325.b3lyp_6-31g(d).smash.inp (generated)

004544325.b3lyp_6-31g(d).nwchem.inp (generated) 004544325.b3lyp_6-31g(d).log.xz 004544325.mol 004544325.PUBCHEM 004544325.mol (via Jmol)
004544425.b3lyp_6-31g(d).inp

004544425.b3lyp_6-31g(d).qchem.inp (generated)

004544425.b3lyp_6-31g(d).gjf (generated)

004544425.b3lyp_6-31g(d).firefly.inp (generated)

004544425.b3lyp_6-31g(d).smash.inp (generated)

004544425.b3lyp_6-31g(d).nwchem.inp (generated) 004544425.b3lyp_6-31g(d).log.xz 004544425.mol 004544425.PUBCHEM 004544425.mol (via Jmol)
004544528.b3lyp_6-31g(d).inp

004544528.b3lyp_6-31g(d).qchem.inp (generated)

004544528.b3lyp_6-31g(d).gjf (generated)

004544528.b3lyp_6-31g(d).firefly.inp (generated)

004544528.b3lyp_6-31g(d).smash.inp (generated)

004544528.b3lyp_6-31g(d).nwchem.inp (generated) 004544528.b3lyp_6-31g(d).log.xz 004544528.td-b3lyp_6-31g+(d).inp 004544528.td-b3lyp_6-31g+(d).log.xz

004544528.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544528.td-b3lyp_6-31+g(d).gjf (generated)

004544528.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544528.mol 004544528.PUBCHEM 004544528.mol (via Jmol)
004544544.b3lyp_6-31g(d).inp

004544544.b3lyp_6-31g(d).qchem.inp (generated)

004544544.b3lyp_6-31g(d).gjf (generated)

004544544.b3lyp_6-31g(d).firefly.inp (generated)

004544544.b3lyp_6-31g(d).smash.inp (generated)

004544544.b3lyp_6-31g(d).nwchem.inp (generated) 004544544.b3lyp_6-31g(d).log.xz 004544544.mol 004544544.PUBCHEM 004544544.mol (via Jmol)
004544632.b3lyp_6-31g(d).inp

004544632.b3lyp_6-31g(d).qchem.inp (generated)

004544632.b3lyp_6-31g(d).gjf (generated)

004544632.b3lyp_6-31g(d).firefly.inp (generated)

004544632.b3lyp_6-31g(d).smash.inp (generated)

004544632.b3lyp_6-31g(d).nwchem.inp (generated) 004544632.b3lyp_6-31g(d).log.xz 004544632.td-b3lyp_6-31g+(d).inp 004544632.td-b3lyp_6-31g+(d).log.xz

004544632.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544632.td-b3lyp_6-31+g(d).gjf (generated)

004544632.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544632.mol 004544632.PUBCHEM 004544632.mol (via Jmol)
004544655.b3lyp_6-31g(d).inp

004544655.b3lyp_6-31g(d).qchem.inp (generated)

004544655.b3lyp_6-31g(d).gjf (generated)

004544655.b3lyp_6-31g(d).firefly.inp (generated)

004544655.b3lyp_6-31g(d).smash.inp (generated)

004544655.b3lyp_6-31g(d).nwchem.inp (generated) 004544655.b3lyp_6-31g(d).log.xz 004544655.td-b3lyp_6-31g+(d).inp 004544655.td-b3lyp_6-31g+(d).log.xz

004544655.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544655.td-b3lyp_6-31+g(d).gjf (generated)

004544655.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544655.mol 004544655.PUBCHEM 004544655.mol (via Jmol)
004544772.b3lyp_6-31g(d).inp

004544772.b3lyp_6-31g(d).qchem.inp (generated)

004544772.b3lyp_6-31g(d).gjf (generated)

004544772.b3lyp_6-31g(d).firefly.inp (generated)

004544772.b3lyp_6-31g(d).smash.inp (generated)

004544772.b3lyp_6-31g(d).nwchem.inp (generated) 004544772.b3lyp_6-31g(d).log.xz 004544772.td-b3lyp_6-31g+(d).inp 004544772.td-b3lyp_6-31g+(d).log.xz

004544772.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544772.td-b3lyp_6-31+g(d).gjf (generated)

004544772.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544772.mol 004544772.PUBCHEM 004544772.mol (via Jmol)
004544809.b3lyp_6-31g(d).inp

004544809.b3lyp_6-31g(d).qchem.inp (generated)

004544809.b3lyp_6-31g(d).gjf (generated)

004544809.b3lyp_6-31g(d).firefly.inp (generated)

004544809.b3lyp_6-31g(d).smash.inp (generated)

004544809.b3lyp_6-31g(d).nwchem.inp (generated) 004544809.b3lyp_6-31g(d).log.xz 004544809.td-b3lyp_6-31g+(d).inp 004544809.td-b3lyp_6-31g+(d).log.xz

004544809.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544809.td-b3lyp_6-31+g(d).gjf (generated)

004544809.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544809.mol 004544809.PUBCHEM 004544809.mol (via Jmol)
004544831.b3lyp_6-31g(d).inp

004544831.b3lyp_6-31g(d).qchem.inp (generated)

004544831.b3lyp_6-31g(d).gjf (generated)

004544831.b3lyp_6-31g(d).firefly.inp (generated)

004544831.b3lyp_6-31g(d).smash.inp (generated)

004544831.b3lyp_6-31g(d).nwchem.inp (generated) 004544831.b3lyp_6-31g(d).log.xz 004544831.td-b3lyp_6-31g+(d).inp 004544831.td-b3lyp_6-31g+(d).log.xz

004544831.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544831.td-b3lyp_6-31+g(d).gjf (generated)

004544831.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544831.mol 004544831.PUBCHEM 004544831.mol (via Jmol)
004544960.b3lyp_6-31g(d).inp

004544960.b3lyp_6-31g(d).qchem.inp (generated)

004544960.b3lyp_6-31g(d).gjf (generated)

004544960.b3lyp_6-31g(d).firefly.inp (generated)

004544960.b3lyp_6-31g(d).smash.inp (generated)

004544960.b3lyp_6-31g(d).nwchem.inp (generated) 004544960.b3lyp_6-31g(d).log.xz 004544960.td-b3lyp_6-31g+(d).inp 004544960.td-b3lyp_6-31g+(d).log.xz

004544960.td-b3lyp_6-31+g(d).qchem.inp (generated)

004544960.td-b3lyp_6-31+g(d).gjf (generated)

004544960.td-b3lyp_6-31+g(d).firefly.inp (generated)

004544960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004544960.mol 004544960.PUBCHEM 004544960.mol (via Jmol)
004545022.b3lyp_6-31g(d).inp

004545022.b3lyp_6-31g(d).qchem.inp (generated)

004545022.b3lyp_6-31g(d).gjf (generated)

004545022.b3lyp_6-31g(d).firefly.inp (generated)

004545022.b3lyp_6-31g(d).smash.inp (generated)

004545022.b3lyp_6-31g(d).nwchem.inp (generated) 004545022.b3lyp_6-31g(d).log.xz 004545022.td-b3lyp_6-31g+(d).inp 004545022.td-b3lyp_6-31g+(d).log.xz

004545022.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545022.td-b3lyp_6-31+g(d).gjf (generated)

004545022.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545022.mol 004545022.PUBCHEM 004545022.mol (via Jmol)
004545065.b3lyp_6-31g(d).inp

004545065.b3lyp_6-31g(d).qchem.inp (generated)

004545065.b3lyp_6-31g(d).gjf (generated)

004545065.b3lyp_6-31g(d).firefly.inp (generated)

004545065.b3lyp_6-31g(d).smash.inp (generated)

004545065.b3lyp_6-31g(d).nwchem.inp (generated) 004545065.b3lyp_6-31g(d).log.xz 004545065.td-b3lyp_6-31g+(d).inp 004545065.td-b3lyp_6-31g+(d).log.xz

004545065.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545065.td-b3lyp_6-31+g(d).gjf (generated)

004545065.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545065.mol 004545065.PUBCHEM 004545065.mol (via Jmol)
004545124.b3lyp_6-31g(d).inp

004545124.b3lyp_6-31g(d).qchem.inp (generated)

004545124.b3lyp_6-31g(d).gjf (generated)

004545124.b3lyp_6-31g(d).firefly.inp (generated)

004545124.b3lyp_6-31g(d).smash.inp (generated)

004545124.b3lyp_6-31g(d).nwchem.inp (generated) 004545124.b3lyp_6-31g(d).log.xz 004545124.mol 004545124.PUBCHEM 004545124.mol (via Jmol)
004545323.b3lyp_6-31g(d).inp

004545323.b3lyp_6-31g(d).qchem.inp (generated)

004545323.b3lyp_6-31g(d).gjf (generated)

004545323.b3lyp_6-31g(d).firefly.inp (generated)

004545323.b3lyp_6-31g(d).smash.inp (generated)

004545323.b3lyp_6-31g(d).nwchem.inp (generated) 004545323.b3lyp_6-31g(d).log.xz 004545323.td-b3lyp_6-31g+(d).inp 004545323.td-b3lyp_6-31g+(d).log.xz

004545323.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545323.td-b3lyp_6-31+g(d).gjf (generated)

004545323.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545323.mol 004545323.PUBCHEM 004545323.mol (via Jmol)
004545495.b3lyp_6-31g(d).inp

004545495.b3lyp_6-31g(d).qchem.inp (generated)

004545495.b3lyp_6-31g(d).gjf (generated)

004545495.b3lyp_6-31g(d).firefly.inp (generated)

004545495.b3lyp_6-31g(d).smash.inp (generated)

004545495.b3lyp_6-31g(d).nwchem.inp (generated) 004545495.b3lyp_6-31g(d).log.xz 004545495.td-b3lyp_6-31g+(d).inp 004545495.td-b3lyp_6-31g+(d).log.xz

004545495.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545495.td-b3lyp_6-31+g(d).gjf (generated)

004545495.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545495.mol 004545495.PUBCHEM 004545495.mol (via Jmol)
004545507.b3lyp_6-31g(d).inp

004545507.b3lyp_6-31g(d).qchem.inp (generated)

004545507.b3lyp_6-31g(d).gjf (generated)

004545507.b3lyp_6-31g(d).firefly.inp (generated)

004545507.b3lyp_6-31g(d).smash.inp (generated)

004545507.b3lyp_6-31g(d).nwchem.inp (generated) 004545507.b3lyp_6-31g(d).log.xz 004545507.mol 004545507.PUBCHEM 004545507.mol (via Jmol)
004545565.b3lyp_6-31g(d).inp

004545565.b3lyp_6-31g(d).qchem.inp (generated)

004545565.b3lyp_6-31g(d).gjf (generated)

004545565.b3lyp_6-31g(d).firefly.inp (generated)

004545565.b3lyp_6-31g(d).smash.inp (generated)

004545565.b3lyp_6-31g(d).nwchem.inp (generated) 004545565.b3lyp_6-31g(d).log.xz 004545565.td-b3lyp_6-31g+(d).inp 004545565.td-b3lyp_6-31g+(d).log.xz

004545565.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545565.td-b3lyp_6-31+g(d).gjf (generated)

004545565.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545565.mol 004545565.PUBCHEM 004545565.mol (via Jmol)
004545574.b3lyp_6-31g(d).inp

004545574.b3lyp_6-31g(d).qchem.inp (generated)

004545574.b3lyp_6-31g(d).gjf (generated)

004545574.b3lyp_6-31g(d).firefly.inp (generated)

004545574.b3lyp_6-31g(d).smash.inp (generated)

004545574.b3lyp_6-31g(d).nwchem.inp (generated) 004545574.b3lyp_6-31g(d).log.xz 004545574.td-b3lyp_6-31g+(d).inp 004545574.td-b3lyp_6-31g+(d).log.xz

004545574.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545574.td-b3lyp_6-31+g(d).gjf (generated)

004545574.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545574.mol 004545574.PUBCHEM 004545574.mol (via Jmol)
004545699.b3lyp_6-31g(d).inp

004545699.b3lyp_6-31g(d).qchem.inp (generated)

004545699.b3lyp_6-31g(d).gjf (generated)

004545699.b3lyp_6-31g(d).firefly.inp (generated)

004545699.b3lyp_6-31g(d).smash.inp (generated)

004545699.b3lyp_6-31g(d).nwchem.inp (generated) 004545699.b3lyp_6-31g(d).log.xz 004545699.td-b3lyp_6-31g+(d).inp 004545699.td-b3lyp_6-31g+(d).log.xz

004545699.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545699.td-b3lyp_6-31+g(d).gjf (generated)

004545699.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545699.mol 004545699.PUBCHEM 004545699.mol (via Jmol)
004545709.b3lyp_6-31g(d).inp

004545709.b3lyp_6-31g(d).qchem.inp (generated)

004545709.b3lyp_6-31g(d).gjf (generated)

004545709.b3lyp_6-31g(d).firefly.inp (generated)

004545709.b3lyp_6-31g(d).smash.inp (generated)

004545709.b3lyp_6-31g(d).nwchem.inp (generated) 004545709.b3lyp_6-31g(d).log.xz 004545709.td-b3lyp_6-31g+(d).inp 004545709.td-b3lyp_6-31g+(d).log.xz

004545709.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545709.td-b3lyp_6-31+g(d).gjf (generated)

004545709.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545709.mol 004545709.PUBCHEM 004545709.mol (via Jmol)
004545714.b3lyp_6-31g(d).inp

004545714.b3lyp_6-31g(d).qchem.inp (generated)

004545714.b3lyp_6-31g(d).gjf (generated)

004545714.b3lyp_6-31g(d).firefly.inp (generated)

004545714.b3lyp_6-31g(d).smash.inp (generated)

004545714.b3lyp_6-31g(d).nwchem.inp (generated) 004545714.b3lyp_6-31g(d).log.xz 004545714.td-b3lyp_6-31g+(d).inp 004545714.td-b3lyp_6-31g+(d).log.xz

004545714.td-b3lyp_6-31+g(d).qchem.inp (generated)

004545714.td-b3lyp_6-31+g(d).gjf (generated)

004545714.td-b3lyp_6-31+g(d).firefly.inp (generated)

004545714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004545714.mol 004545714.PUBCHEM 004545714.mol (via Jmol)
004545767.b3lyp_6-31g(d).inp

004545767.b3lyp_6-31g(d).qchem.inp (generated)

004545767.b3lyp_6-31g(d).gjf (generated)

004545767.b3lyp_6-31g(d).firefly.inp (generated)

004545767.b3lyp_6-31g(d).smash.inp (generated)