Index of

Last updated : Thu May 25 01:35:26 JST 2017
Total : 706 (585) in this page
004550115.b3lyp_6-31g(d).inp

004550115.b3lyp_6-31g(d).qchem.inp (generated)

004550115.b3lyp_6-31g(d).gjf (generated)

004550115.b3lyp_6-31g(d).firefly.inp (generated)

004550115.b3lyp_6-31g(d).smash.inp (generated)

004550115.b3lyp_6-31g(d).nwchem.inp (generated) 004550115.b3lyp_6-31g(d).log.xz 004550115.td-b3lyp_6-31g+(d).inp 004550115.td-b3lyp_6-31g+(d).log.xz

004550115.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550115.td-b3lyp_6-31+g(d).gjf (generated)

004550115.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550115.mol 004550115.PUBCHEM 004550115.mol (via Jmol)
004550118.b3lyp_6-31g(d).inp

004550118.b3lyp_6-31g(d).qchem.inp (generated)

004550118.b3lyp_6-31g(d).gjf (generated)

004550118.b3lyp_6-31g(d).firefly.inp (generated)

004550118.b3lyp_6-31g(d).smash.inp (generated)

004550118.b3lyp_6-31g(d).nwchem.inp (generated) 004550118.b3lyp_6-31g(d).log.xz 004550118.mol 004550118.PUBCHEM 004550118.mol (via Jmol)
004550176.b3lyp_6-31g(d).inp

004550176.b3lyp_6-31g(d).qchem.inp (generated)

004550176.b3lyp_6-31g(d).gjf (generated)

004550176.b3lyp_6-31g(d).firefly.inp (generated)

004550176.b3lyp_6-31g(d).smash.inp (generated)

004550176.b3lyp_6-31g(d).nwchem.inp (generated) 004550176.b3lyp_6-31g(d).log.xz 004550176.td-b3lyp_6-31g+(d).inp 004550176.td-b3lyp_6-31g+(d).log.xz

004550176.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550176.td-b3lyp_6-31+g(d).gjf (generated)

004550176.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550176.mol 004550176.PUBCHEM 004550176.mol (via Jmol)
004550244.b3lyp_6-31g(d).inp

004550244.b3lyp_6-31g(d).qchem.inp (generated)

004550244.b3lyp_6-31g(d).gjf (generated)

004550244.b3lyp_6-31g(d).firefly.inp (generated)

004550244.b3lyp_6-31g(d).smash.inp (generated)

004550244.b3lyp_6-31g(d).nwchem.inp (generated) 004550244.b3lyp_6-31g(d).log.xz 004550244.td-b3lyp_6-31g+(d).inp 004550244.td-b3lyp_6-31g+(d).log.xz

004550244.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550244.td-b3lyp_6-31+g(d).gjf (generated)

004550244.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550244.mol 004550244.PUBCHEM 004550244.mol (via Jmol)
004550249.b3lyp_6-31g(d).inp

004550249.b3lyp_6-31g(d).qchem.inp (generated)

004550249.b3lyp_6-31g(d).gjf (generated)

004550249.b3lyp_6-31g(d).firefly.inp (generated)

004550249.b3lyp_6-31g(d).smash.inp (generated)

004550249.b3lyp_6-31g(d).nwchem.inp (generated) 004550249.b3lyp_6-31g(d).log.xz 004550249.td-b3lyp_6-31g+(d).inp 004550249.td-b3lyp_6-31g+(d).log.xz

004550249.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550249.td-b3lyp_6-31+g(d).gjf (generated)

004550249.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550249.mol 004550249.PUBCHEM 004550249.mol (via Jmol)
004550250.b3lyp_6-31g(d).inp

004550250.b3lyp_6-31g(d).qchem.inp (generated)

004550250.b3lyp_6-31g(d).gjf (generated)

004550250.b3lyp_6-31g(d).firefly.inp (generated)

004550250.b3lyp_6-31g(d).smash.inp (generated)

004550250.b3lyp_6-31g(d).nwchem.inp (generated) 004550250.b3lyp_6-31g(d).log.xz 004550250.td-b3lyp_6-31g+(d).inp 004550250.td-b3lyp_6-31g+(d).log.xz

004550250.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550250.td-b3lyp_6-31+g(d).gjf (generated)

004550250.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550250.mol 004550250.PUBCHEM 004550250.mol (via Jmol)
004550284.b3lyp_6-31g(d).inp

004550284.b3lyp_6-31g(d).qchem.inp (generated)

004550284.b3lyp_6-31g(d).gjf (generated)

004550284.b3lyp_6-31g(d).firefly.inp (generated)

004550284.b3lyp_6-31g(d).smash.inp (generated)

004550284.b3lyp_6-31g(d).nwchem.inp (generated) 004550284.b3lyp_6-31g(d).log.xz 004550284.mol 004550284.PUBCHEM 004550284.mol (via Jmol)
004550289.b3lyp_6-31g(d).inp

004550289.b3lyp_6-31g(d).qchem.inp (generated)

004550289.b3lyp_6-31g(d).gjf (generated)

004550289.b3lyp_6-31g(d).firefly.inp (generated)

004550289.b3lyp_6-31g(d).smash.inp (generated)

004550289.b3lyp_6-31g(d).nwchem.inp (generated) 004550289.b3lyp_6-31g(d).log.xz 004550289.td-b3lyp_6-31g+(d).inp 004550289.td-b3lyp_6-31g+(d).log.xz

004550289.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550289.td-b3lyp_6-31+g(d).gjf (generated)

004550289.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550289.mol 004550289.PUBCHEM 004550289.mol (via Jmol)
004550409.b3lyp_6-31g(d).inp

004550409.b3lyp_6-31g(d).qchem.inp (generated)

004550409.b3lyp_6-31g(d).gjf (generated)

004550409.b3lyp_6-31g(d).firefly.inp (generated)

004550409.b3lyp_6-31g(d).smash.inp (generated)

004550409.b3lyp_6-31g(d).nwchem.inp (generated) 004550409.b3lyp_6-31g(d).log.xz 004550409.td-b3lyp_6-31g+(d).inp 004550409.td-b3lyp_6-31g+(d).log.xz

004550409.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550409.td-b3lyp_6-31+g(d).gjf (generated)

004550409.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550409.mol 004550409.PUBCHEM 004550409.mol (via Jmol)
004550448.b3lyp_6-31g(d).inp

004550448.b3lyp_6-31g(d).qchem.inp (generated)

004550448.b3lyp_6-31g(d).gjf (generated)

004550448.b3lyp_6-31g(d).firefly.inp (generated)

004550448.b3lyp_6-31g(d).smash.inp (generated)

004550448.b3lyp_6-31g(d).nwchem.inp (generated) 004550448.b3lyp_6-31g(d).log.xz 004550448.td-b3lyp_6-31g+(d).inp 004550448.td-b3lyp_6-31g+(d).log.xz

004550448.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550448.td-b3lyp_6-31+g(d).gjf (generated)

004550448.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550448.mol 004550448.PUBCHEM 004550448.mol (via Jmol)
004550454.b3lyp_6-31g(d).inp

004550454.b3lyp_6-31g(d).qchem.inp (generated)

004550454.b3lyp_6-31g(d).gjf (generated)

004550454.b3lyp_6-31g(d).firefly.inp (generated)

004550454.b3lyp_6-31g(d).smash.inp (generated)

004550454.b3lyp_6-31g(d).nwchem.inp (generated) 004550454.b3lyp_6-31g(d).log.xz 004550454.td-b3lyp_6-31g+(d).inp 004550454.td-b3lyp_6-31g+(d).log.xz

004550454.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550454.td-b3lyp_6-31+g(d).gjf (generated)

004550454.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550454.mol 004550454.PUBCHEM 004550454.mol (via Jmol)
004550461.b3lyp_6-31g(d).inp

004550461.b3lyp_6-31g(d).qchem.inp (generated)

004550461.b3lyp_6-31g(d).gjf (generated)

004550461.b3lyp_6-31g(d).firefly.inp (generated)

004550461.b3lyp_6-31g(d).smash.inp (generated)

004550461.b3lyp_6-31g(d).nwchem.inp (generated) 004550461.b3lyp_6-31g(d).log.xz 004550461.td-b3lyp_6-31g+(d).inp 004550461.td-b3lyp_6-31g+(d).log.xz

004550461.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550461.td-b3lyp_6-31+g(d).gjf (generated)

004550461.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550461.mol 004550461.PUBCHEM 004550461.mol (via Jmol)
004550484.b3lyp_6-31g(d).inp

004550484.b3lyp_6-31g(d).qchem.inp (generated)

004550484.b3lyp_6-31g(d).gjf (generated)

004550484.b3lyp_6-31g(d).firefly.inp (generated)

004550484.b3lyp_6-31g(d).smash.inp (generated)

004550484.b3lyp_6-31g(d).nwchem.inp (generated) 004550484.b3lyp_6-31g(d).log.xz 004550484.td-b3lyp_6-31g+(d).inp 004550484.td-b3lyp_6-31g+(d).log.xz

004550484.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550484.td-b3lyp_6-31+g(d).gjf (generated)

004550484.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550484.mol 004550484.PUBCHEM 004550484.mol (via Jmol)
004550486.b3lyp_6-31g(d).inp

004550486.b3lyp_6-31g(d).qchem.inp (generated)

004550486.b3lyp_6-31g(d).gjf (generated)

004550486.b3lyp_6-31g(d).firefly.inp (generated)

004550486.b3lyp_6-31g(d).smash.inp (generated)

004550486.b3lyp_6-31g(d).nwchem.inp (generated) 004550486.b3lyp_6-31g(d).log.xz 004550486.td-b3lyp_6-31g+(d).inp 004550486.td-b3lyp_6-31g+(d).log.xz

004550486.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550486.td-b3lyp_6-31+g(d).gjf (generated)

004550486.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550486.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550486.mol 004550486.PUBCHEM 004550486.mol (via Jmol)
004550489.b3lyp_6-31g(d).inp

004550489.b3lyp_6-31g(d).qchem.inp (generated)

004550489.b3lyp_6-31g(d).gjf (generated)

004550489.b3lyp_6-31g(d).firefly.inp (generated)

004550489.b3lyp_6-31g(d).smash.inp (generated)

004550489.b3lyp_6-31g(d).nwchem.inp (generated) 004550489.b3lyp_6-31g(d).log.xz 004550489.td-b3lyp_6-31g+(d).inp 004550489.td-b3lyp_6-31g+(d).log.xz

004550489.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550489.td-b3lyp_6-31+g(d).gjf (generated)

004550489.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550489.mol 004550489.PUBCHEM 004550489.mol (via Jmol)
004550548.b3lyp_6-31g(d).inp

004550548.b3lyp_6-31g(d).qchem.inp (generated)

004550548.b3lyp_6-31g(d).gjf (generated)

004550548.b3lyp_6-31g(d).firefly.inp (generated)

004550548.b3lyp_6-31g(d).smash.inp (generated)

004550548.b3lyp_6-31g(d).nwchem.inp (generated) 004550548.b3lyp_6-31g(d).log.xz 004550548.td-b3lyp_6-31g+(d).inp 004550548.td-b3lyp_6-31g+(d).log.xz

004550548.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550548.td-b3lyp_6-31+g(d).gjf (generated)

004550548.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550548.mol 004550548.PUBCHEM 004550548.mol (via Jmol)
004550594.b3lyp_6-31g(d).inp

004550594.b3lyp_6-31g(d).qchem.inp (generated)

004550594.b3lyp_6-31g(d).gjf (generated)

004550594.b3lyp_6-31g(d).firefly.inp (generated)

004550594.b3lyp_6-31g(d).smash.inp (generated)

004550594.b3lyp_6-31g(d).nwchem.inp (generated) 004550594.b3lyp_6-31g(d).log.xz 004550594.td-b3lyp_6-31g+(d).inp 004550594.td-b3lyp_6-31g+(d).log.xz

004550594.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550594.td-b3lyp_6-31+g(d).gjf (generated)

004550594.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550594.mol 004550594.PUBCHEM 004550594.mol (via Jmol)
004550598.b3lyp_6-31g(d).inp

004550598.b3lyp_6-31g(d).qchem.inp (generated)

004550598.b3lyp_6-31g(d).gjf (generated)

004550598.b3lyp_6-31g(d).firefly.inp (generated)

004550598.b3lyp_6-31g(d).smash.inp (generated)

004550598.b3lyp_6-31g(d).nwchem.inp (generated) 004550598.b3lyp_6-31g(d).log.xz 004550598.td-b3lyp_6-31g+(d).inp 004550598.td-b3lyp_6-31g+(d).log.xz

004550598.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550598.td-b3lyp_6-31+g(d).gjf (generated)

004550598.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550598.mol 004550598.PUBCHEM 004550598.mol (via Jmol)
004550609.b3lyp_6-31g(d).inp

004550609.b3lyp_6-31g(d).qchem.inp (generated)

004550609.b3lyp_6-31g(d).gjf (generated)

004550609.b3lyp_6-31g(d).firefly.inp (generated)

004550609.b3lyp_6-31g(d).smash.inp (generated)

004550609.b3lyp_6-31g(d).nwchem.inp (generated) 004550609.b3lyp_6-31g(d).log.xz 004550609.td-b3lyp_6-31g+(d).inp 004550609.td-b3lyp_6-31g+(d).log.xz

004550609.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550609.td-b3lyp_6-31+g(d).gjf (generated)

004550609.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550609.mol 004550609.PUBCHEM 004550609.mol (via Jmol)
004550615.b3lyp_6-31g(d).inp

004550615.b3lyp_6-31g(d).qchem.inp (generated)

004550615.b3lyp_6-31g(d).gjf (generated)

004550615.b3lyp_6-31g(d).firefly.inp (generated)

004550615.b3lyp_6-31g(d).smash.inp (generated)

004550615.b3lyp_6-31g(d).nwchem.inp (generated) 004550615.b3lyp_6-31g(d).log.xz 004550615.td-b3lyp_6-31g+(d).inp 004550615.td-b3lyp_6-31g+(d).log.xz

004550615.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550615.td-b3lyp_6-31+g(d).gjf (generated)

004550615.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550615.mol 004550615.PUBCHEM 004550615.mol (via Jmol)
004550616.b3lyp_6-31g(d).inp

004550616.b3lyp_6-31g(d).qchem.inp (generated)

004550616.b3lyp_6-31g(d).gjf (generated)

004550616.b3lyp_6-31g(d).firefly.inp (generated)

004550616.b3lyp_6-31g(d).smash.inp (generated)

004550616.b3lyp_6-31g(d).nwchem.inp (generated) 004550616.b3lyp_6-31g(d).log.xz 004550616.td-b3lyp_6-31g+(d).inp 004550616.td-b3lyp_6-31g+(d).log.xz

004550616.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550616.td-b3lyp_6-31+g(d).gjf (generated)

004550616.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550616.mol 004550616.PUBCHEM 004550616.mol (via Jmol)
004550623.b3lyp_6-31g(d).inp

004550623.b3lyp_6-31g(d).qchem.inp (generated)

004550623.b3lyp_6-31g(d).gjf (generated)

004550623.b3lyp_6-31g(d).firefly.inp (generated)

004550623.b3lyp_6-31g(d).smash.inp (generated)

004550623.b3lyp_6-31g(d).nwchem.inp (generated) 004550623.b3lyp_6-31g(d).log.xz 004550623.td-b3lyp_6-31g+(d).inp 004550623.td-b3lyp_6-31g+(d).log.xz

004550623.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550623.td-b3lyp_6-31+g(d).gjf (generated)

004550623.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550623.mol 004550623.PUBCHEM 004550623.mol (via Jmol)
004550625.b3lyp_6-31g(d).inp

004550625.b3lyp_6-31g(d).qchem.inp (generated)

004550625.b3lyp_6-31g(d).gjf (generated)

004550625.b3lyp_6-31g(d).firefly.inp (generated)

004550625.b3lyp_6-31g(d).smash.inp (generated)

004550625.b3lyp_6-31g(d).nwchem.inp (generated) 004550625.b3lyp_6-31g(d).log.xz 004550625.td-b3lyp_6-31g+(d).inp 004550625.td-b3lyp_6-31g+(d).log.xz

004550625.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550625.td-b3lyp_6-31+g(d).gjf (generated)

004550625.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550625.mol 004550625.PUBCHEM 004550625.mol (via Jmol)
004550698.b3lyp_6-31g(d).inp

004550698.b3lyp_6-31g(d).qchem.inp (generated)

004550698.b3lyp_6-31g(d).gjf (generated)

004550698.b3lyp_6-31g(d).firefly.inp (generated)

004550698.b3lyp_6-31g(d).smash.inp (generated)

004550698.b3lyp_6-31g(d).nwchem.inp (generated) 004550698.b3lyp_6-31g(d).log.xz 004550698.td-b3lyp_6-31g+(d).inp 004550698.td-b3lyp_6-31g+(d).log.xz

004550698.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550698.td-b3lyp_6-31+g(d).gjf (generated)

004550698.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550698.mol 004550698.PUBCHEM 004550698.mol (via Jmol)
004550710.b3lyp_6-31g(d).inp

004550710.b3lyp_6-31g(d).qchem.inp (generated)

004550710.b3lyp_6-31g(d).gjf (generated)

004550710.b3lyp_6-31g(d).firefly.inp (generated)

004550710.b3lyp_6-31g(d).smash.inp (generated)

004550710.b3lyp_6-31g(d).nwchem.inp (generated) 004550710.b3lyp_6-31g(d).log.xz 004550710.mol 004550710.PUBCHEM 004550710.mol (via Jmol)
004550725.b3lyp_6-31g(d).inp

004550725.b3lyp_6-31g(d).qchem.inp (generated)

004550725.b3lyp_6-31g(d).gjf (generated)

004550725.b3lyp_6-31g(d).firefly.inp (generated)

004550725.b3lyp_6-31g(d).smash.inp (generated)

004550725.b3lyp_6-31g(d).nwchem.inp (generated) 004550725.b3lyp_6-31g(d).log.xz 004550725.td-b3lyp_6-31g+(d).inp 004550725.td-b3lyp_6-31g+(d).log.xz

004550725.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550725.td-b3lyp_6-31+g(d).gjf (generated)

004550725.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550725.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550725.mol 004550725.PUBCHEM 004550725.mol (via Jmol)
004550729.b3lyp_6-31g(d).inp

004550729.b3lyp_6-31g(d).qchem.inp (generated)

004550729.b3lyp_6-31g(d).gjf (generated)

004550729.b3lyp_6-31g(d).firefly.inp (generated)

004550729.b3lyp_6-31g(d).smash.inp (generated)

004550729.b3lyp_6-31g(d).nwchem.inp (generated) 004550729.b3lyp_6-31g(d).log.xz 004550729.td-b3lyp_6-31g+(d).inp 004550729.td-b3lyp_6-31g+(d).log.xz

004550729.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550729.td-b3lyp_6-31+g(d).gjf (generated)

004550729.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550729.mol 004550729.PUBCHEM 004550729.mol (via Jmol)
004550747.b3lyp_6-31g(d).inp

004550747.b3lyp_6-31g(d).qchem.inp (generated)

004550747.b3lyp_6-31g(d).gjf (generated)

004550747.b3lyp_6-31g(d).firefly.inp (generated)

004550747.b3lyp_6-31g(d).smash.inp (generated)

004550747.b3lyp_6-31g(d).nwchem.inp (generated) 004550747.b3lyp_6-31g(d).log.xz 004550747.td-b3lyp_6-31g+(d).inp 004550747.td-b3lyp_6-31g+(d).log.xz

004550747.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550747.td-b3lyp_6-31+g(d).gjf (generated)

004550747.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550747.mol 004550747.PUBCHEM 004550747.mol (via Jmol)
004550775.b3lyp_6-31g(d).inp

004550775.b3lyp_6-31g(d).qchem.inp (generated)

004550775.b3lyp_6-31g(d).gjf (generated)

004550775.b3lyp_6-31g(d).firefly.inp (generated)

004550775.b3lyp_6-31g(d).smash.inp (generated)

004550775.b3lyp_6-31g(d).nwchem.inp (generated) 004550775.b3lyp_6-31g(d).log.xz 004550775.mol 004550775.PUBCHEM 004550775.mol (via Jmol)
004550827.b3lyp_6-31g(d).inp

004550827.b3lyp_6-31g(d).qchem.inp (generated)

004550827.b3lyp_6-31g(d).gjf (generated)

004550827.b3lyp_6-31g(d).firefly.inp (generated)

004550827.b3lyp_6-31g(d).smash.inp (generated)

004550827.b3lyp_6-31g(d).nwchem.inp (generated) 004550827.b3lyp_6-31g(d).log.xz 004550827.td-b3lyp_6-31g+(d).inp 004550827.td-b3lyp_6-31g+(d).log.xz

004550827.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550827.td-b3lyp_6-31+g(d).gjf (generated)

004550827.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550827.mol 004550827.PUBCHEM 004550827.mol (via Jmol)
004550832.b3lyp_6-31g(d).inp

004550832.b3lyp_6-31g(d).qchem.inp (generated)

004550832.b3lyp_6-31g(d).gjf (generated)

004550832.b3lyp_6-31g(d).firefly.inp (generated)

004550832.b3lyp_6-31g(d).smash.inp (generated)

004550832.b3lyp_6-31g(d).nwchem.inp (generated) 004550832.b3lyp_6-31g(d).log.xz 004550832.td-b3lyp_6-31g+(d).inp 004550832.td-b3lyp_6-31g+(d).log.xz

004550832.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550832.td-b3lyp_6-31+g(d).gjf (generated)

004550832.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550832.mol 004550832.PUBCHEM 004550832.mol (via Jmol)
004550839.b3lyp_6-31g(d).inp

004550839.b3lyp_6-31g(d).qchem.inp (generated)

004550839.b3lyp_6-31g(d).gjf (generated)

004550839.b3lyp_6-31g(d).firefly.inp (generated)

004550839.b3lyp_6-31g(d).smash.inp (generated)

004550839.b3lyp_6-31g(d).nwchem.inp (generated) 004550839.b3lyp_6-31g(d).log.xz 004550839.mol 004550839.PUBCHEM 004550839.mol (via Jmol)
004550906.b3lyp_6-31g(d).inp

004550906.b3lyp_6-31g(d).qchem.inp (generated)

004550906.b3lyp_6-31g(d).gjf (generated)

004550906.b3lyp_6-31g(d).firefly.inp (generated)

004550906.b3lyp_6-31g(d).smash.inp (generated)

004550906.b3lyp_6-31g(d).nwchem.inp (generated) 004550906.b3lyp_6-31g(d).log.xz 004550906.td-b3lyp_6-31g+(d).inp 004550906.td-b3lyp_6-31g+(d).log.xz

004550906.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550906.td-b3lyp_6-31+g(d).gjf (generated)

004550906.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550906.mol 004550906.PUBCHEM 004550906.mol (via Jmol)
004550955.b3lyp_6-31g(d).inp

004550955.b3lyp_6-31g(d).qchem.inp (generated)

004550955.b3lyp_6-31g(d).gjf (generated)

004550955.b3lyp_6-31g(d).firefly.inp (generated)

004550955.b3lyp_6-31g(d).smash.inp (generated)

004550955.b3lyp_6-31g(d).nwchem.inp (generated) 004550955.b3lyp_6-31g(d).log.xz 004550955.td-b3lyp_6-31g+(d).inp 004550955.td-b3lyp_6-31g+(d).log.xz

004550955.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550955.td-b3lyp_6-31+g(d).gjf (generated)

004550955.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550955.mol 004550955.PUBCHEM 004550955.mol (via Jmol)
004550956.b3lyp_6-31g(d).inp

004550956.b3lyp_6-31g(d).qchem.inp (generated)

004550956.b3lyp_6-31g(d).gjf (generated)

004550956.b3lyp_6-31g(d).firefly.inp (generated)

004550956.b3lyp_6-31g(d).smash.inp (generated)

004550956.b3lyp_6-31g(d).nwchem.inp (generated) 004550956.b3lyp_6-31g(d).log.xz 004550956.td-b3lyp_6-31g+(d).inp 004550956.td-b3lyp_6-31g+(d).log.xz

004550956.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550956.td-b3lyp_6-31+g(d).gjf (generated)

004550956.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550956.mol 004550956.PUBCHEM 004550956.mol (via Jmol)
004550972.b3lyp_6-31g(d).inp

004550972.b3lyp_6-31g(d).qchem.inp (generated)

004550972.b3lyp_6-31g(d).gjf (generated)

004550972.b3lyp_6-31g(d).firefly.inp (generated)

004550972.b3lyp_6-31g(d).smash.inp (generated)

004550972.b3lyp_6-31g(d).nwchem.inp (generated) 004550972.b3lyp_6-31g(d).log.xz 004550972.td-b3lyp_6-31g+(d).inp 004550972.td-b3lyp_6-31g+(d).log.xz

004550972.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550972.td-b3lyp_6-31+g(d).gjf (generated)

004550972.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550972.mol 004550972.PUBCHEM 004550972.mol (via Jmol)
004550989.b3lyp_6-31g(d).inp

004550989.b3lyp_6-31g(d).qchem.inp (generated)

004550989.b3lyp_6-31g(d).gjf (generated)

004550989.b3lyp_6-31g(d).firefly.inp (generated)

004550989.b3lyp_6-31g(d).smash.inp (generated)

004550989.b3lyp_6-31g(d).nwchem.inp (generated) 004550989.b3lyp_6-31g(d).log.xz 004550989.td-b3lyp_6-31g+(d).inp 004550989.td-b3lyp_6-31g+(d).log.xz

004550989.td-b3lyp_6-31+g(d).qchem.inp (generated)

004550989.td-b3lyp_6-31+g(d).gjf (generated)

004550989.td-b3lyp_6-31+g(d).firefly.inp (generated)

004550989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004550989.mol 004550989.PUBCHEM 004550989.mol (via Jmol)
004551009.b3lyp_6-31g(d).inp

004551009.b3lyp_6-31g(d).qchem.inp (generated)

004551009.b3lyp_6-31g(d).gjf (generated)

004551009.b3lyp_6-31g(d).firefly.inp (generated)

004551009.b3lyp_6-31g(d).smash.inp (generated)

004551009.b3lyp_6-31g(d).nwchem.inp (generated) 004551009.b3lyp_6-31g(d).log.xz 004551009.td-b3lyp_6-31g+(d).inp 004551009.td-b3lyp_6-31g+(d).log.xz

004551009.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551009.td-b3lyp_6-31+g(d).gjf (generated)

004551009.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551009.mol 004551009.PUBCHEM 004551009.mol (via Jmol)
004551014.b3lyp_6-31g(d).inp

004551014.b3lyp_6-31g(d).qchem.inp (generated)

004551014.b3lyp_6-31g(d).gjf (generated)

004551014.b3lyp_6-31g(d).firefly.inp (generated)

004551014.b3lyp_6-31g(d).smash.inp (generated)

004551014.b3lyp_6-31g(d).nwchem.inp (generated) 004551014.b3lyp_6-31g(d).log.xz 004551014.td-b3lyp_6-31g+(d).inp 004551014.td-b3lyp_6-31g+(d).log.xz

004551014.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551014.td-b3lyp_6-31+g(d).gjf (generated)

004551014.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551014.mol 004551014.PUBCHEM 004551014.mol (via Jmol)
004551015.b3lyp_6-31g(d).inp

004551015.b3lyp_6-31g(d).qchem.inp (generated)

004551015.b3lyp_6-31g(d).gjf (generated)

004551015.b3lyp_6-31g(d).firefly.inp (generated)

004551015.b3lyp_6-31g(d).smash.inp (generated)

004551015.b3lyp_6-31g(d).nwchem.inp (generated) 004551015.b3lyp_6-31g(d).log.xz 004551015.td-b3lyp_6-31g+(d).inp 004551015.td-b3lyp_6-31g+(d).log.xz

004551015.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551015.td-b3lyp_6-31+g(d).gjf (generated)

004551015.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551015.mol 004551015.PUBCHEM 004551015.mol (via Jmol)
004551016.b3lyp_6-31g(d).inp

004551016.b3lyp_6-31g(d).qchem.inp (generated)

004551016.b3lyp_6-31g(d).gjf (generated)

004551016.b3lyp_6-31g(d).firefly.inp (generated)

004551016.b3lyp_6-31g(d).smash.inp (generated)

004551016.b3lyp_6-31g(d).nwchem.inp (generated) 004551016.b3lyp_6-31g(d).log.xz 004551016.td-b3lyp_6-31g+(d).inp 004551016.td-b3lyp_6-31g+(d).log.xz

004551016.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551016.td-b3lyp_6-31+g(d).gjf (generated)

004551016.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551016.mol 004551016.PUBCHEM 004551016.mol (via Jmol)
004551017.b3lyp_6-31g(d).inp

004551017.b3lyp_6-31g(d).qchem.inp (generated)

004551017.b3lyp_6-31g(d).gjf (generated)

004551017.b3lyp_6-31g(d).firefly.inp (generated)

004551017.b3lyp_6-31g(d).smash.inp (generated)

004551017.b3lyp_6-31g(d).nwchem.inp (generated) 004551017.b3lyp_6-31g(d).log.xz 004551017.mol 004551017.PUBCHEM 004551017.mol (via Jmol)
004551030.b3lyp_6-31g(d).inp

004551030.b3lyp_6-31g(d).qchem.inp (generated)

004551030.b3lyp_6-31g(d).gjf (generated)

004551030.b3lyp_6-31g(d).firefly.inp (generated)

004551030.b3lyp_6-31g(d).smash.inp (generated)

004551030.b3lyp_6-31g(d).nwchem.inp (generated) 004551030.b3lyp_6-31g(d).log.xz 004551030.td-b3lyp_6-31g+(d).inp 004551030.td-b3lyp_6-31g+(d).log.xz

004551030.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551030.td-b3lyp_6-31+g(d).gjf (generated)

004551030.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551030.mol 004551030.PUBCHEM 004551030.mol (via Jmol)
004551248.b3lyp_6-31g(d).inp

004551248.b3lyp_6-31g(d).qchem.inp (generated)

004551248.b3lyp_6-31g(d).gjf (generated)

004551248.b3lyp_6-31g(d).firefly.inp (generated)

004551248.b3lyp_6-31g(d).smash.inp (generated)

004551248.b3lyp_6-31g(d).nwchem.inp (generated) 004551248.b3lyp_6-31g(d).log.xz 004551248.td-b3lyp_6-31g+(d).inp 004551248.td-b3lyp_6-31g+(d).log.xz

004551248.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551248.td-b3lyp_6-31+g(d).gjf (generated)

004551248.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551248.mol 004551248.PUBCHEM 004551248.mol (via Jmol)
004551249.b3lyp_6-31g(d).inp

004551249.b3lyp_6-31g(d).qchem.inp (generated)

004551249.b3lyp_6-31g(d).gjf (generated)

004551249.b3lyp_6-31g(d).firefly.inp (generated)

004551249.b3lyp_6-31g(d).smash.inp (generated)

004551249.b3lyp_6-31g(d).nwchem.inp (generated) 004551249.b3lyp_6-31g(d).log.xz 004551249.td-b3lyp_6-31g+(d).inp 004551249.td-b3lyp_6-31g+(d).log.xz

004551249.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551249.td-b3lyp_6-31+g(d).gjf (generated)

004551249.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551249.mol 004551249.PUBCHEM 004551249.mol (via Jmol)
004551258.b3lyp_6-31g(d).inp

004551258.b3lyp_6-31g(d).qchem.inp (generated)

004551258.b3lyp_6-31g(d).gjf (generated)

004551258.b3lyp_6-31g(d).firefly.inp (generated)

004551258.b3lyp_6-31g(d).smash.inp (generated)

004551258.b3lyp_6-31g(d).nwchem.inp (generated) 004551258.b3lyp_6-31g(d).log.xz 004551258.mol 004551258.PUBCHEM 004551258.mol (via Jmol)
004551261.b3lyp_6-31g(d).inp

004551261.b3lyp_6-31g(d).qchem.inp (generated)

004551261.b3lyp_6-31g(d).gjf (generated)

004551261.b3lyp_6-31g(d).firefly.inp (generated)

004551261.b3lyp_6-31g(d).smash.inp (generated)

004551261.b3lyp_6-31g(d).nwchem.inp (generated) 004551261.b3lyp_6-31g(d).log.xz 004551261.mol 004551261.PUBCHEM 004551261.mol (via Jmol)
004551298.b3lyp_6-31g(d).inp

004551298.b3lyp_6-31g(d).qchem.inp (generated)

004551298.b3lyp_6-31g(d).gjf (generated)

004551298.b3lyp_6-31g(d).firefly.inp (generated)

004551298.b3lyp_6-31g(d).smash.inp (generated)

004551298.b3lyp_6-31g(d).nwchem.inp (generated) 004551298.b3lyp_6-31g(d).log.xz 004551298.td-b3lyp_6-31g+(d).inp 004551298.td-b3lyp_6-31g+(d).log.xz

004551298.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551298.td-b3lyp_6-31+g(d).gjf (generated)

004551298.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551298.mol 004551298.PUBCHEM 004551298.mol (via Jmol)
004551317.b3lyp_6-31g(d).inp

004551317.b3lyp_6-31g(d).qchem.inp (generated)

004551317.b3lyp_6-31g(d).gjf (generated)

004551317.b3lyp_6-31g(d).firefly.inp (generated)

004551317.b3lyp_6-31g(d).smash.inp (generated)

004551317.b3lyp_6-31g(d).nwchem.inp (generated) 004551317.b3lyp_6-31g(d).log.xz 004551317.td-b3lyp_6-31g+(d).inp 004551317.td-b3lyp_6-31g+(d).log.xz

004551317.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551317.td-b3lyp_6-31+g(d).gjf (generated)

004551317.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551317.mol 004551317.PUBCHEM 004551317.mol (via Jmol)
004551404.b3lyp_6-31g(d).inp

004551404.b3lyp_6-31g(d).qchem.inp (generated)

004551404.b3lyp_6-31g(d).gjf (generated)

004551404.b3lyp_6-31g(d).firefly.inp (generated)

004551404.b3lyp_6-31g(d).smash.inp (generated)

004551404.b3lyp_6-31g(d).nwchem.inp (generated) 004551404.b3lyp_6-31g(d).log.xz 004551404.td-b3lyp_6-31g+(d).inp 004551404.td-b3lyp_6-31g+(d).log.xz

004551404.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551404.td-b3lyp_6-31+g(d).gjf (generated)

004551404.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551404.mol 004551404.PUBCHEM 004551404.mol (via Jmol)
004551406.b3lyp_6-31g(d).inp

004551406.b3lyp_6-31g(d).qchem.inp (generated)

004551406.b3lyp_6-31g(d).gjf (generated)

004551406.b3lyp_6-31g(d).firefly.inp (generated)

004551406.b3lyp_6-31g(d).smash.inp (generated)

004551406.b3lyp_6-31g(d).nwchem.inp (generated) 004551406.b3lyp_6-31g(d).log.xz 004551406.td-b3lyp_6-31g+(d).inp 004551406.td-b3lyp_6-31g+(d).log.xz

004551406.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551406.td-b3lyp_6-31+g(d).gjf (generated)

004551406.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551406.mol 004551406.PUBCHEM 004551406.mol (via Jmol)
004551467.b3lyp_6-31g(d).inp

004551467.b3lyp_6-31g(d).qchem.inp (generated)

004551467.b3lyp_6-31g(d).gjf (generated)

004551467.b3lyp_6-31g(d).firefly.inp (generated)

004551467.b3lyp_6-31g(d).smash.inp (generated)

004551467.b3lyp_6-31g(d).nwchem.inp (generated) 004551467.b3lyp_6-31g(d).log.xz 004551467.td-b3lyp_6-31g+(d).inp 004551467.td-b3lyp_6-31g+(d).log.xz

004551467.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551467.td-b3lyp_6-31+g(d).gjf (generated)

004551467.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551467.mol 004551467.PUBCHEM 004551467.mol (via Jmol)
004551546.b3lyp_6-31g(d).inp

004551546.b3lyp_6-31g(d).qchem.inp (generated)

004551546.b3lyp_6-31g(d).gjf (generated)

004551546.b3lyp_6-31g(d).firefly.inp (generated)

004551546.b3lyp_6-31g(d).smash.inp (generated)

004551546.b3lyp_6-31g(d).nwchem.inp (generated) 004551546.b3lyp_6-31g(d).log.xz 004551546.td-b3lyp_6-31g+(d).inp 004551546.td-b3lyp_6-31g+(d).log.xz

004551546.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551546.td-b3lyp_6-31+g(d).gjf (generated)

004551546.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551546.mol 004551546.PUBCHEM 004551546.mol (via Jmol)
004551547.b3lyp_6-31g(d).inp

004551547.b3lyp_6-31g(d).qchem.inp (generated)

004551547.b3lyp_6-31g(d).gjf (generated)

004551547.b3lyp_6-31g(d).firefly.inp (generated)

004551547.b3lyp_6-31g(d).smash.inp (generated)

004551547.b3lyp_6-31g(d).nwchem.inp (generated) 004551547.b3lyp_6-31g(d).log.xz 004551547.td-b3lyp_6-31g+(d).inp 004551547.td-b3lyp_6-31g+(d).log.xz

004551547.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551547.td-b3lyp_6-31+g(d).gjf (generated)

004551547.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551547.mol 004551547.PUBCHEM 004551547.mol (via Jmol)
004551610.b3lyp_6-31g(d).inp

004551610.b3lyp_6-31g(d).qchem.inp (generated)

004551610.b3lyp_6-31g(d).gjf (generated)

004551610.b3lyp_6-31g(d).firefly.inp (generated)

004551610.b3lyp_6-31g(d).smash.inp (generated)

004551610.b3lyp_6-31g(d).nwchem.inp (generated) 004551610.b3lyp_6-31g(d).log.xz 004551610.td-b3lyp_6-31g+(d).inp 004551610.td-b3lyp_6-31g+(d).log.xz

004551610.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551610.td-b3lyp_6-31+g(d).gjf (generated)

004551610.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551610.mol 004551610.PUBCHEM 004551610.mol (via Jmol)
004551631.b3lyp_6-31g(d).inp

004551631.b3lyp_6-31g(d).qchem.inp (generated)

004551631.b3lyp_6-31g(d).gjf (generated)

004551631.b3lyp_6-31g(d).firefly.inp (generated)

004551631.b3lyp_6-31g(d).smash.inp (generated)

004551631.b3lyp_6-31g(d).nwchem.inp (generated) 004551631.b3lyp_6-31g(d).log.xz 004551631.td-b3lyp_6-31g+(d).inp 004551631.td-b3lyp_6-31g+(d).log.xz

004551631.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551631.td-b3lyp_6-31+g(d).gjf (generated)

004551631.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551631.mol 004551631.PUBCHEM 004551631.mol (via Jmol)
004551795.b3lyp_6-31g(d).inp

004551795.b3lyp_6-31g(d).qchem.inp (generated)

004551795.b3lyp_6-31g(d).gjf (generated)

004551795.b3lyp_6-31g(d).firefly.inp (generated)

004551795.b3lyp_6-31g(d).smash.inp (generated)

004551795.b3lyp_6-31g(d).nwchem.inp (generated) 004551795.b3lyp_6-31g(d).log.xz 004551795.td-b3lyp_6-31g+(d).inp 004551795.td-b3lyp_6-31g+(d).log.xz

004551795.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551795.td-b3lyp_6-31+g(d).gjf (generated)

004551795.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551795.mol 004551795.PUBCHEM 004551795.mol (via Jmol)
004551885.b3lyp_6-31g(d).inp

004551885.b3lyp_6-31g(d).qchem.inp (generated)

004551885.b3lyp_6-31g(d).gjf (generated)

004551885.b3lyp_6-31g(d).firefly.inp (generated)

004551885.b3lyp_6-31g(d).smash.inp (generated)

004551885.b3lyp_6-31g(d).nwchem.inp (generated) 004551885.b3lyp_6-31g(d).log.xz 004551885.td-b3lyp_6-31g+(d).inp 004551885.td-b3lyp_6-31g+(d).log.xz

004551885.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551885.td-b3lyp_6-31+g(d).gjf (generated)

004551885.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551885.mol 004551885.PUBCHEM 004551885.mol (via Jmol)
004551926.b3lyp_6-31g(d).inp

004551926.b3lyp_6-31g(d).qchem.inp (generated)

004551926.b3lyp_6-31g(d).gjf (generated)

004551926.b3lyp_6-31g(d).firefly.inp (generated)

004551926.b3lyp_6-31g(d).smash.inp (generated)

004551926.b3lyp_6-31g(d).nwchem.inp (generated) 004551926.b3lyp_6-31g(d).log.xz 004551926.td-b3lyp_6-31g+(d).inp 004551926.td-b3lyp_6-31g+(d).log.xz

004551926.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551926.td-b3lyp_6-31+g(d).gjf (generated)

004551926.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551926.mol 004551926.PUBCHEM 004551926.mol (via Jmol)
004551939.b3lyp_6-31g(d).inp

004551939.b3lyp_6-31g(d).qchem.inp (generated)

004551939.b3lyp_6-31g(d).gjf (generated)

004551939.b3lyp_6-31g(d).firefly.inp (generated)

004551939.b3lyp_6-31g(d).smash.inp (generated)

004551939.b3lyp_6-31g(d).nwchem.inp (generated) 004551939.b3lyp_6-31g(d).log.xz 004551939.mol 004551939.PUBCHEM 004551939.mol (via Jmol)
004551942.b3lyp_6-31g(d).inp

004551942.b3lyp_6-31g(d).qchem.inp (generated)

004551942.b3lyp_6-31g(d).gjf (generated)

004551942.b3lyp_6-31g(d).firefly.inp (generated)

004551942.b3lyp_6-31g(d).smash.inp (generated)

004551942.b3lyp_6-31g(d).nwchem.inp (generated) 004551942.b3lyp_6-31g(d).log.xz 004551942.td-b3lyp_6-31g+(d).inp 004551942.td-b3lyp_6-31g+(d).log.xz

004551942.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551942.td-b3lyp_6-31+g(d).gjf (generated)

004551942.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551942.mol 004551942.PUBCHEM 004551942.mol (via Jmol)
004551943.b3lyp_6-31g(d).inp

004551943.b3lyp_6-31g(d).qchem.inp (generated)

004551943.b3lyp_6-31g(d).gjf (generated)

004551943.b3lyp_6-31g(d).firefly.inp (generated)

004551943.b3lyp_6-31g(d).smash.inp (generated)

004551943.b3lyp_6-31g(d).nwchem.inp (generated) 004551943.b3lyp_6-31g(d).log.xz 004551943.td-b3lyp_6-31g+(d).inp 004551943.td-b3lyp_6-31g+(d).log.xz

004551943.td-b3lyp_6-31+g(d).qchem.inp (generated)

004551943.td-b3lyp_6-31+g(d).gjf (generated)

004551943.td-b3lyp_6-31+g(d).firefly.inp (generated)

004551943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004551943.mol 004551943.PUBCHEM 004551943.mol (via Jmol)
004552098.b3lyp_6-31g(d).inp

004552098.b3lyp_6-31g(d).qchem.inp (generated)

004552098.b3lyp_6-31g(d).gjf (generated)

004552098.b3lyp_6-31g(d).firefly.inp (generated)

004552098.b3lyp_6-31g(d).smash.inp (generated)

004552098.b3lyp_6-31g(d).nwchem.inp (generated) 004552098.b3lyp_6-31g(d).log.xz 004552098.td-b3lyp_6-31g+(d).inp 004552098.td-b3lyp_6-31g+(d).log.xz

004552098.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552098.td-b3lyp_6-31+g(d).gjf (generated)

004552098.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552098.mol 004552098.PUBCHEM 004552098.mol (via Jmol)
004552100.b3lyp_6-31g(d).inp

004552100.b3lyp_6-31g(d).qchem.inp (generated)

004552100.b3lyp_6-31g(d).gjf (generated)

004552100.b3lyp_6-31g(d).firefly.inp (generated)

004552100.b3lyp_6-31g(d).smash.inp (generated)

004552100.b3lyp_6-31g(d).nwchem.inp (generated) 004552100.b3lyp_6-31g(d).log.xz 004552100.td-b3lyp_6-31g+(d).inp 004552100.td-b3lyp_6-31g+(d).log.xz

004552100.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552100.td-b3lyp_6-31+g(d).gjf (generated)

004552100.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552100.mol 004552100.PUBCHEM 004552100.mol (via Jmol)
004552138.b3lyp_6-31g(d).inp

004552138.b3lyp_6-31g(d).qchem.inp (generated)

004552138.b3lyp_6-31g(d).gjf (generated)

004552138.b3lyp_6-31g(d).firefly.inp (generated)

004552138.b3lyp_6-31g(d).smash.inp (generated)

004552138.b3lyp_6-31g(d).nwchem.inp (generated) 004552138.b3lyp_6-31g(d).log.xz 004552138.mol 004552138.PUBCHEM 004552138.mol (via Jmol)
004552158.b3lyp_6-31g(d).inp

004552158.b3lyp_6-31g(d).qchem.inp (generated)

004552158.b3lyp_6-31g(d).gjf (generated)

004552158.b3lyp_6-31g(d).firefly.inp (generated)

004552158.b3lyp_6-31g(d).smash.inp (generated)

004552158.b3lyp_6-31g(d).nwchem.inp (generated) 004552158.b3lyp_6-31g(d).log.xz 004552158.td-b3lyp_6-31g+(d).inp 004552158.td-b3lyp_6-31g+(d).log.xz

004552158.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552158.td-b3lyp_6-31+g(d).gjf (generated)

004552158.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552158.mol 004552158.PUBCHEM 004552158.mol (via Jmol)
004552189.b3lyp_6-31g(d).inp

004552189.b3lyp_6-31g(d).qchem.inp (generated)

004552189.b3lyp_6-31g(d).gjf (generated)

004552189.b3lyp_6-31g(d).firefly.inp (generated)

004552189.b3lyp_6-31g(d).smash.inp (generated)

004552189.b3lyp_6-31g(d).nwchem.inp (generated) 004552189.b3lyp_6-31g(d).log.xz 004552189.mol 004552189.PUBCHEM 004552189.mol (via Jmol)
004552223.b3lyp_6-31g(d).inp

004552223.b3lyp_6-31g(d).qchem.inp (generated)

004552223.b3lyp_6-31g(d).gjf (generated)

004552223.b3lyp_6-31g(d).firefly.inp (generated)

004552223.b3lyp_6-31g(d).smash.inp (generated)

004552223.b3lyp_6-31g(d).nwchem.inp (generated) 004552223.b3lyp_6-31g(d).log.xz 004552223.td-b3lyp_6-31g+(d).inp 004552223.td-b3lyp_6-31g+(d).log.xz

004552223.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552223.td-b3lyp_6-31+g(d).gjf (generated)

004552223.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552223.mol 004552223.PUBCHEM 004552223.mol (via Jmol)
004552318.b3lyp_6-31g(d).inp

004552318.b3lyp_6-31g(d).qchem.inp (generated)

004552318.b3lyp_6-31g(d).gjf (generated)

004552318.b3lyp_6-31g(d).firefly.inp (generated)

004552318.b3lyp_6-31g(d).smash.inp (generated)

004552318.b3lyp_6-31g(d).nwchem.inp (generated) 004552318.b3lyp_6-31g(d).log.xz 004552318.mol 004552318.PUBCHEM 004552318.mol (via Jmol)
004552352.b3lyp_6-31g(d).inp

004552352.b3lyp_6-31g(d).qchem.inp (generated)

004552352.b3lyp_6-31g(d).gjf (generated)

004552352.b3lyp_6-31g(d).firefly.inp (generated)

004552352.b3lyp_6-31g(d).smash.inp (generated)

004552352.b3lyp_6-31g(d).nwchem.inp (generated) 004552352.b3lyp_6-31g(d).log.xz 004552352.td-b3lyp_6-31g+(d).inp 004552352.td-b3lyp_6-31g+(d).log.xz

004552352.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552352.td-b3lyp_6-31+g(d).gjf (generated)

004552352.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552352.mol 004552352.PUBCHEM 004552352.mol (via Jmol)
004552463.b3lyp_6-31g(d).inp

004552463.b3lyp_6-31g(d).qchem.inp (generated)

004552463.b3lyp_6-31g(d).gjf (generated)

004552463.b3lyp_6-31g(d).firefly.inp (generated)

004552463.b3lyp_6-31g(d).smash.inp (generated)

004552463.b3lyp_6-31g(d).nwchem.inp (generated) 004552463.b3lyp_6-31g(d).log.xz 004552463.td-b3lyp_6-31g+(d).inp 004552463.td-b3lyp_6-31g+(d).log.xz

004552463.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552463.td-b3lyp_6-31+g(d).gjf (generated)

004552463.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552463.mol 004552463.PUBCHEM 004552463.mol (via Jmol)
004552465.b3lyp_6-31g(d).inp

004552465.b3lyp_6-31g(d).qchem.inp (generated)

004552465.b3lyp_6-31g(d).gjf (generated)

004552465.b3lyp_6-31g(d).firefly.inp (generated)

004552465.b3lyp_6-31g(d).smash.inp (generated)

004552465.b3lyp_6-31g(d).nwchem.inp (generated) 004552465.b3lyp_6-31g(d).log.xz 004552465.td-b3lyp_6-31g+(d).inp 004552465.td-b3lyp_6-31g+(d).log.xz

004552465.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552465.td-b3lyp_6-31+g(d).gjf (generated)

004552465.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552465.mol 004552465.PUBCHEM 004552465.mol (via Jmol)
004552537.b3lyp_6-31g(d).inp

004552537.b3lyp_6-31g(d).qchem.inp (generated)

004552537.b3lyp_6-31g(d).gjf (generated)

004552537.b3lyp_6-31g(d).firefly.inp (generated)

004552537.b3lyp_6-31g(d).smash.inp (generated)

004552537.b3lyp_6-31g(d).nwchem.inp (generated) 004552537.b3lyp_6-31g(d).log.xz 004552537.td-b3lyp_6-31g+(d).inp 004552537.td-b3lyp_6-31g+(d).log.xz

004552537.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552537.td-b3lyp_6-31+g(d).gjf (generated)

004552537.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552537.mol 004552537.PUBCHEM 004552537.mol (via Jmol)
004552592.b3lyp_6-31g(d).inp

004552592.b3lyp_6-31g(d).qchem.inp (generated)

004552592.b3lyp_6-31g(d).gjf (generated)

004552592.b3lyp_6-31g(d).firefly.inp (generated)

004552592.b3lyp_6-31g(d).smash.inp (generated)

004552592.b3lyp_6-31g(d).nwchem.inp (generated) 004552592.b3lyp_6-31g(d).log.xz 004552592.mol 004552592.PUBCHEM 004552592.mol (via Jmol)
004552656.b3lyp_6-31g(d).inp

004552656.b3lyp_6-31g(d).qchem.inp (generated)

004552656.b3lyp_6-31g(d).gjf (generated)

004552656.b3lyp_6-31g(d).firefly.inp (generated)

004552656.b3lyp_6-31g(d).smash.inp (generated)

004552656.b3lyp_6-31g(d).nwchem.inp (generated) 004552656.b3lyp_6-31g(d).log.xz 004552656.td-b3lyp_6-31g+(d).inp 004552656.td-b3lyp_6-31g+(d).log.xz

004552656.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552656.td-b3lyp_6-31+g(d).gjf (generated)

004552656.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552656.mol 004552656.PUBCHEM 004552656.mol (via Jmol)
004552702.b3lyp_6-31g(d).inp

004552702.b3lyp_6-31g(d).qchem.inp (generated)

004552702.b3lyp_6-31g(d).gjf (generated)

004552702.b3lyp_6-31g(d).firefly.inp (generated)

004552702.b3lyp_6-31g(d).smash.inp (generated)

004552702.b3lyp_6-31g(d).nwchem.inp (generated) 004552702.b3lyp_6-31g(d).log.xz 004552702.td-b3lyp_6-31g+(d).inp 004552702.td-b3lyp_6-31g+(d).log.xz

004552702.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552702.td-b3lyp_6-31+g(d).gjf (generated)

004552702.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552702.mol 004552702.PUBCHEM 004552702.mol (via Jmol)
004552728.b3lyp_6-31g(d).inp

004552728.b3lyp_6-31g(d).qchem.inp (generated)

004552728.b3lyp_6-31g(d).gjf (generated)

004552728.b3lyp_6-31g(d).firefly.inp (generated)

004552728.b3lyp_6-31g(d).smash.inp (generated)

004552728.b3lyp_6-31g(d).nwchem.inp (generated) 004552728.b3lyp_6-31g(d).log.xz 004552728.td-b3lyp_6-31g+(d).inp 004552728.td-b3lyp_6-31g+(d).log.xz

004552728.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552728.td-b3lyp_6-31+g(d).gjf (generated)

004552728.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552728.mol 004552728.PUBCHEM 004552728.mol (via Jmol)
004552736.b3lyp_6-31g(d).inp

004552736.b3lyp_6-31g(d).qchem.inp (generated)

004552736.b3lyp_6-31g(d).gjf (generated)

004552736.b3lyp_6-31g(d).firefly.inp (generated)

004552736.b3lyp_6-31g(d).smash.inp (generated)

004552736.b3lyp_6-31g(d).nwchem.inp (generated) 004552736.b3lyp_6-31g(d).log.xz 004552736.td-b3lyp_6-31g+(d).inp 004552736.td-b3lyp_6-31g+(d).log.xz

004552736.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552736.td-b3lyp_6-31+g(d).gjf (generated)

004552736.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552736.mol 004552736.PUBCHEM 004552736.mol (via Jmol)
004552770.b3lyp_6-31g(d).inp

004552770.b3lyp_6-31g(d).qchem.inp (generated)

004552770.b3lyp_6-31g(d).gjf (generated)

004552770.b3lyp_6-31g(d).firefly.inp (generated)

004552770.b3lyp_6-31g(d).smash.inp (generated)

004552770.b3lyp_6-31g(d).nwchem.inp (generated) 004552770.b3lyp_6-31g(d).log.xz 004552770.td-b3lyp_6-31g+(d).inp 004552770.td-b3lyp_6-31g+(d).log.xz

004552770.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552770.td-b3lyp_6-31+g(d).gjf (generated)

004552770.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552770.mol 004552770.PUBCHEM 004552770.mol (via Jmol)
004552774.b3lyp_6-31g(d).inp

004552774.b3lyp_6-31g(d).qchem.inp (generated)

004552774.b3lyp_6-31g(d).gjf (generated)

004552774.b3lyp_6-31g(d).firefly.inp (generated)

004552774.b3lyp_6-31g(d).smash.inp (generated)

004552774.b3lyp_6-31g(d).nwchem.inp (generated) 004552774.b3lyp_6-31g(d).log.xz 004552774.td-b3lyp_6-31g+(d).inp 004552774.td-b3lyp_6-31g+(d).log.xz

004552774.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552774.td-b3lyp_6-31+g(d).gjf (generated)

004552774.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552774.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552774.mol 004552774.PUBCHEM 004552774.mol (via Jmol)
004552778.b3lyp_6-31g(d).inp

004552778.b3lyp_6-31g(d).qchem.inp (generated)

004552778.b3lyp_6-31g(d).gjf (generated)

004552778.b3lyp_6-31g(d).firefly.inp (generated)

004552778.b3lyp_6-31g(d).smash.inp (generated)

004552778.b3lyp_6-31g(d).nwchem.inp (generated) 004552778.b3lyp_6-31g(d).log.xz 004552778.mol 004552778.PUBCHEM 004552778.mol (via Jmol)
004552784.b3lyp_6-31g(d).inp

004552784.b3lyp_6-31g(d).qchem.inp (generated)

004552784.b3lyp_6-31g(d).gjf (generated)

004552784.b3lyp_6-31g(d).firefly.inp (generated)

004552784.b3lyp_6-31g(d).smash.inp (generated)

004552784.b3lyp_6-31g(d).nwchem.inp (generated) 004552784.b3lyp_6-31g(d).log.xz 004552784.mol 004552784.PUBCHEM 004552784.mol (via Jmol)
004552797.b3lyp_6-31g(d).inp

004552797.b3lyp_6-31g(d).qchem.inp (generated)

004552797.b3lyp_6-31g(d).gjf (generated)

004552797.b3lyp_6-31g(d).firefly.inp (generated)

004552797.b3lyp_6-31g(d).smash.inp (generated)

004552797.b3lyp_6-31g(d).nwchem.inp (generated) 004552797.b3lyp_6-31g(d).log.xz 004552797.td-b3lyp_6-31g+(d).inp 004552797.td-b3lyp_6-31g+(d).log.xz

004552797.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552797.td-b3lyp_6-31+g(d).gjf (generated)

004552797.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552797.mol 004552797.PUBCHEM 004552797.mol (via Jmol)
004552810.b3lyp_6-31g(d).inp

004552810.b3lyp_6-31g(d).qchem.inp (generated)

004552810.b3lyp_6-31g(d).gjf (generated)

004552810.b3lyp_6-31g(d).firefly.inp (generated)

004552810.b3lyp_6-31g(d).smash.inp (generated)

004552810.b3lyp_6-31g(d).nwchem.inp (generated) 004552810.b3lyp_6-31g(d).log.xz 004552810.mol 004552810.PUBCHEM 004552810.mol (via Jmol)
004552818.b3lyp_6-31g(d).inp

004552818.b3lyp_6-31g(d).qchem.inp (generated)

004552818.b3lyp_6-31g(d).gjf (generated)

004552818.b3lyp_6-31g(d).firefly.inp (generated)

004552818.b3lyp_6-31g(d).smash.inp (generated)

004552818.b3lyp_6-31g(d).nwchem.inp (generated) 004552818.b3lyp_6-31g(d).log.xz 004552818.td-b3lyp_6-31g+(d).inp 004552818.td-b3lyp_6-31g+(d).log.xz

004552818.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552818.td-b3lyp_6-31+g(d).gjf (generated)

004552818.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552818.mol 004552818.PUBCHEM 004552818.mol (via Jmol)
004552865.b3lyp_6-31g(d).inp

004552865.b3lyp_6-31g(d).qchem.inp (generated)

004552865.b3lyp_6-31g(d).gjf (generated)

004552865.b3lyp_6-31g(d).firefly.inp (generated)

004552865.b3lyp_6-31g(d).smash.inp (generated)

004552865.b3lyp_6-31g(d).nwchem.inp (generated) 004552865.b3lyp_6-31g(d).log.xz 004552865.td-b3lyp_6-31g+(d).inp 004552865.td-b3lyp_6-31g+(d).log.xz

004552865.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552865.td-b3lyp_6-31+g(d).gjf (generated)

004552865.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552865.mol 004552865.PUBCHEM 004552865.mol (via Jmol)
004552867.b3lyp_6-31g(d).inp

004552867.b3lyp_6-31g(d).qchem.inp (generated)

004552867.b3lyp_6-31g(d).gjf (generated)

004552867.b3lyp_6-31g(d).firefly.inp (generated)

004552867.b3lyp_6-31g(d).smash.inp (generated)

004552867.b3lyp_6-31g(d).nwchem.inp (generated) 004552867.b3lyp_6-31g(d).log.xz 004552867.td-b3lyp_6-31g+(d).inp 004552867.td-b3lyp_6-31g+(d).log.xz

004552867.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552867.td-b3lyp_6-31+g(d).gjf (generated)

004552867.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552867.mol 004552867.PUBCHEM 004552867.mol (via Jmol)
004552917.b3lyp_6-31g(d).inp

004552917.b3lyp_6-31g(d).qchem.inp (generated)

004552917.b3lyp_6-31g(d).gjf (generated)

004552917.b3lyp_6-31g(d).firefly.inp (generated)

004552917.b3lyp_6-31g(d).smash.inp (generated)

004552917.b3lyp_6-31g(d).nwchem.inp (generated) 004552917.b3lyp_6-31g(d).log.xz 004552917.td-b3lyp_6-31g+(d).inp 004552917.td-b3lyp_6-31g+(d).log.xz

004552917.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552917.td-b3lyp_6-31+g(d).gjf (generated)

004552917.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552917.mol 004552917.PUBCHEM 004552917.mol (via Jmol)
004552949.b3lyp_6-31g(d).inp

004552949.b3lyp_6-31g(d).qchem.inp (generated)

004552949.b3lyp_6-31g(d).gjf (generated)

004552949.b3lyp_6-31g(d).firefly.inp (generated)

004552949.b3lyp_6-31g(d).smash.inp (generated)

004552949.b3lyp_6-31g(d).nwchem.inp (generated) 004552949.b3lyp_6-31g(d).log.xz 004552949.td-b3lyp_6-31g+(d).inp 004552949.td-b3lyp_6-31g+(d).log.xz

004552949.td-b3lyp_6-31+g(d).qchem.inp (generated)

004552949.td-b3lyp_6-31+g(d).gjf (generated)

004552949.td-b3lyp_6-31+g(d).firefly.inp (generated)

004552949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004552949.mol 004552949.PUBCHEM 004552949.mol (via Jmol)
004553009.b3lyp_6-31g(d).inp

004553009.b3lyp_6-31g(d).qchem.inp (generated)

004553009.b3lyp_6-31g(d).gjf (generated)

004553009.b3lyp_6-31g(d).firefly.inp (generated)

004553009.b3lyp_6-31g(d).smash.inp (generated)

004553009.b3lyp_6-31g(d).nwchem.inp (generated) 004553009.b3lyp_6-31g(d).log.xz 004553009.mol 004553009.PUBCHEM 004553009.mol (via Jmol)
004553041.b3lyp_6-31g(d).inp

004553041.b3lyp_6-31g(d).qchem.inp (generated)

004553041.b3lyp_6-31g(d).gjf (generated)

004553041.b3lyp_6-31g(d).firefly.inp (generated)

004553041.b3lyp_6-31g(d).smash.inp (generated)

004553041.b3lyp_6-31g(d).nwchem.inp (generated) 004553041.b3lyp_6-31g(d).log.xz 004553041.mol 004553041.PUBCHEM 004553041.mol (via Jmol)
004553154.b3lyp_6-31g(d).inp

004553154.b3lyp_6-31g(d).qchem.inp (generated)

004553154.b3lyp_6-31g(d).gjf (generated)

004553154.b3lyp_6-31g(d).firefly.inp (generated)

004553154.b3lyp_6-31g(d).smash.inp (generated)

004553154.b3lyp_6-31g(d).nwchem.inp (generated) 004553154.b3lyp_6-31g(d).log.xz 004553154.td-b3lyp_6-31g+(d).inp 004553154.td-b3lyp_6-31g+(d).log.xz

004553154.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553154.td-b3lyp_6-31+g(d).gjf (generated)

004553154.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553154.mol 004553154.PUBCHEM 004553154.mol (via Jmol)
004553156.b3lyp_6-31g(d).inp

004553156.b3lyp_6-31g(d).qchem.inp (generated)

004553156.b3lyp_6-31g(d).gjf (generated)

004553156.b3lyp_6-31g(d).firefly.inp (generated)

004553156.b3lyp_6-31g(d).smash.inp (generated)

004553156.b3lyp_6-31g(d).nwchem.inp (generated) 004553156.b3lyp_6-31g(d).log.xz 004553156.mol 004553156.PUBCHEM 004553156.mol (via Jmol)
004553182.b3lyp_6-31g(d).inp

004553182.b3lyp_6-31g(d).qchem.inp (generated)

004553182.b3lyp_6-31g(d).gjf (generated)

004553182.b3lyp_6-31g(d).firefly.inp (generated)

004553182.b3lyp_6-31g(d).smash.inp (generated)

004553182.b3lyp_6-31g(d).nwchem.inp (generated) 004553182.b3lyp_6-31g(d).log.xz 004553182.td-b3lyp_6-31g+(d).inp 004553182.td-b3lyp_6-31g+(d).log.xz

004553182.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553182.td-b3lyp_6-31+g(d).gjf (generated)

004553182.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553182.mol 004553182.PUBCHEM 004553182.mol (via Jmol)
004553263.b3lyp_6-31g(d).inp

004553263.b3lyp_6-31g(d).qchem.inp (generated)

004553263.b3lyp_6-31g(d).gjf (generated)

004553263.b3lyp_6-31g(d).firefly.inp (generated)

004553263.b3lyp_6-31g(d).smash.inp (generated)

004553263.b3lyp_6-31g(d).nwchem.inp (generated) 004553263.b3lyp_6-31g(d).log.xz 004553263.td-b3lyp_6-31g+(d).inp 004553263.td-b3lyp_6-31g+(d).log.xz

004553263.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553263.td-b3lyp_6-31+g(d).gjf (generated)

004553263.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553263.mol 004553263.PUBCHEM 004553263.mol (via Jmol)
004553276.b3lyp_6-31g(d).inp

004553276.b3lyp_6-31g(d).qchem.inp (generated)

004553276.b3lyp_6-31g(d).gjf (generated)

004553276.b3lyp_6-31g(d).firefly.inp (generated)

004553276.b3lyp_6-31g(d).smash.inp (generated)

004553276.b3lyp_6-31g(d).nwchem.inp (generated) 004553276.b3lyp_6-31g(d).log.xz 004553276.td-b3lyp_6-31g+(d).inp 004553276.td-b3lyp_6-31g+(d).log.xz

004553276.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553276.td-b3lyp_6-31+g(d).gjf (generated)

004553276.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553276.mol 004553276.PUBCHEM 004553276.mol (via Jmol)
004553367.b3lyp_6-31g(d).inp

004553367.b3lyp_6-31g(d).qchem.inp (generated)

004553367.b3lyp_6-31g(d).gjf (generated)

004553367.b3lyp_6-31g(d).firefly.inp (generated)

004553367.b3lyp_6-31g(d).smash.inp (generated)

004553367.b3lyp_6-31g(d).nwchem.inp (generated) 004553367.b3lyp_6-31g(d).log.xz 004553367.mol 004553367.PUBCHEM 004553367.mol (via Jmol)
004553394.b3lyp_6-31g(d).inp

004553394.b3lyp_6-31g(d).qchem.inp (generated)

004553394.b3lyp_6-31g(d).gjf (generated)

004553394.b3lyp_6-31g(d).firefly.inp (generated)

004553394.b3lyp_6-31g(d).smash.inp (generated)

004553394.b3lyp_6-31g(d).nwchem.inp (generated) 004553394.b3lyp_6-31g(d).log.xz 004553394.td-b3lyp_6-31g+(d).inp 004553394.td-b3lyp_6-31g+(d).log.xz

004553394.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553394.td-b3lyp_6-31+g(d).gjf (generated)

004553394.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553394.mol 004553394.PUBCHEM 004553394.mol (via Jmol)
004553576.b3lyp_6-31g(d).inp

004553576.b3lyp_6-31g(d).qchem.inp (generated)

004553576.b3lyp_6-31g(d).gjf (generated)

004553576.b3lyp_6-31g(d).firefly.inp (generated)

004553576.b3lyp_6-31g(d).smash.inp (generated)

004553576.b3lyp_6-31g(d).nwchem.inp (generated) 004553576.b3lyp_6-31g(d).log.xz 004553576.td-b3lyp_6-31g+(d).inp 004553576.td-b3lyp_6-31g+(d).log.xz

004553576.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553576.td-b3lyp_6-31+g(d).gjf (generated)

004553576.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553576.mol 004553576.PUBCHEM 004553576.mol (via Jmol)
004553583.b3lyp_6-31g(d).inp

004553583.b3lyp_6-31g(d).qchem.inp (generated)

004553583.b3lyp_6-31g(d).gjf (generated)

004553583.b3lyp_6-31g(d).firefly.inp (generated)

004553583.b3lyp_6-31g(d).smash.inp (generated)

004553583.b3lyp_6-31g(d).nwchem.inp (generated) 004553583.b3lyp_6-31g(d).log.xz 004553583.td-b3lyp_6-31g+(d).inp 004553583.td-b3lyp_6-31g+(d).log.xz

004553583.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553583.td-b3lyp_6-31+g(d).gjf (generated)

004553583.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553583.mol 004553583.PUBCHEM 004553583.mol (via Jmol)
004553675.b3lyp_6-31g(d).inp

004553675.b3lyp_6-31g(d).qchem.inp (generated)

004553675.b3lyp_6-31g(d).gjf (generated)

004553675.b3lyp_6-31g(d).firefly.inp (generated)

004553675.b3lyp_6-31g(d).smash.inp (generated)

004553675.b3lyp_6-31g(d).nwchem.inp (generated) 004553675.b3lyp_6-31g(d).log.xz 004553675.mol 004553675.PUBCHEM 004553675.mol (via Jmol)
004553742.b3lyp_6-31g(d).inp

004553742.b3lyp_6-31g(d).qchem.inp (generated)

004553742.b3lyp_6-31g(d).gjf (generated)

004553742.b3lyp_6-31g(d).firefly.inp (generated)

004553742.b3lyp_6-31g(d).smash.inp (generated)

004553742.b3lyp_6-31g(d).nwchem.inp (generated) 004553742.b3lyp_6-31g(d).log.xz 004553742.td-b3lyp_6-31g+(d).inp 004553742.td-b3lyp_6-31g+(d).log.xz

004553742.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553742.td-b3lyp_6-31+g(d).gjf (generated)

004553742.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553742.mol 004553742.PUBCHEM 004553742.mol (via Jmol)
004553744.b3lyp_6-31g(d).inp

004553744.b3lyp_6-31g(d).qchem.inp (generated)

004553744.b3lyp_6-31g(d).gjf (generated)

004553744.b3lyp_6-31g(d).firefly.inp (generated)

004553744.b3lyp_6-31g(d).smash.inp (generated)

004553744.b3lyp_6-31g(d).nwchem.inp (generated) 004553744.b3lyp_6-31g(d).log.xz 004553744.mol 004553744.PUBCHEM 004553744.mol (via Jmol)
004553853.b3lyp_6-31g(d).inp

004553853.b3lyp_6-31g(d).qchem.inp (generated)

004553853.b3lyp_6-31g(d).gjf (generated)

004553853.b3lyp_6-31g(d).firefly.inp (generated)

004553853.b3lyp_6-31g(d).smash.inp (generated)

004553853.b3lyp_6-31g(d).nwchem.inp (generated) 004553853.b3lyp_6-31g(d).log.xz 004553853.td-b3lyp_6-31g+(d).inp 004553853.td-b3lyp_6-31g+(d).log.xz

004553853.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553853.td-b3lyp_6-31+g(d).gjf (generated)

004553853.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553853.mol 004553853.PUBCHEM 004553853.mol (via Jmol)
004553854.b3lyp_6-31g(d).inp

004553854.b3lyp_6-31g(d).qchem.inp (generated)

004553854.b3lyp_6-31g(d).gjf (generated)

004553854.b3lyp_6-31g(d).firefly.inp (generated)

004553854.b3lyp_6-31g(d).smash.inp (generated)

004553854.b3lyp_6-31g(d).nwchem.inp (generated) 004553854.b3lyp_6-31g(d).log.xz 004553854.td-b3lyp_6-31g+(d).inp 004553854.td-b3lyp_6-31g+(d).log.xz

004553854.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553854.td-b3lyp_6-31+g(d).gjf (generated)

004553854.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553854.mol 004553854.PUBCHEM 004553854.mol (via Jmol)
004553955.b3lyp_6-31g(d).inp

004553955.b3lyp_6-31g(d).qchem.inp (generated)

004553955.b3lyp_6-31g(d).gjf (generated)

004553955.b3lyp_6-31g(d).firefly.inp (generated)

004553955.b3lyp_6-31g(d).smash.inp (generated)

004553955.b3lyp_6-31g(d).nwchem.inp (generated) 004553955.b3lyp_6-31g(d).log.xz 004553955.td-b3lyp_6-31g+(d).inp 004553955.td-b3lyp_6-31g+(d).log.xz

004553955.td-b3lyp_6-31+g(d).qchem.inp (generated)

004553955.td-b3lyp_6-31+g(d).gjf (generated)

004553955.td-b3lyp_6-31+g(d).firefly.inp (generated)

004553955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004553955.mol 004553955.PUBCHEM 004553955.mol (via Jmol)
004554038.b3lyp_6-31g(d).inp

004554038.b3lyp_6-31g(d).qchem.inp (generated)

004554038.b3lyp_6-31g(d).gjf (generated)

004554038.b3lyp_6-31g(d).firefly.inp (generated)

004554038.b3lyp_6-31g(d).smash.inp (generated)

004554038.b3lyp_6-31g(d).nwchem.inp (generated) 004554038.b3lyp_6-31g(d).log.xz 004554038.td-b3lyp_6-31g+(d).inp 004554038.td-b3lyp_6-31g+(d).log.xz

004554038.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554038.td-b3lyp_6-31+g(d).gjf (generated)

004554038.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554038.mol 004554038.PUBCHEM 004554038.mol (via Jmol)
004554168.b3lyp_6-31g(d).inp

004554168.b3lyp_6-31g(d).qchem.inp (generated)

004554168.b3lyp_6-31g(d).gjf (generated)

004554168.b3lyp_6-31g(d).firefly.inp (generated)

004554168.b3lyp_6-31g(d).smash.inp (generated)

004554168.b3lyp_6-31g(d).nwchem.inp (generated) 004554168.b3lyp_6-31g(d).log.xz 004554168.mol 004554168.PUBCHEM 004554168.mol (via Jmol)
004554256.b3lyp_6-31g(d).inp

004554256.b3lyp_6-31g(d).qchem.inp (generated)

004554256.b3lyp_6-31g(d).gjf (generated)

004554256.b3lyp_6-31g(d).firefly.inp (generated)

004554256.b3lyp_6-31g(d).smash.inp (generated)

004554256.b3lyp_6-31g(d).nwchem.inp (generated) 004554256.b3lyp_6-31g(d).log.xz 004554256.td-b3lyp_6-31g+(d).inp 004554256.td-b3lyp_6-31g+(d).log.xz

004554256.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554256.td-b3lyp_6-31+g(d).gjf (generated)

004554256.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554256.mol 004554256.PUBCHEM 004554256.mol (via Jmol)
004554299.b3lyp_6-31g(d).inp

004554299.b3lyp_6-31g(d).qchem.inp (generated)

004554299.b3lyp_6-31g(d).gjf (generated)

004554299.b3lyp_6-31g(d).firefly.inp (generated)

004554299.b3lyp_6-31g(d).smash.inp (generated)

004554299.b3lyp_6-31g(d).nwchem.inp (generated) 004554299.b3lyp_6-31g(d).log.xz 004554299.td-b3lyp_6-31g+(d).inp 004554299.td-b3lyp_6-31g+(d).log.xz

004554299.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554299.td-b3lyp_6-31+g(d).gjf (generated)

004554299.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554299.mol 004554299.PUBCHEM 004554299.mol (via Jmol)
004554364.b3lyp_6-31g(d).inp

004554364.b3lyp_6-31g(d).qchem.inp (generated)

004554364.b3lyp_6-31g(d).gjf (generated)

004554364.b3lyp_6-31g(d).firefly.inp (generated)

004554364.b3lyp_6-31g(d).smash.inp (generated)

004554364.b3lyp_6-31g(d).nwchem.inp (generated) 004554364.b3lyp_6-31g(d).log.xz 004554364.td-b3lyp_6-31g+(d).inp 004554364.td-b3lyp_6-31g+(d).log.xz

004554364.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554364.td-b3lyp_6-31+g(d).gjf (generated)

004554364.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554364.mol 004554364.PUBCHEM 004554364.mol (via Jmol)
004554442.b3lyp_6-31g(d).inp

004554442.b3lyp_6-31g(d).qchem.inp (generated)

004554442.b3lyp_6-31g(d).gjf (generated)

004554442.b3lyp_6-31g(d).firefly.inp (generated)

004554442.b3lyp_6-31g(d).smash.inp (generated)

004554442.b3lyp_6-31g(d).nwchem.inp (generated) 004554442.b3lyp_6-31g(d).log.xz 004554442.td-b3lyp_6-31g+(d).inp 004554442.td-b3lyp_6-31g+(d).log.xz

004554442.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554442.td-b3lyp_6-31+g(d).gjf (generated)

004554442.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554442.mol 004554442.PUBCHEM 004554442.mol (via Jmol)
004554456.b3lyp_6-31g(d).inp

004554456.b3lyp_6-31g(d).qchem.inp (generated)

004554456.b3lyp_6-31g(d).gjf (generated)

004554456.b3lyp_6-31g(d).firefly.inp (generated)

004554456.b3lyp_6-31g(d).smash.inp (generated)

004554456.b3lyp_6-31g(d).nwchem.inp (generated) 004554456.b3lyp_6-31g(d).log.xz 004554456.td-b3lyp_6-31g+(d).inp 004554456.td-b3lyp_6-31g+(d).log.xz

004554456.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554456.td-b3lyp_6-31+g(d).gjf (generated)

004554456.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554456.mol 004554456.PUBCHEM 004554456.mol (via Jmol)
004554458.b3lyp_6-31g(d).inp

004554458.b3lyp_6-31g(d).qchem.inp (generated)

004554458.b3lyp_6-31g(d).gjf (generated)

004554458.b3lyp_6-31g(d).firefly.inp (generated)

004554458.b3lyp_6-31g(d).smash.inp (generated)

004554458.b3lyp_6-31g(d).nwchem.inp (generated) 004554458.b3lyp_6-31g(d).log.xz 004554458.td-b3lyp_6-31g+(d).inp 004554458.td-b3lyp_6-31g+(d).log.xz

004554458.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554458.td-b3lyp_6-31+g(d).gjf (generated)

004554458.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554458.mol 004554458.PUBCHEM 004554458.mol (via Jmol)
004554554.b3lyp_6-31g(d).inp

004554554.b3lyp_6-31g(d).qchem.inp (generated)

004554554.b3lyp_6-31g(d).gjf (generated)

004554554.b3lyp_6-31g(d).firefly.inp (generated)

004554554.b3lyp_6-31g(d).smash.inp (generated)

004554554.b3lyp_6-31g(d).nwchem.inp (generated) 004554554.b3lyp_6-31g(d).log.xz 004554554.td-b3lyp_6-31g+(d).inp 004554554.td-b3lyp_6-31g+(d).log.xz

004554554.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554554.td-b3lyp_6-31+g(d).gjf (generated)

004554554.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554554.mol 004554554.PUBCHEM 004554554.mol (via Jmol)
004554563.b3lyp_6-31g(d).inp

004554563.b3lyp_6-31g(d).qchem.inp (generated)

004554563.b3lyp_6-31g(d).gjf (generated)

004554563.b3lyp_6-31g(d).firefly.inp (generated)

004554563.b3lyp_6-31g(d).smash.inp (generated)

004554563.b3lyp_6-31g(d).nwchem.inp (generated) 004554563.b3lyp_6-31g(d).log.xz 004554563.td-b3lyp_6-31g+(d).inp 004554563.td-b3lyp_6-31g+(d).log.xz

004554563.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554563.td-b3lyp_6-31+g(d).gjf (generated)

004554563.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554563.mol 004554563.PUBCHEM 004554563.mol (via Jmol)
004554564.b3lyp_6-31g(d).inp

004554564.b3lyp_6-31g(d).qchem.inp (generated)

004554564.b3lyp_6-31g(d).gjf (generated)

004554564.b3lyp_6-31g(d).firefly.inp (generated)

004554564.b3lyp_6-31g(d).smash.inp (generated)

004554564.b3lyp_6-31g(d).nwchem.inp (generated) 004554564.b3lyp_6-31g(d).log.xz 004554564.td-b3lyp_6-31g+(d).inp 004554564.td-b3lyp_6-31g+(d).log.xz

004554564.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554564.td-b3lyp_6-31+g(d).gjf (generated)

004554564.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554564.mol 004554564.PUBCHEM 004554564.mol (via Jmol)
004554619.b3lyp_6-31g(d).inp

004554619.b3lyp_6-31g(d).qchem.inp (generated)

004554619.b3lyp_6-31g(d).gjf (generated)

004554619.b3lyp_6-31g(d).firefly.inp (generated)

004554619.b3lyp_6-31g(d).smash.inp (generated)

004554619.b3lyp_6-31g(d).nwchem.inp (generated) 004554619.b3lyp_6-31g(d).log.xz 004554619.td-b3lyp_6-31g+(d).inp 004554619.td-b3lyp_6-31g+(d).log.xz

004554619.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554619.td-b3lyp_6-31+g(d).gjf (generated)

004554619.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554619.mol 004554619.PUBCHEM 004554619.mol (via Jmol)
004554666.b3lyp_6-31g(d).inp

004554666.b3lyp_6-31g(d).qchem.inp (generated)

004554666.b3lyp_6-31g(d).gjf (generated)

004554666.b3lyp_6-31g(d).firefly.inp (generated)

004554666.b3lyp_6-31g(d).smash.inp (generated)

004554666.b3lyp_6-31g(d).nwchem.inp (generated) 004554666.b3lyp_6-31g(d).log.xz 004554666.td-b3lyp_6-31g+(d).inp 004554666.td-b3lyp_6-31g+(d).log.xz

004554666.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554666.td-b3lyp_6-31+g(d).gjf (generated)

004554666.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554666.mol 004554666.PUBCHEM 004554666.mol (via Jmol)
004554669.b3lyp_6-31g(d).inp

004554669.b3lyp_6-31g(d).qchem.inp (generated)

004554669.b3lyp_6-31g(d).gjf (generated)

004554669.b3lyp_6-31g(d).firefly.inp (generated)

004554669.b3lyp_6-31g(d).smash.inp (generated)

004554669.b3lyp_6-31g(d).nwchem.inp (generated) 004554669.b3lyp_6-31g(d).log.xz 004554669.td-b3lyp_6-31g+(d).inp 004554669.td-b3lyp_6-31g+(d).log.xz

004554669.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554669.td-b3lyp_6-31+g(d).gjf (generated)

004554669.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554669.mol 004554669.PUBCHEM 004554669.mol (via Jmol)
004554770.b3lyp_6-31g(d).inp

004554770.b3lyp_6-31g(d).qchem.inp (generated)

004554770.b3lyp_6-31g(d).gjf (generated)

004554770.b3lyp_6-31g(d).firefly.inp (generated)

004554770.b3lyp_6-31g(d).smash.inp (generated)

004554770.b3lyp_6-31g(d).nwchem.inp (generated) 004554770.b3lyp_6-31g(d).log.xz 004554770.td-b3lyp_6-31g+(d).inp 004554770.td-b3lyp_6-31g+(d).log.xz

004554770.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554770.td-b3lyp_6-31+g(d).gjf (generated)

004554770.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554770.mol 004554770.PUBCHEM 004554770.mol (via Jmol)
004554782.b3lyp_6-31g(d).inp

004554782.b3lyp_6-31g(d).qchem.inp (generated)

004554782.b3lyp_6-31g(d).gjf (generated)

004554782.b3lyp_6-31g(d).firefly.inp (generated)

004554782.b3lyp_6-31g(d).smash.inp (generated)

004554782.b3lyp_6-31g(d).nwchem.inp (generated) 004554782.b3lyp_6-31g(d).log.xz 004554782.td-b3lyp_6-31g+(d).inp 004554782.td-b3lyp_6-31g+(d).log.xz

004554782.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554782.td-b3lyp_6-31+g(d).gjf (generated)

004554782.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554782.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554782.mol 004554782.PUBCHEM 004554782.mol (via Jmol)
004554831.b3lyp_6-31g(d).inp

004554831.b3lyp_6-31g(d).qchem.inp (generated)

004554831.b3lyp_6-31g(d).gjf (generated)

004554831.b3lyp_6-31g(d).firefly.inp (generated)

004554831.b3lyp_6-31g(d).smash.inp (generated)

004554831.b3lyp_6-31g(d).nwchem.inp (generated) 004554831.b3lyp_6-31g(d).log.xz 004554831.td-b3lyp_6-31g+(d).inp 004554831.td-b3lyp_6-31g+(d).log.xz

004554831.td-b3lyp_6-31+g(d).qchem.inp (generated)

004554831.td-b3lyp_6-31+g(d).gjf (generated)

004554831.td-b3lyp_6-31+g(d).firefly.inp (generated)

004554831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004554831.mol 004554831.PUBCHEM 004554831.mol (via Jmol)
004554836.b3lyp_6-31g(d).inp

004554836.b3lyp_6-31g(d).qchem.inp (generated)

004554836.b3lyp_6-31g(d).gjf (generated)

004554836.b3lyp_6-31g(d).firefly.inp (generated)

004554836.b3lyp_6-31g(d).smash.inp (generated)

004554836.b3lyp_6-31g(d).nwchem.inp (generated) 004554836.b3lyp_6-31g(d).log.xz 004554836.mol 004554836.PUBCHEM 004554836.mol (via Jmol)
004555143.b3lyp_6-31g(d).inp

004555143.b3lyp_6-31g(d).qchem.inp (generated)

004555143.b3lyp_6-31g(d).gjf (generated)

004555143.b3lyp_6-31g(d).firefly.inp (generated)

004555143.b3lyp_6-31g(d).smash.inp (generated)

004555143.b3lyp_6-31g(d).nwchem.inp (generated) 004555143.b3lyp_6-31g(d).log.xz 004555143.td-b3lyp_6-31g+(d).inp 004555143.td-b3lyp_6-31g+(d).log.xz

004555143.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555143.td-b3lyp_6-31+g(d).gjf (generated)

004555143.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555143.mol 004555143.PUBCHEM 004555143.mol (via Jmol)
004555217.b3lyp_6-31g(d).inp

004555217.b3lyp_6-31g(d).qchem.inp (generated)

004555217.b3lyp_6-31g(d).gjf (generated)

004555217.b3lyp_6-31g(d).firefly.inp (generated)

004555217.b3lyp_6-31g(d).smash.inp (generated)

004555217.b3lyp_6-31g(d).nwchem.inp (generated) 004555217.b3lyp_6-31g(d).log.xz 004555217.td-b3lyp_6-31g+(d).inp 004555217.td-b3lyp_6-31g+(d).log.xz

004555217.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555217.td-b3lyp_6-31+g(d).gjf (generated)

004555217.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555217.mol 004555217.PUBCHEM 004555217.mol (via Jmol)
004555293.b3lyp_6-31g(d).inp

004555293.b3lyp_6-31g(d).qchem.inp (generated)

004555293.b3lyp_6-31g(d).gjf (generated)

004555293.b3lyp_6-31g(d).firefly.inp (generated)

004555293.b3lyp_6-31g(d).smash.inp (generated)

004555293.b3lyp_6-31g(d).nwchem.inp (generated) 004555293.b3lyp_6-31g(d).log.xz 004555293.td-b3lyp_6-31g+(d).inp 004555293.td-b3lyp_6-31g+(d).log.xz

004555293.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555293.td-b3lyp_6-31+g(d).gjf (generated)

004555293.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555293.mol 004555293.PUBCHEM 004555293.mol (via Jmol)
004555362.b3lyp_6-31g(d).inp

004555362.b3lyp_6-31g(d).qchem.inp (generated)

004555362.b3lyp_6-31g(d).gjf (generated)

004555362.b3lyp_6-31g(d).firefly.inp (generated)

004555362.b3lyp_6-31g(d).smash.inp (generated)

004555362.b3lyp_6-31g(d).nwchem.inp (generated) 004555362.b3lyp_6-31g(d).log.xz 004555362.td-b3lyp_6-31g+(d).inp 004555362.td-b3lyp_6-31g+(d).log.xz

004555362.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555362.td-b3lyp_6-31+g(d).gjf (generated)

004555362.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555362.mol 004555362.PUBCHEM 004555362.mol (via Jmol)
004555395.b3lyp_6-31g(d).inp

004555395.b3lyp_6-31g(d).qchem.inp (generated)

004555395.b3lyp_6-31g(d).gjf (generated)

004555395.b3lyp_6-31g(d).firefly.inp (generated)

004555395.b3lyp_6-31g(d).smash.inp (generated)

004555395.b3lyp_6-31g(d).nwchem.inp (generated) 004555395.b3lyp_6-31g(d).log.xz 004555395.td-b3lyp_6-31g+(d).inp 004555395.td-b3lyp_6-31g+(d).log.xz

004555395.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555395.td-b3lyp_6-31+g(d).gjf (generated)

004555395.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555395.mol 004555395.PUBCHEM 004555395.mol (via Jmol)
004555415.b3lyp_6-31g(d).inp

004555415.b3lyp_6-31g(d).qchem.inp (generated)

004555415.b3lyp_6-31g(d).gjf (generated)

004555415.b3lyp_6-31g(d).firefly.inp (generated)

004555415.b3lyp_6-31g(d).smash.inp (generated)

004555415.b3lyp_6-31g(d).nwchem.inp (generated) 004555415.b3lyp_6-31g(d).log.xz 004555415.mol 004555415.PUBCHEM 004555415.mol (via Jmol)
004555436.b3lyp_6-31g(d).inp

004555436.b3lyp_6-31g(d).qchem.inp (generated)

004555436.b3lyp_6-31g(d).gjf (generated)

004555436.b3lyp_6-31g(d).firefly.inp (generated)

004555436.b3lyp_6-31g(d).smash.inp (generated)

004555436.b3lyp_6-31g(d).nwchem.inp (generated) 004555436.b3lyp_6-31g(d).log.xz 004555436.td-b3lyp_6-31g+(d).inp 004555436.td-b3lyp_6-31g+(d).log.xz

004555436.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555436.td-b3lyp_6-31+g(d).gjf (generated)

004555436.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555436.mol 004555436.PUBCHEM 004555436.mol (via Jmol)
004555457.b3lyp_6-31g(d).inp

004555457.b3lyp_6-31g(d).qchem.inp (generated)

004555457.b3lyp_6-31g(d).gjf (generated)

004555457.b3lyp_6-31g(d).firefly.inp (generated)

004555457.b3lyp_6-31g(d).smash.inp (generated)

004555457.b3lyp_6-31g(d).nwchem.inp (generated) 004555457.b3lyp_6-31g(d).log.xz 004555457.td-b3lyp_6-31g+(d).inp 004555457.td-b3lyp_6-31g+(d).log.xz

004555457.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555457.td-b3lyp_6-31+g(d).gjf (generated)

004555457.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555457.mol 004555457.PUBCHEM 004555457.mol (via Jmol)
004555678.b3lyp_6-31g(d).inp

004555678.b3lyp_6-31g(d).qchem.inp (generated)

004555678.b3lyp_6-31g(d).gjf (generated)

004555678.b3lyp_6-31g(d).firefly.inp (generated)

004555678.b3lyp_6-31g(d).smash.inp (generated)

004555678.b3lyp_6-31g(d).nwchem.inp (generated) 004555678.b3lyp_6-31g(d).log.xz 004555678.td-b3lyp_6-31g+(d).inp 004555678.td-b3lyp_6-31g+(d).log.xz

004555678.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555678.td-b3lyp_6-31+g(d).gjf (generated)

004555678.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555678.mol 004555678.PUBCHEM 004555678.mol (via Jmol)
004555685.b3lyp_6-31g(d).inp

004555685.b3lyp_6-31g(d).qchem.inp (generated)

004555685.b3lyp_6-31g(d).gjf (generated)

004555685.b3lyp_6-31g(d).firefly.inp (generated)

004555685.b3lyp_6-31g(d).smash.inp (generated)

004555685.b3lyp_6-31g(d).nwchem.inp (generated) 004555685.b3lyp_6-31g(d).log.xz 004555685.td-b3lyp_6-31g+(d).inp 004555685.td-b3lyp_6-31g+(d).log.xz

004555685.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555685.td-b3lyp_6-31+g(d).gjf (generated)

004555685.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555685.mol 004555685.PUBCHEM 004555685.mol (via Jmol)
004555739.b3lyp_6-31g(d).inp

004555739.b3lyp_6-31g(d).qchem.inp (generated)

004555739.b3lyp_6-31g(d).gjf (generated)

004555739.b3lyp_6-31g(d).firefly.inp (generated)

004555739.b3lyp_6-31g(d).smash.inp (generated)

004555739.b3lyp_6-31g(d).nwchem.inp (generated) 004555739.b3lyp_6-31g(d).log.xz 004555739.td-b3lyp_6-31g+(d).inp 004555739.td-b3lyp_6-31g+(d).log.xz

004555739.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555739.td-b3lyp_6-31+g(d).gjf (generated)

004555739.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555739.mol 004555739.PUBCHEM 004555739.mol (via Jmol)
004555743.b3lyp_6-31g(d).inp

004555743.b3lyp_6-31g(d).qchem.inp (generated)

004555743.b3lyp_6-31g(d).gjf (generated)

004555743.b3lyp_6-31g(d).firefly.inp (generated)

004555743.b3lyp_6-31g(d).smash.inp (generated)

004555743.b3lyp_6-31g(d).nwchem.inp (generated) 004555743.b3lyp_6-31g(d).log.xz 004555743.td-b3lyp_6-31g+(d).inp 004555743.td-b3lyp_6-31g+(d).log.xz

004555743.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555743.td-b3lyp_6-31+g(d).gjf (generated)

004555743.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555743.mol 004555743.PUBCHEM 004555743.mol (via Jmol)
004555748.b3lyp_6-31g(d).inp

004555748.b3lyp_6-31g(d).qchem.inp (generated)

004555748.b3lyp_6-31g(d).gjf (generated)

004555748.b3lyp_6-31g(d).firefly.inp (generated)

004555748.b3lyp_6-31g(d).smash.inp (generated)

004555748.b3lyp_6-31g(d).nwchem.inp (generated) 004555748.b3lyp_6-31g(d).log.xz 004555748.td-b3lyp_6-31g+(d).inp 004555748.td-b3lyp_6-31g+(d).log.xz

004555748.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555748.td-b3lyp_6-31+g(d).gjf (generated)

004555748.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555748.mol 004555748.PUBCHEM 004555748.mol (via Jmol)
004555749.b3lyp_6-31g(d).inp

004555749.b3lyp_6-31g(d).qchem.inp (generated)

004555749.b3lyp_6-31g(d).gjf (generated)

004555749.b3lyp_6-31g(d).firefly.inp (generated)

004555749.b3lyp_6-31g(d).smash.inp (generated)

004555749.b3lyp_6-31g(d).nwchem.inp (generated) 004555749.b3lyp_6-31g(d).log.xz 004555749.td-b3lyp_6-31g+(d).inp 004555749.td-b3lyp_6-31g+(d).log.xz

004555749.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555749.td-b3lyp_6-31+g(d).gjf (generated)

004555749.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555749.mol 004555749.PUBCHEM 004555749.mol (via Jmol)
004555750.b3lyp_6-31g(d).inp

004555750.b3lyp_6-31g(d).qchem.inp (generated)

004555750.b3lyp_6-31g(d).gjf (generated)

004555750.b3lyp_6-31g(d).firefly.inp (generated)

004555750.b3lyp_6-31g(d).smash.inp (generated)

004555750.b3lyp_6-31g(d).nwchem.inp (generated) 004555750.b3lyp_6-31g(d).log.xz 004555750.td-b3lyp_6-31g+(d).inp 004555750.td-b3lyp_6-31g+(d).log.xz

004555750.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555750.td-b3lyp_6-31+g(d).gjf (generated)

004555750.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555750.mol 004555750.PUBCHEM 004555750.mol (via Jmol)
004555752.b3lyp_6-31g(d).inp

004555752.b3lyp_6-31g(d).qchem.inp (generated)

004555752.b3lyp_6-31g(d).gjf (generated)

004555752.b3lyp_6-31g(d).firefly.inp (generated)

004555752.b3lyp_6-31g(d).smash.inp (generated)

004555752.b3lyp_6-31g(d).nwchem.inp (generated) 004555752.b3lyp_6-31g(d).log.xz 004555752.td-b3lyp_6-31g+(d).inp 004555752.td-b3lyp_6-31g+(d).log.xz

004555752.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555752.td-b3lyp_6-31+g(d).gjf (generated)

004555752.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555752.mol 004555752.PUBCHEM 004555752.mol (via Jmol)
004555765.b3lyp_6-31g(d).inp

004555765.b3lyp_6-31g(d).qchem.inp (generated)

004555765.b3lyp_6-31g(d).gjf (generated)

004555765.b3lyp_6-31g(d).firefly.inp (generated)

004555765.b3lyp_6-31g(d).smash.inp (generated)

004555765.b3lyp_6-31g(d).nwchem.inp (generated) 004555765.b3lyp_6-31g(d).log.xz 004555765.td-b3lyp_6-31g+(d).inp 004555765.td-b3lyp_6-31g+(d).log.xz

004555765.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555765.td-b3lyp_6-31+g(d).gjf (generated)

004555765.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555765.mol 004555765.PUBCHEM 004555765.mol (via Jmol)
004555775.b3lyp_6-31g(d).inp

004555775.b3lyp_6-31g(d).qchem.inp (generated)

004555775.b3lyp_6-31g(d).gjf (generated)

004555775.b3lyp_6-31g(d).firefly.inp (generated)

004555775.b3lyp_6-31g(d).smash.inp (generated)

004555775.b3lyp_6-31g(d).nwchem.inp (generated) 004555775.b3lyp_6-31g(d).log.xz 004555775.td-b3lyp_6-31g+(d).inp 004555775.td-b3lyp_6-31g+(d).log.xz

004555775.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555775.td-b3lyp_6-31+g(d).gjf (generated)

004555775.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555775.mol 004555775.PUBCHEM 004555775.mol (via Jmol)
004555806.b3lyp_6-31g(d).inp

004555806.b3lyp_6-31g(d).qchem.inp (generated)

004555806.b3lyp_6-31g(d).gjf (generated)

004555806.b3lyp_6-31g(d).firefly.inp (generated)

004555806.b3lyp_6-31g(d).smash.inp (generated)

004555806.b3lyp_6-31g(d).nwchem.inp (generated) 004555806.b3lyp_6-31g(d).log.xz 004555806.td-b3lyp_6-31g+(d).inp 004555806.td-b3lyp_6-31g+(d).log.xz

004555806.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555806.td-b3lyp_6-31+g(d).gjf (generated)

004555806.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555806.mol 004555806.PUBCHEM 004555806.mol (via Jmol)
004555807.b3lyp_6-31g(d).inp

004555807.b3lyp_6-31g(d).qchem.inp (generated)

004555807.b3lyp_6-31g(d).gjf (generated)

004555807.b3lyp_6-31g(d).firefly.inp (generated)

004555807.b3lyp_6-31g(d).smash.inp (generated)

004555807.b3lyp_6-31g(d).nwchem.inp (generated) 004555807.b3lyp_6-31g(d).log.xz 004555807.mol 004555807.PUBCHEM 004555807.mol (via Jmol)
004555808.b3lyp_6-31g(d).inp

004555808.b3lyp_6-31g(d).qchem.inp (generated)

004555808.b3lyp_6-31g(d).gjf (generated)

004555808.b3lyp_6-31g(d).firefly.inp (generated)

004555808.b3lyp_6-31g(d).smash.inp (generated)

004555808.b3lyp_6-31g(d).nwchem.inp (generated) 004555808.b3lyp_6-31g(d).log.xz 004555808.td-b3lyp_6-31g+(d).inp 004555808.td-b3lyp_6-31g+(d).log.xz

004555808.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555808.td-b3lyp_6-31+g(d).gjf (generated)

004555808.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555808.mol 004555808.PUBCHEM 004555808.mol (via Jmol)
004555815.b3lyp_6-31g(d).inp

004555815.b3lyp_6-31g(d).qchem.inp (generated)

004555815.b3lyp_6-31g(d).gjf (generated)

004555815.b3lyp_6-31g(d).firefly.inp (generated)

004555815.b3lyp_6-31g(d).smash.inp (generated)

004555815.b3lyp_6-31g(d).nwchem.inp (generated) 004555815.b3lyp_6-31g(d).log.xz 004555815.td-b3lyp_6-31g+(d).inp 004555815.td-b3lyp_6-31g+(d).log.xz

004555815.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555815.td-b3lyp_6-31+g(d).gjf (generated)

004555815.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555815.mol 004555815.PUBCHEM 004555815.mol (via Jmol)
004555816.b3lyp_6-31g(d).inp

004555816.b3lyp_6-31g(d).qchem.inp (generated)

004555816.b3lyp_6-31g(d).gjf (generated)

004555816.b3lyp_6-31g(d).firefly.inp (generated)

004555816.b3lyp_6-31g(d).smash.inp (generated)

004555816.b3lyp_6-31g(d).nwchem.inp (generated) 004555816.b3lyp_6-31g(d).log.xz 004555816.mol 004555816.PUBCHEM 004555816.mol (via Jmol)
004555820.b3lyp_6-31g(d).inp

004555820.b3lyp_6-31g(d).qchem.inp (generated)

004555820.b3lyp_6-31g(d).gjf (generated)

004555820.b3lyp_6-31g(d).firefly.inp (generated)

004555820.b3lyp_6-31g(d).smash.inp (generated)

004555820.b3lyp_6-31g(d).nwchem.inp (generated) 004555820.b3lyp_6-31g(d).log.xz 004555820.td-b3lyp_6-31g+(d).inp 004555820.td-b3lyp_6-31g+(d).log.xz

004555820.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555820.td-b3lyp_6-31+g(d).gjf (generated)

004555820.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555820.mol 004555820.PUBCHEM 004555820.mol (via Jmol)
004555827.b3lyp_6-31g(d).inp

004555827.b3lyp_6-31g(d).qchem.inp (generated)

004555827.b3lyp_6-31g(d).gjf (generated)

004555827.b3lyp_6-31g(d).firefly.inp (generated)

004555827.b3lyp_6-31g(d).smash.inp (generated)

004555827.b3lyp_6-31g(d).nwchem.inp (generated) 004555827.b3lyp_6-31g(d).log.xz 004555827.td-b3lyp_6-31g+(d).inp 004555827.td-b3lyp_6-31g+(d).log.xz

004555827.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555827.td-b3lyp_6-31+g(d).gjf (generated)

004555827.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555827.mol 004555827.PUBCHEM 004555827.mol (via Jmol)
004555828.b3lyp_6-31g(d).inp

004555828.b3lyp_6-31g(d).qchem.inp (generated)

004555828.b3lyp_6-31g(d).gjf (generated)

004555828.b3lyp_6-31g(d).firefly.inp (generated)

004555828.b3lyp_6-31g(d).smash.inp (generated)

004555828.b3lyp_6-31g(d).nwchem.inp (generated) 004555828.b3lyp_6-31g(d).log.xz 004555828.td-b3lyp_6-31g+(d).inp 004555828.td-b3lyp_6-31g+(d).log.xz

004555828.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555828.td-b3lyp_6-31+g(d).gjf (generated)

004555828.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555828.mol 004555828.PUBCHEM 004555828.mol (via Jmol)
004555846.b3lyp_6-31g(d).inp

004555846.b3lyp_6-31g(d).qchem.inp (generated)

004555846.b3lyp_6-31g(d).gjf (generated)

004555846.b3lyp_6-31g(d).firefly.inp (generated)

004555846.b3lyp_6-31g(d).smash.inp (generated)

004555846.b3lyp_6-31g(d).nwchem.inp (generated) 004555846.b3lyp_6-31g(d).log.xz 004555846.td-b3lyp_6-31g+(d).inp 004555846.td-b3lyp_6-31g+(d).log.xz

004555846.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555846.td-b3lyp_6-31+g(d).gjf (generated)

004555846.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555846.mol 004555846.PUBCHEM 004555846.mol (via Jmol)
004555867.b3lyp_6-31g(d).inp

004555867.b3lyp_6-31g(d).qchem.inp (generated)

004555867.b3lyp_6-31g(d).gjf (generated)

004555867.b3lyp_6-31g(d).firefly.inp (generated)

004555867.b3lyp_6-31g(d).smash.inp (generated)

004555867.b3lyp_6-31g(d).nwchem.inp (generated) 004555867.b3lyp_6-31g(d).log.xz 004555867.td-b3lyp_6-31g+(d).inp 004555867.td-b3lyp_6-31g+(d).log.xz

004555867.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555867.td-b3lyp_6-31+g(d).gjf (generated)

004555867.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555867.mol 004555867.PUBCHEM 004555867.mol (via Jmol)
004555894.b3lyp_6-31g(d).inp

004555894.b3lyp_6-31g(d).qchem.inp (generated)

004555894.b3lyp_6-31g(d).gjf (generated)

004555894.b3lyp_6-31g(d).firefly.inp (generated)

004555894.b3lyp_6-31g(d).smash.inp (generated)

004555894.b3lyp_6-31g(d).nwchem.inp (generated) 004555894.b3lyp_6-31g(d).log.xz 004555894.td-b3lyp_6-31g+(d).inp 004555894.td-b3lyp_6-31g+(d).log.xz

004555894.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555894.td-b3lyp_6-31+g(d).gjf (generated)

004555894.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555894.mol 004555894.PUBCHEM 004555894.mol (via Jmol)
004555911.b3lyp_6-31g(d).inp

004555911.b3lyp_6-31g(d).qchem.inp (generated)

004555911.b3lyp_6-31g(d).gjf (generated)

004555911.b3lyp_6-31g(d).firefly.inp (generated)

004555911.b3lyp_6-31g(d).smash.inp (generated)

004555911.b3lyp_6-31g(d).nwchem.inp (generated) 004555911.b3lyp_6-31g(d).log.xz 004555911.td-b3lyp_6-31g+(d).inp 004555911.td-b3lyp_6-31g+(d).log.xz

004555911.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555911.td-b3lyp_6-31+g(d).gjf (generated)

004555911.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555911.mol 004555911.PUBCHEM 004555911.mol (via Jmol)
004555912.b3lyp_6-31g(d).inp

004555912.b3lyp_6-31g(d).qchem.inp (generated)

004555912.b3lyp_6-31g(d).gjf (generated)

004555912.b3lyp_6-31g(d).firefly.inp (generated)

004555912.b3lyp_6-31g(d).smash.inp (generated)

004555912.b3lyp_6-31g(d).nwchem.inp (generated) 004555912.b3lyp_6-31g(d).log.xz 004555912.td-b3lyp_6-31g+(d).inp 004555912.td-b3lyp_6-31g+(d).log.xz

004555912.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555912.td-b3lyp_6-31+g(d).gjf (generated)

004555912.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555912.mol 004555912.PUBCHEM 004555912.mol (via Jmol)
004555946.b3lyp_6-31g(d).inp

004555946.b3lyp_6-31g(d).qchem.inp (generated)

004555946.b3lyp_6-31g(d).gjf (generated)

004555946.b3lyp_6-31g(d).firefly.inp (generated)

004555946.b3lyp_6-31g(d).smash.inp (generated)

004555946.b3lyp_6-31g(d).nwchem.inp (generated) 004555946.b3lyp_6-31g(d).log.xz 004555946.td-b3lyp_6-31g+(d).inp 004555946.td-b3lyp_6-31g+(d).log.xz

004555946.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555946.td-b3lyp_6-31+g(d).gjf (generated)

004555946.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555946.mol 004555946.PUBCHEM 004555946.mol (via Jmol)
004555949.b3lyp_6-31g(d).inp

004555949.b3lyp_6-31g(d).qchem.inp (generated)

004555949.b3lyp_6-31g(d).gjf (generated)

004555949.b3lyp_6-31g(d).firefly.inp (generated)

004555949.b3lyp_6-31g(d).smash.inp (generated)

004555949.b3lyp_6-31g(d).nwchem.inp (generated) 004555949.b3lyp_6-31g(d).log.xz 004555949.td-b3lyp_6-31g+(d).inp 004555949.td-b3lyp_6-31g+(d).log.xz

004555949.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555949.td-b3lyp_6-31+g(d).gjf (generated)

004555949.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555949.mol 004555949.PUBCHEM 004555949.mol (via Jmol)
004555959.b3lyp_6-31g(d).inp

004555959.b3lyp_6-31g(d).qchem.inp (generated)

004555959.b3lyp_6-31g(d).gjf (generated)

004555959.b3lyp_6-31g(d).firefly.inp (generated)

004555959.b3lyp_6-31g(d).smash.inp (generated)

004555959.b3lyp_6-31g(d).nwchem.inp (generated) 004555959.b3lyp_6-31g(d).log.xz 004555959.td-b3lyp_6-31g+(d).inp 004555959.td-b3lyp_6-31g+(d).log.xz

004555959.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555959.td-b3lyp_6-31+g(d).gjf (generated)

004555959.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555959.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555959.mol 004555959.PUBCHEM 004555959.mol (via Jmol)
004555980.b3lyp_6-31g(d).inp

004555980.b3lyp_6-31g(d).qchem.inp (generated)

004555980.b3lyp_6-31g(d).gjf (generated)

004555980.b3lyp_6-31g(d).firefly.inp (generated)

004555980.b3lyp_6-31g(d).smash.inp (generated)

004555980.b3lyp_6-31g(d).nwchem.inp (generated) 004555980.b3lyp_6-31g(d).log.xz 004555980.td-b3lyp_6-31g+(d).inp 004555980.td-b3lyp_6-31g+(d).log.xz

004555980.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555980.td-b3lyp_6-31+g(d).gjf (generated)

004555980.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555980.mol 004555980.PUBCHEM 004555980.mol (via Jmol)
004555997.b3lyp_6-31g(d).inp

004555997.b3lyp_6-31g(d).qchem.inp (generated)

004555997.b3lyp_6-31g(d).gjf (generated)

004555997.b3lyp_6-31g(d).firefly.inp (generated)

004555997.b3lyp_6-31g(d).smash.inp (generated)

004555997.b3lyp_6-31g(d).nwchem.inp (generated) 004555997.b3lyp_6-31g(d).log.xz 004555997.td-b3lyp_6-31g+(d).inp 004555997.td-b3lyp_6-31g+(d).log.xz

004555997.td-b3lyp_6-31+g(d).qchem.inp (generated)

004555997.td-b3lyp_6-31+g(d).gjf (generated)

004555997.td-b3lyp_6-31+g(d).firefly.inp (generated)

004555997.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004555997.mol 004555997.PUBCHEM 004555997.mol (via Jmol)
004556012.b3lyp_6-31g(d).inp

004556012.b3lyp_6-31g(d).qchem.inp (generated)

004556012.b3lyp_6-31g(d).gjf (generated)

004556012.b3lyp_6-31g(d).firefly.inp (generated)

004556012.b3lyp_6-31g(d).smash.inp (generated)

004556012.b3lyp_6-31g(d).nwchem.inp (generated) 004556012.b3lyp_6-31g(d).log.xz 004556012.td-b3lyp_6-31g+(d).inp 004556012.td-b3lyp_6-31g+(d).log.xz

004556012.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556012.td-b3lyp_6-31+g(d).gjf (generated)

004556012.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556012.mol 004556012.PUBCHEM 004556012.mol (via Jmol)
004556013.b3lyp_6-31g(d).inp

004556013.b3lyp_6-31g(d).qchem.inp (generated)

004556013.b3lyp_6-31g(d).gjf (generated)

004556013.b3lyp_6-31g(d).firefly.inp (generated)

004556013.b3lyp_6-31g(d).smash.inp (generated)

004556013.b3lyp_6-31g(d).nwchem.inp (generated) 004556013.b3lyp_6-31g(d).log.xz 004556013.mol 004556013.PUBCHEM 004556013.mol (via Jmol)
004556014.b3lyp_6-31g(d).inp

004556014.b3lyp_6-31g(d).qchem.inp (generated)

004556014.b3lyp_6-31g(d).gjf (generated)

004556014.b3lyp_6-31g(d).firefly.inp (generated)

004556014.b3lyp_6-31g(d).smash.inp (generated)

004556014.b3lyp_6-31g(d).nwchem.inp (generated) 004556014.b3lyp_6-31g(d).log.xz 004556014.td-b3lyp_6-31g+(d).inp 004556014.td-b3lyp_6-31g+(d).log.xz

004556014.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556014.td-b3lyp_6-31+g(d).gjf (generated)

004556014.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556014.mol 004556014.PUBCHEM 004556014.mol (via Jmol)
004556020.b3lyp_6-31g(d).inp

004556020.b3lyp_6-31g(d).qchem.inp (generated)

004556020.b3lyp_6-31g(d).gjf (generated)

004556020.b3lyp_6-31g(d).firefly.inp (generated)

004556020.b3lyp_6-31g(d).smash.inp (generated)

004556020.b3lyp_6-31g(d).nwchem.inp (generated) 004556020.b3lyp_6-31g(d).log.xz 004556020.td-b3lyp_6-31g+(d).inp 004556020.td-b3lyp_6-31g+(d).log.xz

004556020.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556020.td-b3lyp_6-31+g(d).gjf (generated)

004556020.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556020.mol 004556020.PUBCHEM 004556020.mol (via Jmol)
004556046.b3lyp_6-31g(d).inp

004556046.b3lyp_6-31g(d).qchem.inp (generated)

004556046.b3lyp_6-31g(d).gjf (generated)

004556046.b3lyp_6-31g(d).firefly.inp (generated)

004556046.b3lyp_6-31g(d).smash.inp (generated)

004556046.b3lyp_6-31g(d).nwchem.inp (generated) 004556046.b3lyp_6-31g(d).log.xz 004556046.td-b3lyp_6-31g+(d).inp 004556046.td-b3lyp_6-31g+(d).log.xz

004556046.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556046.td-b3lyp_6-31+g(d).gjf (generated)

004556046.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556046.mol 004556046.PUBCHEM 004556046.mol (via Jmol)
004556082.b3lyp_6-31g(d).inp

004556082.b3lyp_6-31g(d).qchem.inp (generated)

004556082.b3lyp_6-31g(d).gjf (generated)

004556082.b3lyp_6-31g(d).firefly.inp (generated)

004556082.b3lyp_6-31g(d).smash.inp (generated)

004556082.b3lyp_6-31g(d).nwchem.inp (generated) 004556082.b3lyp_6-31g(d).log.xz 004556082.td-b3lyp_6-31g+(d).inp 004556082.td-b3lyp_6-31g+(d).log.xz

004556082.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556082.td-b3lyp_6-31+g(d).gjf (generated)

004556082.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556082.mol 004556082.PUBCHEM 004556082.mol (via Jmol)
004556083.b3lyp_6-31g(d).inp

004556083.b3lyp_6-31g(d).qchem.inp (generated)

004556083.b3lyp_6-31g(d).gjf (generated)

004556083.b3lyp_6-31g(d).firefly.inp (generated)

004556083.b3lyp_6-31g(d).smash.inp (generated)

004556083.b3lyp_6-31g(d).nwchem.inp (generated) 004556083.b3lyp_6-31g(d).log.xz 004556083.td-b3lyp_6-31g+(d).inp 004556083.td-b3lyp_6-31g+(d).log.xz

004556083.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556083.td-b3lyp_6-31+g(d).gjf (generated)

004556083.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556083.mol 004556083.PUBCHEM 004556083.mol (via Jmol)
004556096.b3lyp_6-31g(d).inp

004556096.b3lyp_6-31g(d).qchem.inp (generated)

004556096.b3lyp_6-31g(d).gjf (generated)

004556096.b3lyp_6-31g(d).firefly.inp (generated)

004556096.b3lyp_6-31g(d).smash.inp (generated)

004556096.b3lyp_6-31g(d).nwchem.inp (generated) 004556096.b3lyp_6-31g(d).log.xz 004556096.td-b3lyp_6-31g+(d).inp 004556096.td-b3lyp_6-31g+(d).log.xz

004556096.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556096.td-b3lyp_6-31+g(d).gjf (generated)

004556096.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556096.mol 004556096.PUBCHEM 004556096.mol (via Jmol)
004556107.b3lyp_6-31g(d).inp

004556107.b3lyp_6-31g(d).qchem.inp (generated)

004556107.b3lyp_6-31g(d).gjf (generated)

004556107.b3lyp_6-31g(d).firefly.inp (generated)

004556107.b3lyp_6-31g(d).smash.inp (generated)

004556107.b3lyp_6-31g(d).nwchem.inp (generated) 004556107.b3lyp_6-31g(d).log.xz 004556107.td-b3lyp_6-31g+(d).inp 004556107.td-b3lyp_6-31g+(d).log.xz

004556107.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556107.td-b3lyp_6-31+g(d).gjf (generated)

004556107.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556107.mol 004556107.PUBCHEM 004556107.mol (via Jmol)
004556114.b3lyp_6-31g(d).inp

004556114.b3lyp_6-31g(d).qchem.inp (generated)

004556114.b3lyp_6-31g(d).gjf (generated)

004556114.b3lyp_6-31g(d).firefly.inp (generated)

004556114.b3lyp_6-31g(d).smash.inp (generated)

004556114.b3lyp_6-31g(d).nwchem.inp (generated) 004556114.b3lyp_6-31g(d).log.xz 004556114.mol 004556114.PUBCHEM 004556114.mol (via Jmol)
004556155.b3lyp_6-31g(d).inp

004556155.b3lyp_6-31g(d).qchem.inp (generated)

004556155.b3lyp_6-31g(d).gjf (generated)

004556155.b3lyp_6-31g(d).firefly.inp (generated)

004556155.b3lyp_6-31g(d).smash.inp (generated)

004556155.b3lyp_6-31g(d).nwchem.inp (generated) 004556155.b3lyp_6-31g(d).log.xz 004556155.td-b3lyp_6-31g+(d).inp 004556155.td-b3lyp_6-31g+(d).log.xz

004556155.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556155.td-b3lyp_6-31+g(d).gjf (generated)

004556155.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556155.mol 004556155.PUBCHEM 004556155.mol (via Jmol)
004556200.b3lyp_6-31g(d).inp

004556200.b3lyp_6-31g(d).qchem.inp (generated)

004556200.b3lyp_6-31g(d).gjf (generated)

004556200.b3lyp_6-31g(d).firefly.inp (generated)

004556200.b3lyp_6-31g(d).smash.inp (generated)

004556200.b3lyp_6-31g(d).nwchem.inp (generated) 004556200.b3lyp_6-31g(d).log.xz 004556200.td-b3lyp_6-31g+(d).inp 004556200.td-b3lyp_6-31g+(d).log.xz

004556200.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556200.td-b3lyp_6-31+g(d).gjf (generated)

004556200.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556200.mol 004556200.PUBCHEM 004556200.mol (via Jmol)
004556220.b3lyp_6-31g(d).inp

004556220.b3lyp_6-31g(d).qchem.inp (generated)

004556220.b3lyp_6-31g(d).gjf (generated)

004556220.b3lyp_6-31g(d).firefly.inp (generated)

004556220.b3lyp_6-31g(d).smash.inp (generated)

004556220.b3lyp_6-31g(d).nwchem.inp (generated) 004556220.b3lyp_6-31g(d).log.xz 004556220.mol 004556220.PUBCHEM 004556220.mol (via Jmol)
004556229.b3lyp_6-31g(d).inp

004556229.b3lyp_6-31g(d).qchem.inp (generated)

004556229.b3lyp_6-31g(d).gjf (generated)

004556229.b3lyp_6-31g(d).firefly.inp (generated)

004556229.b3lyp_6-31g(d).smash.inp (generated)

004556229.b3lyp_6-31g(d).nwchem.inp (generated) 004556229.b3lyp_6-31g(d).log.xz 004556229.td-b3lyp_6-31g+(d).inp 004556229.td-b3lyp_6-31g+(d).log.xz

004556229.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556229.td-b3lyp_6-31+g(d).gjf (generated)

004556229.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556229.mol 004556229.PUBCHEM 004556229.mol (via Jmol)
004556239.b3lyp_6-31g(d).inp

004556239.b3lyp_6-31g(d).qchem.inp (generated)

004556239.b3lyp_6-31g(d).gjf (generated)

004556239.b3lyp_6-31g(d).firefly.inp (generated)

004556239.b3lyp_6-31g(d).smash.inp (generated)

004556239.b3lyp_6-31g(d).nwchem.inp (generated) 004556239.b3lyp_6-31g(d).log.xz 004556239.mol 004556239.PUBCHEM 004556239.mol (via Jmol)
004556260.b3lyp_6-31g(d).inp

004556260.b3lyp_6-31g(d).qchem.inp (generated)

004556260.b3lyp_6-31g(d).gjf (generated)

004556260.b3lyp_6-31g(d).firefly.inp (generated)

004556260.b3lyp_6-31g(d).smash.inp (generated)

004556260.b3lyp_6-31g(d).nwchem.inp (generated) 004556260.b3lyp_6-31g(d).log.xz 004556260.td-b3lyp_6-31g+(d).inp 004556260.td-b3lyp_6-31g+(d).log.xz

004556260.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556260.td-b3lyp_6-31+g(d).gjf (generated)

004556260.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556260.mol 004556260.PUBCHEM 004556260.mol (via Jmol)
004556268.b3lyp_6-31g(d).inp

004556268.b3lyp_6-31g(d).qchem.inp (generated)

004556268.b3lyp_6-31g(d).gjf (generated)

004556268.b3lyp_6-31g(d).firefly.inp (generated)

004556268.b3lyp_6-31g(d).smash.inp (generated)

004556268.b3lyp_6-31g(d).nwchem.inp (generated) 004556268.b3lyp_6-31g(d).log.xz 004556268.td-b3lyp_6-31g+(d).inp 004556268.td-b3lyp_6-31g+(d).log.xz

004556268.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556268.td-b3lyp_6-31+g(d).gjf (generated)

004556268.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556268.mol 004556268.PUBCHEM 004556268.mol (via Jmol)
004556387.b3lyp_6-31g(d).inp

004556387.b3lyp_6-31g(d).qchem.inp (generated)

004556387.b3lyp_6-31g(d).gjf (generated)

004556387.b3lyp_6-31g(d).firefly.inp (generated)

004556387.b3lyp_6-31g(d).smash.inp (generated)

004556387.b3lyp_6-31g(d).nwchem.inp (generated) 004556387.b3lyp_6-31g(d).log.xz 004556387.td-b3lyp_6-31g+(d).inp 004556387.td-b3lyp_6-31g+(d).log.xz

004556387.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556387.td-b3lyp_6-31+g(d).gjf (generated)

004556387.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556387.mol 004556387.PUBCHEM 004556387.mol (via Jmol)
004556388.b3lyp_6-31g(d).inp

004556388.b3lyp_6-31g(d).qchem.inp (generated)

004556388.b3lyp_6-31g(d).gjf (generated)

004556388.b3lyp_6-31g(d).firefly.inp (generated)

004556388.b3lyp_6-31g(d).smash.inp (generated)

004556388.b3lyp_6-31g(d).nwchem.inp (generated) 004556388.b3lyp_6-31g(d).log.xz 004556388.td-b3lyp_6-31g+(d).inp 004556388.td-b3lyp_6-31g+(d).log.xz

004556388.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556388.td-b3lyp_6-31+g(d).gjf (generated)

004556388.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556388.mol 004556388.PUBCHEM 004556388.mol (via Jmol)
004556389.b3lyp_6-31g(d).inp

004556389.b3lyp_6-31g(d).qchem.inp (generated)

004556389.b3lyp_6-31g(d).gjf (generated)

004556389.b3lyp_6-31g(d).firefly.inp (generated)

004556389.b3lyp_6-31g(d).smash.inp (generated)

004556389.b3lyp_6-31g(d).nwchem.inp (generated) 004556389.b3lyp_6-31g(d).log.xz 004556389.td-b3lyp_6-31g+(d).inp 004556389.td-b3lyp_6-31g+(d).log.xz

004556389.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556389.td-b3lyp_6-31+g(d).gjf (generated)

004556389.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556389.mol 004556389.PUBCHEM 004556389.mol (via Jmol)
004556456.b3lyp_6-31g(d).inp

004556456.b3lyp_6-31g(d).qchem.inp (generated)

004556456.b3lyp_6-31g(d).gjf (generated)

004556456.b3lyp_6-31g(d).firefly.inp (generated)

004556456.b3lyp_6-31g(d).smash.inp (generated)

004556456.b3lyp_6-31g(d).nwchem.inp (generated) 004556456.b3lyp_6-31g(d).log.xz 004556456.td-b3lyp_6-31g+(d).inp 004556456.td-b3lyp_6-31g+(d).log.xz

004556456.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556456.td-b3lyp_6-31+g(d).gjf (generated)

004556456.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556456.mol 004556456.PUBCHEM 004556456.mol (via Jmol)
004556520.b3lyp_6-31g(d).inp

004556520.b3lyp_6-31g(d).qchem.inp (generated)

004556520.b3lyp_6-31g(d).gjf (generated)

004556520.b3lyp_6-31g(d).firefly.inp (generated)

004556520.b3lyp_6-31g(d).smash.inp (generated)

004556520.b3lyp_6-31g(d).nwchem.inp (generated) 004556520.b3lyp_6-31g(d).log.xz 004556520.mol 004556520.PUBCHEM 004556520.mol (via Jmol)
004556659.b3lyp_6-31g(d).inp

004556659.b3lyp_6-31g(d).qchem.inp (generated)

004556659.b3lyp_6-31g(d).gjf (generated)

004556659.b3lyp_6-31g(d).firefly.inp (generated)

004556659.b3lyp_6-31g(d).smash.inp (generated)

004556659.b3lyp_6-31g(d).nwchem.inp (generated) 004556659.b3lyp_6-31g(d).log.xz 004556659.td-b3lyp_6-31g+(d).inp 004556659.td-b3lyp_6-31g+(d).log.xz

004556659.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556659.td-b3lyp_6-31+g(d).gjf (generated)

004556659.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556659.mol 004556659.PUBCHEM 004556659.mol (via Jmol)
004556740.b3lyp_6-31g(d).inp

004556740.b3lyp_6-31g(d).qchem.inp (generated)

004556740.b3lyp_6-31g(d).gjf (generated)

004556740.b3lyp_6-31g(d).firefly.inp (generated)

004556740.b3lyp_6-31g(d).smash.inp (generated)

004556740.b3lyp_6-31g(d).nwchem.inp (generated) 004556740.b3lyp_6-31g(d).log.xz 004556740.td-b3lyp_6-31g+(d).inp 004556740.td-b3lyp_6-31g+(d).log.xz

004556740.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556740.td-b3lyp_6-31+g(d).gjf (generated)

004556740.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556740.mol 004556740.PUBCHEM 004556740.mol (via Jmol)
004556757.b3lyp_6-31g(d).inp

004556757.b3lyp_6-31g(d).qchem.inp (generated)

004556757.b3lyp_6-31g(d).gjf (generated)

004556757.b3lyp_6-31g(d).firefly.inp (generated)

004556757.b3lyp_6-31g(d).smash.inp (generated)

004556757.b3lyp_6-31g(d).nwchem.inp (generated) 004556757.b3lyp_6-31g(d).log.xz 004556757.td-b3lyp_6-31g+(d).inp 004556757.td-b3lyp_6-31g+(d).log.xz

004556757.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556757.td-b3lyp_6-31+g(d).gjf (generated)

004556757.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556757.mol 004556757.PUBCHEM 004556757.mol (via Jmol)
004556793.b3lyp_6-31g(d).inp

004556793.b3lyp_6-31g(d).qchem.inp (generated)

004556793.b3lyp_6-31g(d).gjf (generated)

004556793.b3lyp_6-31g(d).firefly.inp (generated)

004556793.b3lyp_6-31g(d).smash.inp (generated)

004556793.b3lyp_6-31g(d).nwchem.inp (generated) 004556793.b3lyp_6-31g(d).log.xz 004556793.td-b3lyp_6-31g+(d).inp 004556793.td-b3lyp_6-31g+(d).log.xz

004556793.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556793.td-b3lyp_6-31+g(d).gjf (generated)

004556793.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556793.mol 004556793.PUBCHEM 004556793.mol (via Jmol)
004556823.b3lyp_6-31g(d).inp

004556823.b3lyp_6-31g(d).qchem.inp (generated)

004556823.b3lyp_6-31g(d).gjf (generated)

004556823.b3lyp_6-31g(d).firefly.inp (generated)

004556823.b3lyp_6-31g(d).smash.inp (generated)

004556823.b3lyp_6-31g(d).nwchem.inp (generated) 004556823.b3lyp_6-31g(d).log.xz 004556823.td-b3lyp_6-31g+(d).inp 004556823.td-b3lyp_6-31g+(d).log.xz

004556823.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556823.td-b3lyp_6-31+g(d).gjf (generated)

004556823.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556823.mol 004556823.PUBCHEM 004556823.mol (via Jmol)
004556859.b3lyp_6-31g(d).inp

004556859.b3lyp_6-31g(d).qchem.inp (generated)

004556859.b3lyp_6-31g(d).gjf (generated)

004556859.b3lyp_6-31g(d).firefly.inp (generated)

004556859.b3lyp_6-31g(d).smash.inp (generated)

004556859.b3lyp_6-31g(d).nwchem.inp (generated) 004556859.b3lyp_6-31g(d).log.xz 004556859.td-b3lyp_6-31g+(d).inp 004556859.td-b3lyp_6-31g+(d).log.xz

004556859.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556859.td-b3lyp_6-31+g(d).gjf (generated)

004556859.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556859.mol 004556859.PUBCHEM 004556859.mol (via Jmol)
004556915.b3lyp_6-31g(d).inp

004556915.b3lyp_6-31g(d).qchem.inp (generated)

004556915.b3lyp_6-31g(d).gjf (generated)

004556915.b3lyp_6-31g(d).firefly.inp (generated)

004556915.b3lyp_6-31g(d).smash.inp (generated)

004556915.b3lyp_6-31g(d).nwchem.inp (generated) 004556915.b3lyp_6-31g(d).log.xz 004556915.td-b3lyp_6-31g+(d).inp 004556915.td-b3lyp_6-31g+(d).log.xz

004556915.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556915.td-b3lyp_6-31+g(d).gjf (generated)

004556915.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556915.mol 004556915.PUBCHEM 004556915.mol (via Jmol)
004556917.b3lyp_6-31g(d).inp

004556917.b3lyp_6-31g(d).qchem.inp (generated)

004556917.b3lyp_6-31g(d).gjf (generated)

004556917.b3lyp_6-31g(d).firefly.inp (generated)

004556917.b3lyp_6-31g(d).smash.inp (generated)

004556917.b3lyp_6-31g(d).nwchem.inp (generated) 004556917.b3lyp_6-31g(d).log.xz 004556917.td-b3lyp_6-31g+(d).inp 004556917.td-b3lyp_6-31g+(d).log.xz

004556917.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556917.td-b3lyp_6-31+g(d).gjf (generated)

004556917.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556917.mol 004556917.PUBCHEM 004556917.mol (via Jmol)
004556918.b3lyp_6-31g(d).inp

004556918.b3lyp_6-31g(d).qchem.inp (generated)

004556918.b3lyp_6-31g(d).gjf (generated)

004556918.b3lyp_6-31g(d).firefly.inp (generated)

004556918.b3lyp_6-31g(d).smash.inp (generated)

004556918.b3lyp_6-31g(d).nwchem.inp (generated) 004556918.b3lyp_6-31g(d).log.xz 004556918.td-b3lyp_6-31g+(d).inp 004556918.td-b3lyp_6-31g+(d).log.xz

004556918.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556918.td-b3lyp_6-31+g(d).gjf (generated)

004556918.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556918.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556918.mol 004556918.PUBCHEM 004556918.mol (via Jmol)
004556946.b3lyp_6-31g(d).inp

004556946.b3lyp_6-31g(d).qchem.inp (generated)

004556946.b3lyp_6-31g(d).gjf (generated)

004556946.b3lyp_6-31g(d).firefly.inp (generated)

004556946.b3lyp_6-31g(d).smash.inp (generated)

004556946.b3lyp_6-31g(d).nwchem.inp (generated) 004556946.b3lyp_6-31g(d).log.xz 004556946.td-b3lyp_6-31g+(d).inp 004556946.td-b3lyp_6-31g+(d).log.xz

004556946.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556946.td-b3lyp_6-31+g(d).gjf (generated)

004556946.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556946.mol 004556946.PUBCHEM 004556946.mol (via Jmol)
004556976.b3lyp_6-31g(d).inp

004556976.b3lyp_6-31g(d).qchem.inp (generated)

004556976.b3lyp_6-31g(d).gjf (generated)

004556976.b3lyp_6-31g(d).firefly.inp (generated)

004556976.b3lyp_6-31g(d).smash.inp (generated)

004556976.b3lyp_6-31g(d).nwchem.inp (generated) 004556976.b3lyp_6-31g(d).log.xz 004556976.td-b3lyp_6-31g+(d).inp 004556976.td-b3lyp_6-31g+(d).log.xz

004556976.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556976.td-b3lyp_6-31+g(d).gjf (generated)

004556976.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556976.mol 004556976.PUBCHEM 004556976.mol (via Jmol)
004556982.b3lyp_6-31g(d).inp

004556982.b3lyp_6-31g(d).qchem.inp (generated)

004556982.b3lyp_6-31g(d).gjf (generated)

004556982.b3lyp_6-31g(d).firefly.inp (generated)

004556982.b3lyp_6-31g(d).smash.inp (generated)

004556982.b3lyp_6-31g(d).nwchem.inp (generated) 004556982.b3lyp_6-31g(d).log.xz 004556982.td-b3lyp_6-31g+(d).inp 004556982.td-b3lyp_6-31g+(d).log.xz

004556982.td-b3lyp_6-31+g(d).qchem.inp (generated)

004556982.td-b3lyp_6-31+g(d).gjf (generated)

004556982.td-b3lyp_6-31+g(d).firefly.inp (generated)

004556982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004556982.mol 004556982.PUBCHEM 004556982.mol (via Jmol)
004557183.b3lyp_6-31g(d).inp

004557183.b3lyp_6-31g(d).qchem.inp (generated)

004557183.b3lyp_6-31g(d).gjf (generated)

004557183.b3lyp_6-31g(d).firefly.inp (generated)

004557183.b3lyp_6-31g(d).smash.inp (generated)

004557183.b3lyp_6-31g(d).nwchem.inp (generated) 004557183.b3lyp_6-31g(d).log.xz 004557183.td-b3lyp_6-31g+(d).inp 004557183.td-b3lyp_6-31g+(d).log.xz

004557183.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557183.td-b3lyp_6-31+g(d).gjf (generated)

004557183.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557183.mol 004557183.PUBCHEM 004557183.mol (via Jmol)
004557208.b3lyp_6-31g(d).inp

004557208.b3lyp_6-31g(d).qchem.inp (generated)

004557208.b3lyp_6-31g(d).gjf (generated)

004557208.b3lyp_6-31g(d).firefly.inp (generated)

004557208.b3lyp_6-31g(d).smash.inp (generated)

004557208.b3lyp_6-31g(d).nwchem.inp (generated) 004557208.b3lyp_6-31g(d).log.xz 004557208.td-b3lyp_6-31g+(d).inp 004557208.td-b3lyp_6-31g+(d).log.xz

004557208.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557208.td-b3lyp_6-31+g(d).gjf (generated)

004557208.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557208.mol 004557208.PUBCHEM 004557208.mol (via Jmol)
004557237.b3lyp_6-31g(d).inp

004557237.b3lyp_6-31g(d).qchem.inp (generated)

004557237.b3lyp_6-31g(d).gjf (generated)

004557237.b3lyp_6-31g(d).firefly.inp (generated)

004557237.b3lyp_6-31g(d).smash.inp (generated)

004557237.b3lyp_6-31g(d).nwchem.inp (generated) 004557237.b3lyp_6-31g(d).log.xz 004557237.td-b3lyp_6-31g+(d).inp 004557237.td-b3lyp_6-31g+(d).log.xz

004557237.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557237.td-b3lyp_6-31+g(d).gjf (generated)

004557237.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557237.mol 004557237.PUBCHEM 004557237.mol (via Jmol)
004557290.b3lyp_6-31g(d).inp

004557290.b3lyp_6-31g(d).qchem.inp (generated)

004557290.b3lyp_6-31g(d).gjf (generated)

004557290.b3lyp_6-31g(d).firefly.inp (generated)

004557290.b3lyp_6-31g(d).smash.inp (generated)

004557290.b3lyp_6-31g(d).nwchem.inp (generated) 004557290.b3lyp_6-31g(d).log.xz 004557290.td-b3lyp_6-31g+(d).inp 004557290.td-b3lyp_6-31g+(d).log.xz

004557290.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557290.td-b3lyp_6-31+g(d).gjf (generated)

004557290.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557290.mol 004557290.PUBCHEM 004557290.mol (via Jmol)
004557329.b3lyp_6-31g(d).inp

004557329.b3lyp_6-31g(d).qchem.inp (generated)

004557329.b3lyp_6-31g(d).gjf (generated)

004557329.b3lyp_6-31g(d).firefly.inp (generated)

004557329.b3lyp_6-31g(d).smash.inp (generated)

004557329.b3lyp_6-31g(d).nwchem.inp (generated) 004557329.b3lyp_6-31g(d).log.xz 004557329.mol 004557329.PUBCHEM 004557329.mol (via Jmol)
004557366.b3lyp_6-31g(d).inp

004557366.b3lyp_6-31g(d).qchem.inp (generated)

004557366.b3lyp_6-31g(d).gjf (generated)

004557366.b3lyp_6-31g(d).firefly.inp (generated)

004557366.b3lyp_6-31g(d).smash.inp (generated)

004557366.b3lyp_6-31g(d).nwchem.inp (generated) 004557366.b3lyp_6-31g(d).log.xz 004557366.td-b3lyp_6-31g+(d).inp 004557366.td-b3lyp_6-31g+(d).log.xz

004557366.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557366.td-b3lyp_6-31+g(d).gjf (generated)

004557366.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557366.mol 004557366.PUBCHEM 004557366.mol (via Jmol)
004557368.b3lyp_6-31g(d).inp

004557368.b3lyp_6-31g(d).qchem.inp (generated)

004557368.b3lyp_6-31g(d).gjf (generated)

004557368.b3lyp_6-31g(d).firefly.inp (generated)

004557368.b3lyp_6-31g(d).smash.inp (generated)

004557368.b3lyp_6-31g(d).nwchem.inp (generated) 004557368.b3lyp_6-31g(d).log.xz 004557368.mol 004557368.PUBCHEM 004557368.mol (via Jmol)
004557369.b3lyp_6-31g(d).inp

004557369.b3lyp_6-31g(d).qchem.inp (generated)

004557369.b3lyp_6-31g(d).gjf (generated)

004557369.b3lyp_6-31g(d).firefly.inp (generated)

004557369.b3lyp_6-31g(d).smash.inp (generated)

004557369.b3lyp_6-31g(d).nwchem.inp (generated) 004557369.b3lyp_6-31g(d).log.xz 004557369.td-b3lyp_6-31g+(d).inp 004557369.td-b3lyp_6-31g+(d).log.xz

004557369.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557369.td-b3lyp_6-31+g(d).gjf (generated)

004557369.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557369.mol 004557369.PUBCHEM 004557369.mol (via Jmol)
004557389.b3lyp_6-31g(d).inp

004557389.b3lyp_6-31g(d).qchem.inp (generated)

004557389.b3lyp_6-31g(d).gjf (generated)

004557389.b3lyp_6-31g(d).firefly.inp (generated)

004557389.b3lyp_6-31g(d).smash.inp (generated)

004557389.b3lyp_6-31g(d).nwchem.inp (generated) 004557389.b3lyp_6-31g(d).log.xz 004557389.td-b3lyp_6-31g+(d).inp 004557389.td-b3lyp_6-31g+(d).log.xz

004557389.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557389.td-b3lyp_6-31+g(d).gjf (generated)

004557389.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557389.mol 004557389.PUBCHEM 004557389.mol (via Jmol)
004557394.b3lyp_6-31g(d).inp

004557394.b3lyp_6-31g(d).qchem.inp (generated)

004557394.b3lyp_6-31g(d).gjf (generated)

004557394.b3lyp_6-31g(d).firefly.inp (generated)

004557394.b3lyp_6-31g(d).smash.inp (generated)

004557394.b3lyp_6-31g(d).nwchem.inp (generated) 004557394.b3lyp_6-31g(d).log.xz 004557394.td-b3lyp_6-31g+(d).inp 004557394.td-b3lyp_6-31g+(d).log.xz

004557394.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557394.td-b3lyp_6-31+g(d).gjf (generated)

004557394.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557394.mol 004557394.PUBCHEM 004557394.mol (via Jmol)
004557422.b3lyp_6-31g(d).inp

004557422.b3lyp_6-31g(d).qchem.inp (generated)

004557422.b3lyp_6-31g(d).gjf (generated)

004557422.b3lyp_6-31g(d).firefly.inp (generated)

004557422.b3lyp_6-31g(d).smash.inp (generated)

004557422.b3lyp_6-31g(d).nwchem.inp (generated) 004557422.b3lyp_6-31g(d).log.xz 004557422.td-b3lyp_6-31g+(d).inp 004557422.td-b3lyp_6-31g+(d).log.xz

004557422.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557422.td-b3lyp_6-31+g(d).gjf (generated)

004557422.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557422.mol 004557422.PUBCHEM 004557422.mol (via Jmol)
004557472.b3lyp_6-31g(d).inp

004557472.b3lyp_6-31g(d).qchem.inp (generated)

004557472.b3lyp_6-31g(d).gjf (generated)

004557472.b3lyp_6-31g(d).firefly.inp (generated)

004557472.b3lyp_6-31g(d).smash.inp (generated)

004557472.b3lyp_6-31g(d).nwchem.inp (generated) 004557472.b3lyp_6-31g(d).log.xz 004557472.td-b3lyp_6-31g+(d).inp 004557472.td-b3lyp_6-31g+(d).log.xz

004557472.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557472.td-b3lyp_6-31+g(d).gjf (generated)

004557472.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557472.mol 004557472.PUBCHEM 004557472.mol (via Jmol)
004557491.b3lyp_6-31g(d).inp

004557491.b3lyp_6-31g(d).qchem.inp (generated)

004557491.b3lyp_6-31g(d).gjf (generated)

004557491.b3lyp_6-31g(d).firefly.inp (generated)

004557491.b3lyp_6-31g(d).smash.inp (generated)

004557491.b3lyp_6-31g(d).nwchem.inp (generated) 004557491.b3lyp_6-31g(d).log.xz 004557491.mol 004557491.PUBCHEM 004557491.mol (via Jmol)
004557492.b3lyp_6-31g(d).inp

004557492.b3lyp_6-31g(d).qchem.inp (generated)

004557492.b3lyp_6-31g(d).gjf (generated)

004557492.b3lyp_6-31g(d).firefly.inp (generated)

004557492.b3lyp_6-31g(d).smash.inp (generated)

004557492.b3lyp_6-31g(d).nwchem.inp (generated) 004557492.b3lyp_6-31g(d).log.xz 004557492.td-b3lyp_6-31g+(d).inp 004557492.td-b3lyp_6-31g+(d).log.xz

004557492.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557492.td-b3lyp_6-31+g(d).gjf (generated)

004557492.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557492.mol 004557492.PUBCHEM 004557492.mol (via Jmol)
004557494.b3lyp_6-31g(d).inp

004557494.b3lyp_6-31g(d).qchem.inp (generated)

004557494.b3lyp_6-31g(d).gjf (generated)

004557494.b3lyp_6-31g(d).firefly.inp (generated)

004557494.b3lyp_6-31g(d).smash.inp (generated)

004557494.b3lyp_6-31g(d).nwchem.inp (generated) 004557494.b3lyp_6-31g(d).log.xz 004557494.td-b3lyp_6-31g+(d).inp 004557494.td-b3lyp_6-31g+(d).log.xz

004557494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557494.td-b3lyp_6-31+g(d).gjf (generated)

004557494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557494.mol 004557494.PUBCHEM 004557494.mol (via Jmol)
004557516.b3lyp_6-31g(d).inp

004557516.b3lyp_6-31g(d).qchem.inp (generated)

004557516.b3lyp_6-31g(d).gjf (generated)

004557516.b3lyp_6-31g(d).firefly.inp (generated)

004557516.b3lyp_6-31g(d).smash.inp (generated)

004557516.b3lyp_6-31g(d).nwchem.inp (generated) 004557516.b3lyp_6-31g(d).log.xz 004557516.td-b3lyp_6-31g+(d).inp 004557516.td-b3lyp_6-31g+(d).log.xz

004557516.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557516.td-b3lyp_6-31+g(d).gjf (generated)

004557516.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557516.mol 004557516.PUBCHEM 004557516.mol (via Jmol)
004557519.b3lyp_6-31g(d).inp

004557519.b3lyp_6-31g(d).qchem.inp (generated)

004557519.b3lyp_6-31g(d).gjf (generated)

004557519.b3lyp_6-31g(d).firefly.inp (generated)

004557519.b3lyp_6-31g(d).smash.inp (generated)

004557519.b3lyp_6-31g(d).nwchem.inp (generated) 004557519.b3lyp_6-31g(d).log.xz 004557519.mol 004557519.PUBCHEM 004557519.mol (via Jmol)
004557549.b3lyp_6-31g(d).inp

004557549.b3lyp_6-31g(d).qchem.inp (generated)

004557549.b3lyp_6-31g(d).gjf (generated)

004557549.b3lyp_6-31g(d).firefly.inp (generated)

004557549.b3lyp_6-31g(d).smash.inp (generated)

004557549.b3lyp_6-31g(d).nwchem.inp (generated) 004557549.b3lyp_6-31g(d).log.xz 004557549.td-b3lyp_6-31g+(d).inp 004557549.td-b3lyp_6-31g+(d).log.xz

004557549.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557549.td-b3lyp_6-31+g(d).gjf (generated)

004557549.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557549.mol 004557549.PUBCHEM 004557549.mol (via Jmol)
004557563.b3lyp_6-31g(d).inp

004557563.b3lyp_6-31g(d).qchem.inp (generated)

004557563.b3lyp_6-31g(d).gjf (generated)

004557563.b3lyp_6-31g(d).firefly.inp (generated)

004557563.b3lyp_6-31g(d).smash.inp (generated)

004557563.b3lyp_6-31g(d).nwchem.inp (generated) 004557563.b3lyp_6-31g(d).log.xz 004557563.mol 004557563.PUBCHEM 004557563.mol (via Jmol)
004557565.b3lyp_6-31g(d).inp

004557565.b3lyp_6-31g(d).qchem.inp (generated)

004557565.b3lyp_6-31g(d).gjf (generated)

004557565.b3lyp_6-31g(d).firefly.inp (generated)

004557565.b3lyp_6-31g(d).smash.inp (generated)

004557565.b3lyp_6-31g(d).nwchem.inp (generated) 004557565.b3lyp_6-31g(d).log.xz 004557565.td-b3lyp_6-31g+(d).inp 004557565.td-b3lyp_6-31g+(d).log.xz

004557565.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557565.td-b3lyp_6-31+g(d).gjf (generated)

004557565.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557565.mol 004557565.PUBCHEM 004557565.mol (via Jmol)
004557566.b3lyp_6-31g(d).inp

004557566.b3lyp_6-31g(d).qchem.inp (generated)

004557566.b3lyp_6-31g(d).gjf (generated)

004557566.b3lyp_6-31g(d).firefly.inp (generated)

004557566.b3lyp_6-31g(d).smash.inp (generated)

004557566.b3lyp_6-31g(d).nwchem.inp (generated) 004557566.b3lyp_6-31g(d).log.xz 004557566.td-b3lyp_6-31g+(d).inp 004557566.td-b3lyp_6-31g+(d).log.xz

004557566.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557566.td-b3lyp_6-31+g(d).gjf (generated)

004557566.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557566.mol 004557566.PUBCHEM 004557566.mol (via Jmol)
004557570.b3lyp_6-31g(d).inp

004557570.b3lyp_6-31g(d).qchem.inp (generated)

004557570.b3lyp_6-31g(d).gjf (generated)

004557570.b3lyp_6-31g(d).firefly.inp (generated)

004557570.b3lyp_6-31g(d).smash.inp (generated)

004557570.b3lyp_6-31g(d).nwchem.inp (generated) 004557570.b3lyp_6-31g(d).log.xz 004557570.td-b3lyp_6-31g+(d).inp 004557570.td-b3lyp_6-31g+(d).log.xz

004557570.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557570.td-b3lyp_6-31+g(d).gjf (generated)

004557570.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557570.mol 004557570.PUBCHEM 004557570.mol (via Jmol)
004557573.b3lyp_6-31g(d).inp

004557573.b3lyp_6-31g(d).qchem.inp (generated)

004557573.b3lyp_6-31g(d).gjf (generated)

004557573.b3lyp_6-31g(d).firefly.inp (generated)

004557573.b3lyp_6-31g(d).smash.inp (generated)

004557573.b3lyp_6-31g(d).nwchem.inp (generated) 004557573.b3lyp_6-31g(d).log.xz 004557573.td-b3lyp_6-31g+(d).inp 004557573.td-b3lyp_6-31g+(d).log.xz

004557573.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557573.td-b3lyp_6-31+g(d).gjf (generated)

004557573.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557573.mol 004557573.PUBCHEM 004557573.mol (via Jmol)
004557583.b3lyp_6-31g(d).inp

004557583.b3lyp_6-31g(d).qchem.inp (generated)

004557583.b3lyp_6-31g(d).gjf (generated)

004557583.b3lyp_6-31g(d).firefly.inp (generated)

004557583.b3lyp_6-31g(d).smash.inp (generated)

004557583.b3lyp_6-31g(d).nwchem.inp (generated) 004557583.b3lyp_6-31g(d).log.xz 004557583.td-b3lyp_6-31g+(d).inp 004557583.td-b3lyp_6-31g+(d).log.xz

004557583.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557583.td-b3lyp_6-31+g(d).gjf (generated)

004557583.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557583.mol 004557583.PUBCHEM 004557583.mol (via Jmol)
004557596.b3lyp_6-31g(d).inp

004557596.b3lyp_6-31g(d).qchem.inp (generated)

004557596.b3lyp_6-31g(d).gjf (generated)

004557596.b3lyp_6-31g(d).firefly.inp (generated)

004557596.b3lyp_6-31g(d).smash.inp (generated)

004557596.b3lyp_6-31g(d).nwchem.inp (generated) 004557596.b3lyp_6-31g(d).log.xz 004557596.td-b3lyp_6-31g+(d).inp 004557596.td-b3lyp_6-31g+(d).log.xz

004557596.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557596.td-b3lyp_6-31+g(d).gjf (generated)

004557596.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557596.mol 004557596.PUBCHEM 004557596.mol (via Jmol)
004557599.b3lyp_6-31g(d).inp

004557599.b3lyp_6-31g(d).qchem.inp (generated)

004557599.b3lyp_6-31g(d).gjf (generated)

004557599.b3lyp_6-31g(d).firefly.inp (generated)

004557599.b3lyp_6-31g(d).smash.inp (generated)

004557599.b3lyp_6-31g(d).nwchem.inp (generated) 004557599.b3lyp_6-31g(d).log.xz 004557599.td-b3lyp_6-31g+(d).inp 004557599.td-b3lyp_6-31g+(d).log.xz

004557599.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557599.td-b3lyp_6-31+g(d).gjf (generated)

004557599.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557599.mol 004557599.PUBCHEM 004557599.mol (via Jmol)
004557600.b3lyp_6-31g(d).inp

004557600.b3lyp_6-31g(d).qchem.inp (generated)

004557600.b3lyp_6-31g(d).gjf (generated)

004557600.b3lyp_6-31g(d).firefly.inp (generated)

004557600.b3lyp_6-31g(d).smash.inp (generated)

004557600.b3lyp_6-31g(d).nwchem.inp (generated) 004557600.b3lyp_6-31g(d).log.xz 004557600.mol 004557600.PUBCHEM 004557600.mol (via Jmol)
004557670.b3lyp_6-31g(d).inp

004557670.b3lyp_6-31g(d).qchem.inp (generated)

004557670.b3lyp_6-31g(d).gjf (generated)

004557670.b3lyp_6-31g(d).firefly.inp (generated)

004557670.b3lyp_6-31g(d).smash.inp (generated)

004557670.b3lyp_6-31g(d).nwchem.inp (generated) 004557670.b3lyp_6-31g(d).log.xz 004557670.td-b3lyp_6-31g+(d).inp 004557670.td-b3lyp_6-31g+(d).log.xz

004557670.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557670.td-b3lyp_6-31+g(d).gjf (generated)

004557670.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557670.mol 004557670.PUBCHEM 004557670.mol (via Jmol)
004557691.b3lyp_6-31g(d).inp

004557691.b3lyp_6-31g(d).qchem.inp (generated)

004557691.b3lyp_6-31g(d).gjf (generated)

004557691.b3lyp_6-31g(d).firefly.inp (generated)

004557691.b3lyp_6-31g(d).smash.inp (generated)

004557691.b3lyp_6-31g(d).nwchem.inp (generated) 004557691.b3lyp_6-31g(d).log.xz 004557691.td-b3lyp_6-31g+(d).inp 004557691.td-b3lyp_6-31g+(d).log.xz

004557691.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557691.td-b3lyp_6-31+g(d).gjf (generated)

004557691.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557691.mol 004557691.PUBCHEM 004557691.mol (via Jmol)
004557762.b3lyp_6-31g(d).inp

004557762.b3lyp_6-31g(d).qchem.inp (generated)

004557762.b3lyp_6-31g(d).gjf (generated)

004557762.b3lyp_6-31g(d).firefly.inp (generated)

004557762.b3lyp_6-31g(d).smash.inp (generated)

004557762.b3lyp_6-31g(d).nwchem.inp (generated) 004557762.b3lyp_6-31g(d).log.xz 004557762.td-b3lyp_6-31g+(d).inp 004557762.td-b3lyp_6-31g+(d).log.xz

004557762.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557762.td-b3lyp_6-31+g(d).gjf (generated)

004557762.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557762.mol 004557762.PUBCHEM 004557762.mol (via Jmol)
004557788.b3lyp_6-31g(d).inp

004557788.b3lyp_6-31g(d).qchem.inp (generated)

004557788.b3lyp_6-31g(d).gjf (generated)

004557788.b3lyp_6-31g(d).firefly.inp (generated)

004557788.b3lyp_6-31g(d).smash.inp (generated)

004557788.b3lyp_6-31g(d).nwchem.inp (generated) 004557788.b3lyp_6-31g(d).log.xz 004557788.td-b3lyp_6-31g+(d).inp 004557788.td-b3lyp_6-31g+(d).log.xz

004557788.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557788.td-b3lyp_6-31+g(d).gjf (generated)

004557788.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557788.mol 004557788.PUBCHEM 004557788.mol (via Jmol)
004557789.b3lyp_6-31g(d).inp

004557789.b3lyp_6-31g(d).qchem.inp (generated)

004557789.b3lyp_6-31g(d).gjf (generated)

004557789.b3lyp_6-31g(d).firefly.inp (generated)

004557789.b3lyp_6-31g(d).smash.inp (generated)

004557789.b3lyp_6-31g(d).nwchem.inp (generated) 004557789.b3lyp_6-31g(d).log.xz 004557789.td-b3lyp_6-31g+(d).inp 004557789.td-b3lyp_6-31g+(d).log.xz

004557789.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557789.td-b3lyp_6-31+g(d).gjf (generated)

004557789.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557789.mol 004557789.PUBCHEM 004557789.mol (via Jmol)
004557829.b3lyp_6-31g(d).inp

004557829.b3lyp_6-31g(d).qchem.inp (generated)

004557829.b3lyp_6-31g(d).gjf (generated)

004557829.b3lyp_6-31g(d).firefly.inp (generated)

004557829.b3lyp_6-31g(d).smash.inp (generated)

004557829.b3lyp_6-31g(d).nwchem.inp (generated) 004557829.b3lyp_6-31g(d).log.xz 004557829.td-b3lyp_6-31g+(d).inp 004557829.td-b3lyp_6-31g+(d).log.xz

004557829.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557829.td-b3lyp_6-31+g(d).gjf (generated)

004557829.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557829.mol 004557829.PUBCHEM 004557829.mol (via Jmol)
004557865.b3lyp_6-31g(d).inp

004557865.b3lyp_6-31g(d).qchem.inp (generated)

004557865.b3lyp_6-31g(d).gjf (generated)

004557865.b3lyp_6-31g(d).firefly.inp (generated)

004557865.b3lyp_6-31g(d).smash.inp (generated)

004557865.b3lyp_6-31g(d).nwchem.inp (generated) 004557865.b3lyp_6-31g(d).log.xz 004557865.td-b3lyp_6-31g+(d).inp 004557865.td-b3lyp_6-31g+(d).log.xz

004557865.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557865.td-b3lyp_6-31+g(d).gjf (generated)

004557865.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557865.mol 004557865.PUBCHEM 004557865.mol (via Jmol)
004557896.b3lyp_6-31g(d).inp

004557896.b3lyp_6-31g(d).qchem.inp (generated)

004557896.b3lyp_6-31g(d).gjf (generated)

004557896.b3lyp_6-31g(d).firefly.inp (generated)

004557896.b3lyp_6-31g(d).smash.inp (generated)

004557896.b3lyp_6-31g(d).nwchem.inp (generated) 004557896.b3lyp_6-31g(d).log.xz 004557896.td-b3lyp_6-31g+(d).inp 004557896.td-b3lyp_6-31g+(d).log.xz

004557896.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557896.td-b3lyp_6-31+g(d).gjf (generated)

004557896.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557896.mol 004557896.PUBCHEM 004557896.mol (via Jmol)
004557962.b3lyp_6-31g(d).inp

004557962.b3lyp_6-31g(d).qchem.inp (generated)

004557962.b3lyp_6-31g(d).gjf (generated)

004557962.b3lyp_6-31g(d).firefly.inp (generated)

004557962.b3lyp_6-31g(d).smash.inp (generated)

004557962.b3lyp_6-31g(d).nwchem.inp (generated) 004557962.b3lyp_6-31g(d).log.xz 004557962.td-b3lyp_6-31g+(d).inp 004557962.td-b3lyp_6-31g+(d).log.xz

004557962.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557962.td-b3lyp_6-31+g(d).gjf (generated)

004557962.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557962.mol 004557962.PUBCHEM 004557962.mol (via Jmol)
004557970.b3lyp_6-31g(d).inp

004557970.b3lyp_6-31g(d).qchem.inp (generated)

004557970.b3lyp_6-31g(d).gjf (generated)

004557970.b3lyp_6-31g(d).firefly.inp (generated)

004557970.b3lyp_6-31g(d).smash.inp (generated)

004557970.b3lyp_6-31g(d).nwchem.inp (generated) 004557970.b3lyp_6-31g(d).log.xz 004557970.td-b3lyp_6-31g+(d).inp 004557970.td-b3lyp_6-31g+(d).log.xz

004557970.td-b3lyp_6-31+g(d).qchem.inp (generated)

004557970.td-b3lyp_6-31+g(d).gjf (generated)

004557970.td-b3lyp_6-31+g(d).firefly.inp (generated)

004557970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004557970.mol 004557970.PUBCHEM 004557970.mol (via Jmol)
004558106.b3lyp_6-31g(d).inp

004558106.b3lyp_6-31g(d).qchem.inp (generated)

004558106.b3lyp_6-31g(d).gjf (generated)

004558106.b3lyp_6-31g(d).firefly.inp (generated)

004558106.b3lyp_6-31g(d).smash.inp (generated)

004558106.b3lyp_6-31g(d).nwchem.inp (generated) 004558106.b3lyp_6-31g(d).log.xz 004558106.td-b3lyp_6-31g+(d).inp 004558106.td-b3lyp_6-31g+(d).log.xz

004558106.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558106.td-b3lyp_6-31+g(d).gjf (generated)

004558106.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558106.mol 004558106.PUBCHEM 004558106.mol (via Jmol)
004558138.b3lyp_6-31g(d).inp

004558138.b3lyp_6-31g(d).qchem.inp (generated)

004558138.b3lyp_6-31g(d).gjf (generated)

004558138.b3lyp_6-31g(d).firefly.inp (generated)

004558138.b3lyp_6-31g(d).smash.inp (generated)

004558138.b3lyp_6-31g(d).nwchem.inp (generated) 004558138.b3lyp_6-31g(d).log.xz 004558138.td-b3lyp_6-31g+(d).inp 004558138.td-b3lyp_6-31g+(d).log.xz

004558138.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558138.td-b3lyp_6-31+g(d).gjf (generated)

004558138.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558138.mol 004558138.PUBCHEM 004558138.mol (via Jmol)
004558202.b3lyp_6-31g(d).inp

004558202.b3lyp_6-31g(d).qchem.inp (generated)

004558202.b3lyp_6-31g(d).gjf (generated)

004558202.b3lyp_6-31g(d).firefly.inp (generated)

004558202.b3lyp_6-31g(d).smash.inp (generated)

004558202.b3lyp_6-31g(d).nwchem.inp (generated) 004558202.b3lyp_6-31g(d).log.xz 004558202.td-b3lyp_6-31g+(d).inp 004558202.td-b3lyp_6-31g+(d).log.xz

004558202.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558202.td-b3lyp_6-31+g(d).gjf (generated)

004558202.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558202.mol 004558202.PUBCHEM 004558202.mol (via Jmol)
004558203.b3lyp_6-31g(d).inp

004558203.b3lyp_6-31g(d).qchem.inp (generated)

004558203.b3lyp_6-31g(d).gjf (generated)

004558203.b3lyp_6-31g(d).firefly.inp (generated)

004558203.b3lyp_6-31g(d).smash.inp (generated)

004558203.b3lyp_6-31g(d).nwchem.inp (generated) 004558203.b3lyp_6-31g(d).log.xz 004558203.td-b3lyp_6-31g+(d).inp 004558203.td-b3lyp_6-31g+(d).log.xz

004558203.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558203.td-b3lyp_6-31+g(d).gjf (generated)

004558203.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558203.mol 004558203.PUBCHEM 004558203.mol (via Jmol)
004558211.b3lyp_6-31g(d).inp

004558211.b3lyp_6-31g(d).qchem.inp (generated)

004558211.b3lyp_6-31g(d).gjf (generated)

004558211.b3lyp_6-31g(d).firefly.inp (generated)

004558211.b3lyp_6-31g(d).smash.inp (generated)

004558211.b3lyp_6-31g(d).nwchem.inp (generated) 004558211.b3lyp_6-31g(d).log.xz 004558211.td-b3lyp_6-31g+(d).inp 004558211.td-b3lyp_6-31g+(d).log.xz

004558211.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558211.td-b3lyp_6-31+g(d).gjf (generated)

004558211.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558211.mol 004558211.PUBCHEM 004558211.mol (via Jmol)
004558221.b3lyp_6-31g(d).inp

004558221.b3lyp_6-31g(d).qchem.inp (generated)

004558221.b3lyp_6-31g(d).gjf (generated)

004558221.b3lyp_6-31g(d).firefly.inp (generated)

004558221.b3lyp_6-31g(d).smash.inp (generated)

004558221.b3lyp_6-31g(d).nwchem.inp (generated) 004558221.b3lyp_6-31g(d).log.xz 004558221.td-b3lyp_6-31g+(d).inp 004558221.td-b3lyp_6-31g+(d).log.xz

004558221.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558221.td-b3lyp_6-31+g(d).gjf (generated)

004558221.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558221.mol 004558221.PUBCHEM 004558221.mol (via Jmol)
004558251.b3lyp_6-31g(d).inp

004558251.b3lyp_6-31g(d).qchem.inp (generated)

004558251.b3lyp_6-31g(d).gjf (generated)

004558251.b3lyp_6-31g(d).firefly.inp (generated)

004558251.b3lyp_6-31g(d).smash.inp (generated)

004558251.b3lyp_6-31g(d).nwchem.inp (generated) 004558251.b3lyp_6-31g(d).log.xz 004558251.td-b3lyp_6-31g+(d).inp 004558251.td-b3lyp_6-31g+(d).log.xz

004558251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558251.td-b3lyp_6-31+g(d).gjf (generated)

004558251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558251.mol 004558251.PUBCHEM 004558251.mol (via Jmol)
004558303.b3lyp_6-31g(d).inp

004558303.b3lyp_6-31g(d).qchem.inp (generated)

004558303.b3lyp_6-31g(d).gjf (generated)

004558303.b3lyp_6-31g(d).firefly.inp (generated)

004558303.b3lyp_6-31g(d).smash.inp (generated)

004558303.b3lyp_6-31g(d).nwchem.inp (generated) 004558303.b3lyp_6-31g(d).log.xz 004558303.td-b3lyp_6-31g+(d).inp 004558303.td-b3lyp_6-31g+(d).log.xz

004558303.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558303.td-b3lyp_6-31+g(d).gjf (generated)

004558303.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558303.mol 004558303.PUBCHEM 004558303.mol (via Jmol)
004558333.b3lyp_6-31g(d).inp

004558333.b3lyp_6-31g(d).qchem.inp (generated)

004558333.b3lyp_6-31g(d).gjf (generated)

004558333.b3lyp_6-31g(d).firefly.inp (generated)

004558333.b3lyp_6-31g(d).smash.inp (generated)

004558333.b3lyp_6-31g(d).nwchem.inp (generated) 004558333.b3lyp_6-31g(d).log.xz 004558333.td-b3lyp_6-31g+(d).inp 004558333.td-b3lyp_6-31g+(d).log.xz

004558333.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558333.td-b3lyp_6-31+g(d).gjf (generated)

004558333.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558333.mol 004558333.PUBCHEM 004558333.mol (via Jmol)
004558355.b3lyp_6-31g(d).inp

004558355.b3lyp_6-31g(d).qchem.inp (generated)

004558355.b3lyp_6-31g(d).gjf (generated)

004558355.b3lyp_6-31g(d).firefly.inp (generated)

004558355.b3lyp_6-31g(d).smash.inp (generated)

004558355.b3lyp_6-31g(d).nwchem.inp (generated) 004558355.b3lyp_6-31g(d).log.xz 004558355.td-b3lyp_6-31g+(d).inp 004558355.td-b3lyp_6-31g+(d).log.xz

004558355.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558355.td-b3lyp_6-31+g(d).gjf (generated)

004558355.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558355.mol 004558355.PUBCHEM 004558355.mol (via Jmol)
004558363.b3lyp_6-31g(d).inp

004558363.b3lyp_6-31g(d).qchem.inp (generated)

004558363.b3lyp_6-31g(d).gjf (generated)

004558363.b3lyp_6-31g(d).firefly.inp (generated)

004558363.b3lyp_6-31g(d).smash.inp (generated)

004558363.b3lyp_6-31g(d).nwchem.inp (generated) 004558363.b3lyp_6-31g(d).log.xz 004558363.td-b3lyp_6-31g+(d).inp 004558363.td-b3lyp_6-31g+(d).log.xz

004558363.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558363.td-b3lyp_6-31+g(d).gjf (generated)

004558363.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558363.mol 004558363.PUBCHEM 004558363.mol (via Jmol)
004558441.b3lyp_6-31g(d).inp

004558441.b3lyp_6-31g(d).qchem.inp (generated)

004558441.b3lyp_6-31g(d).gjf (generated)

004558441.b3lyp_6-31g(d).firefly.inp (generated)

004558441.b3lyp_6-31g(d).smash.inp (generated)

004558441.b3lyp_6-31g(d).nwchem.inp (generated) 004558441.b3lyp_6-31g(d).log.xz 004558441.td-b3lyp_6-31g+(d).inp 004558441.td-b3lyp_6-31g+(d).log.xz

004558441.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558441.td-b3lyp_6-31+g(d).gjf (generated)

004558441.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558441.mol 004558441.PUBCHEM 004558441.mol (via Jmol)
004558458.b3lyp_6-31g(d).inp

004558458.b3lyp_6-31g(d).qchem.inp (generated)

004558458.b3lyp_6-31g(d).gjf (generated)

004558458.b3lyp_6-31g(d).firefly.inp (generated)

004558458.b3lyp_6-31g(d).smash.inp (generated)

004558458.b3lyp_6-31g(d).nwchem.inp (generated) 004558458.b3lyp_6-31g(d).log.xz 004558458.td-b3lyp_6-31g+(d).inp 004558458.td-b3lyp_6-31g+(d).log.xz

004558458.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558458.td-b3lyp_6-31+g(d).gjf (generated)

004558458.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558458.mol 004558458.PUBCHEM 004558458.mol (via Jmol)
004558472.b3lyp_6-31g(d).inp

004558472.b3lyp_6-31g(d).qchem.inp (generated)

004558472.b3lyp_6-31g(d).gjf (generated)

004558472.b3lyp_6-31g(d).firefly.inp (generated)

004558472.b3lyp_6-31g(d).smash.inp (generated)

004558472.b3lyp_6-31g(d).nwchem.inp (generated) 004558472.b3lyp_6-31g(d).log.xz 004558472.mol 004558472.PUBCHEM 004558472.mol (via Jmol)
004558473.b3lyp_6-31g(d).inp

004558473.b3lyp_6-31g(d).qchem.inp (generated)

004558473.b3lyp_6-31g(d).gjf (generated)

004558473.b3lyp_6-31g(d).firefly.inp (generated)

004558473.b3lyp_6-31g(d).smash.inp (generated)

004558473.b3lyp_6-31g(d).nwchem.inp (generated) 004558473.b3lyp_6-31g(d).log.xz 004558473.mol 004558473.PUBCHEM 004558473.mol (via Jmol)
004558530.b3lyp_6-31g(d).inp

004558530.b3lyp_6-31g(d).qchem.inp (generated)

004558530.b3lyp_6-31g(d).gjf (generated)

004558530.b3lyp_6-31g(d).firefly.inp (generated)

004558530.b3lyp_6-31g(d).smash.inp (generated)

004558530.b3lyp_6-31g(d).nwchem.inp (generated) 004558530.b3lyp_6-31g(d).log.xz 004558530.td-b3lyp_6-31g+(d).inp 004558530.td-b3lyp_6-31g+(d).log.xz

004558530.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558530.td-b3lyp_6-31+g(d).gjf (generated)

004558530.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558530.mol 004558530.PUBCHEM 004558530.mol (via Jmol)
004558590.b3lyp_6-31g(d).inp

004558590.b3lyp_6-31g(d).qchem.inp (generated)

004558590.b3lyp_6-31g(d).gjf (generated)

004558590.b3lyp_6-31g(d).firefly.inp (generated)

004558590.b3lyp_6-31g(d).smash.inp (generated)

004558590.b3lyp_6-31g(d).nwchem.inp (generated) 004558590.b3lyp_6-31g(d).log.xz 004558590.td-b3lyp_6-31g+(d).inp 004558590.td-b3lyp_6-31g+(d).log.xz

004558590.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558590.td-b3lyp_6-31+g(d).gjf (generated)

004558590.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558590.mol 004558590.PUBCHEM 004558590.mol (via Jmol)
004558603.b3lyp_6-31g(d).inp

004558603.b3lyp_6-31g(d).qchem.inp (generated)

004558603.b3lyp_6-31g(d).gjf (generated)

004558603.b3lyp_6-31g(d).firefly.inp (generated)

004558603.b3lyp_6-31g(d).smash.inp (generated)

004558603.b3lyp_6-31g(d).nwchem.inp (generated) 004558603.b3lyp_6-31g(d).log.xz 004558603.td-b3lyp_6-31g+(d).inp 004558603.td-b3lyp_6-31g+(d).log.xz

004558603.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558603.td-b3lyp_6-31+g(d).gjf (generated)

004558603.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558603.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558603.mol 004558603.PUBCHEM 004558603.mol (via Jmol)
004558651.b3lyp_6-31g(d).inp

004558651.b3lyp_6-31g(d).qchem.inp (generated)

004558651.b3lyp_6-31g(d).gjf (generated)

004558651.b3lyp_6-31g(d).firefly.inp (generated)

004558651.b3lyp_6-31g(d).smash.inp (generated)

004558651.b3lyp_6-31g(d).nwchem.inp (generated) 004558651.b3lyp_6-31g(d).log.xz 004558651.td-b3lyp_6-31g+(d).inp 004558651.td-b3lyp_6-31g+(d).log.xz

004558651.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558651.td-b3lyp_6-31+g(d).gjf (generated)

004558651.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558651.mol 004558651.PUBCHEM 004558651.mol (via Jmol)
004558720.b3lyp_6-31g(d).inp

004558720.b3lyp_6-31g(d).qchem.inp (generated)

004558720.b3lyp_6-31g(d).gjf (generated)

004558720.b3lyp_6-31g(d).firefly.inp (generated)

004558720.b3lyp_6-31g(d).smash.inp (generated)

004558720.b3lyp_6-31g(d).nwchem.inp (generated) 004558720.b3lyp_6-31g(d).log.xz 004558720.td-b3lyp_6-31g+(d).inp 004558720.td-b3lyp_6-31g+(d).log.xz

004558720.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558720.td-b3lyp_6-31+g(d).gjf (generated)

004558720.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558720.mol 004558720.PUBCHEM 004558720.mol (via Jmol)
004558721.b3lyp_6-31g(d).inp

004558721.b3lyp_6-31g(d).qchem.inp (generated)

004558721.b3lyp_6-31g(d).gjf (generated)

004558721.b3lyp_6-31g(d).firefly.inp (generated)

004558721.b3lyp_6-31g(d).smash.inp (generated)

004558721.b3lyp_6-31g(d).nwchem.inp (generated) 004558721.b3lyp_6-31g(d).log.xz 004558721.td-b3lyp_6-31g+(d).inp 004558721.td-b3lyp_6-31g+(d).log.xz

004558721.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558721.td-b3lyp_6-31+g(d).gjf (generated)

004558721.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558721.mol 004558721.PUBCHEM 004558721.mol (via Jmol)
004558722.b3lyp_6-31g(d).inp

004558722.b3lyp_6-31g(d).qchem.inp (generated)

004558722.b3lyp_6-31g(d).gjf (generated)

004558722.b3lyp_6-31g(d).firefly.inp (generated)

004558722.b3lyp_6-31g(d).smash.inp (generated)

004558722.b3lyp_6-31g(d).nwchem.inp (generated) 004558722.b3lyp_6-31g(d).log.xz 004558722.td-b3lyp_6-31g+(d).inp 004558722.td-b3lyp_6-31g+(d).log.xz

004558722.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558722.td-b3lyp_6-31+g(d).gjf (generated)

004558722.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558722.mol 004558722.PUBCHEM 004558722.mol (via Jmol)
004558737.b3lyp_6-31g(d).inp

004558737.b3lyp_6-31g(d).qchem.inp (generated)

004558737.b3lyp_6-31g(d).gjf (generated)

004558737.b3lyp_6-31g(d).firefly.inp (generated)

004558737.b3lyp_6-31g(d).smash.inp (generated)

004558737.b3lyp_6-31g(d).nwchem.inp (generated) 004558737.b3lyp_6-31g(d).log.xz 004558737.mol 004558737.PUBCHEM 004558737.mol (via Jmol)
004558811.b3lyp_6-31g(d).inp

004558811.b3lyp_6-31g(d).qchem.inp (generated)

004558811.b3lyp_6-31g(d).gjf (generated)

004558811.b3lyp_6-31g(d).firefly.inp (generated)

004558811.b3lyp_6-31g(d).smash.inp (generated)

004558811.b3lyp_6-31g(d).nwchem.inp (generated) 004558811.b3lyp_6-31g(d).log.xz 004558811.td-b3lyp_6-31g+(d).inp 004558811.td-b3lyp_6-31g+(d).log.xz

004558811.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558811.td-b3lyp_6-31+g(d).gjf (generated)

004558811.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558811.mol 004558811.PUBCHEM 004558811.mol (via Jmol)
004558884.b3lyp_6-31g(d).inp

004558884.b3lyp_6-31g(d).qchem.inp (generated)

004558884.b3lyp_6-31g(d).gjf (generated)

004558884.b3lyp_6-31g(d).firefly.inp (generated)

004558884.b3lyp_6-31g(d).smash.inp (generated)

004558884.b3lyp_6-31g(d).nwchem.inp (generated) 004558884.b3lyp_6-31g(d).log.xz 004558884.td-b3lyp_6-31g+(d).inp 004558884.td-b3lyp_6-31g+(d).log.xz

004558884.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558884.td-b3lyp_6-31+g(d).gjf (generated)

004558884.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558884.mol 004558884.PUBCHEM 004558884.mol (via Jmol)
004558885.b3lyp_6-31g(d).inp

004558885.b3lyp_6-31g(d).qchem.inp (generated)

004558885.b3lyp_6-31g(d).gjf (generated)

004558885.b3lyp_6-31g(d).firefly.inp (generated)

004558885.b3lyp_6-31g(d).smash.inp (generated)

004558885.b3lyp_6-31g(d).nwchem.inp (generated) 004558885.b3lyp_6-31g(d).log.xz 004558885.td-b3lyp_6-31g+(d).inp 004558885.td-b3lyp_6-31g+(d).log.xz

004558885.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558885.td-b3lyp_6-31+g(d).gjf (generated)

004558885.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558885.mol 004558885.PUBCHEM 004558885.mol (via Jmol)
004558902.b3lyp_6-31g(d).inp

004558902.b3lyp_6-31g(d).qchem.inp (generated)

004558902.b3lyp_6-31g(d).gjf (generated)

004558902.b3lyp_6-31g(d).firefly.inp (generated)

004558902.b3lyp_6-31g(d).smash.inp (generated)

004558902.b3lyp_6-31g(d).nwchem.inp (generated) 004558902.b3lyp_6-31g(d).log.xz 004558902.mol 004558902.PUBCHEM 004558902.mol (via Jmol)
004558908.b3lyp_6-31g(d).inp

004558908.b3lyp_6-31g(d).qchem.inp (generated)

004558908.b3lyp_6-31g(d).gjf (generated)

004558908.b3lyp_6-31g(d).firefly.inp (generated)

004558908.b3lyp_6-31g(d).smash.inp (generated)

004558908.b3lyp_6-31g(d).nwchem.inp (generated) 004558908.b3lyp_6-31g(d).log.xz 004558908.td-b3lyp_6-31g+(d).inp 004558908.td-b3lyp_6-31g+(d).log.xz

004558908.td-b3lyp_6-31+g(d).qchem.inp (generated)

004558908.td-b3lyp_6-31+g(d).gjf (generated)

004558908.td-b3lyp_6-31+g(d).firefly.inp (generated)

004558908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004558908.mol 004558908.PUBCHEM 004558908.mol (via Jmol)
004559100.b3lyp_6-31g(d).inp

004559100.b3lyp_6-31g(d).qchem.inp (generated)

004559100.b3lyp_6-31g(d).gjf (generated)

004559100.b3lyp_6-31g(d).firefly.inp (generated)

004559100.b3lyp_6-31g(d).smash.inp (generated)

004559100.b3lyp_6-31g(d).nwchem.inp (generated) 004559100.b3lyp_6-31g(d).log.xz 004559100.td-b3lyp_6-31g+(d).inp 004559100.td-b3lyp_6-31g+(d).log.xz

004559100.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559100.td-b3lyp_6-31+g(d).gjf (generated)

004559100.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559100.mol 004559100.PUBCHEM 004559100.mol (via Jmol)
004559150.b3lyp_6-31g(d).inp

004559150.b3lyp_6-31g(d).qchem.inp (generated)

004559150.b3lyp_6-31g(d).gjf (generated)

004559150.b3lyp_6-31g(d).firefly.inp (generated)

004559150.b3lyp_6-31g(d).smash.inp (generated)

004559150.b3lyp_6-31g(d).nwchem.inp (generated) 004559150.b3lyp_6-31g(d).log.xz 004559150.td-b3lyp_6-31g+(d).inp 004559150.td-b3lyp_6-31g+(d).log.xz

004559150.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559150.td-b3lyp_6-31+g(d).gjf (generated)

004559150.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559150.mol 004559150.PUBCHEM 004559150.mol (via Jmol)
004559151.b3lyp_6-31g(d).inp

004559151.b3lyp_6-31g(d).qchem.inp (generated)

004559151.b3lyp_6-31g(d).gjf (generated)

004559151.b3lyp_6-31g(d).firefly.inp (generated)

004559151.b3lyp_6-31g(d).smash.inp (generated)

004559151.b3lyp_6-31g(d).nwchem.inp (generated) 004559151.b3lyp_6-31g(d).log.xz 004559151.td-b3lyp_6-31g+(d).inp 004559151.td-b3lyp_6-31g+(d).log.xz

004559151.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559151.td-b3lyp_6-31+g(d).gjf (generated)

004559151.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559151.mol 004559151.PUBCHEM 004559151.mol (via Jmol)
004559190.b3lyp_6-31g(d).inp

004559190.b3lyp_6-31g(d).qchem.inp (generated)

004559190.b3lyp_6-31g(d).gjf (generated)

004559190.b3lyp_6-31g(d).firefly.inp (generated)

004559190.b3lyp_6-31g(d).smash.inp (generated)

004559190.b3lyp_6-31g(d).nwchem.inp (generated) 004559190.b3lyp_6-31g(d).log.xz 004559190.td-b3lyp_6-31g+(d).inp 004559190.td-b3lyp_6-31g+(d).log.xz

004559190.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559190.td-b3lyp_6-31+g(d).gjf (generated)

004559190.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559190.mol 004559190.PUBCHEM 004559190.mol (via Jmol)
004559207.b3lyp_6-31g(d).inp

004559207.b3lyp_6-31g(d).qchem.inp (generated)

004559207.b3lyp_6-31g(d).gjf (generated)

004559207.b3lyp_6-31g(d).firefly.inp (generated)

004559207.b3lyp_6-31g(d).smash.inp (generated)

004559207.b3lyp_6-31g(d).nwchem.inp (generated) 004559207.b3lyp_6-31g(d).log.xz 004559207.td-b3lyp_6-31g+(d).inp 004559207.td-b3lyp_6-31g+(d).log.xz

004559207.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559207.td-b3lyp_6-31+g(d).gjf (generated)

004559207.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559207.mol 004559207.PUBCHEM 004559207.mol (via Jmol)
004559251.b3lyp_6-31g(d).inp

004559251.b3lyp_6-31g(d).qchem.inp (generated)

004559251.b3lyp_6-31g(d).gjf (generated)

004559251.b3lyp_6-31g(d).firefly.inp (generated)

004559251.b3lyp_6-31g(d).smash.inp (generated)

004559251.b3lyp_6-31g(d).nwchem.inp (generated) 004559251.b3lyp_6-31g(d).log.xz 004559251.td-b3lyp_6-31g+(d).inp 004559251.td-b3lyp_6-31g+(d).log.xz

004559251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559251.td-b3lyp_6-31+g(d).gjf (generated)

004559251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559251.mol 004559251.PUBCHEM 004559251.mol (via Jmol)
004559256.b3lyp_6-31g(d).inp

004559256.b3lyp_6-31g(d).qchem.inp (generated)

004559256.b3lyp_6-31g(d).gjf (generated)

004559256.b3lyp_6-31g(d).firefly.inp (generated)

004559256.b3lyp_6-31g(d).smash.inp (generated)

004559256.b3lyp_6-31g(d).nwchem.inp (generated) 004559256.b3lyp_6-31g(d).log.xz 004559256.mol 004559256.PUBCHEM 004559256.mol (via Jmol)
004559276.b3lyp_6-31g(d).inp

004559276.b3lyp_6-31g(d).qchem.inp (generated)

004559276.b3lyp_6-31g(d).gjf (generated)

004559276.b3lyp_6-31g(d).firefly.inp (generated)

004559276.b3lyp_6-31g(d).smash.inp (generated)

004559276.b3lyp_6-31g(d).nwchem.inp (generated) 004559276.b3lyp_6-31g(d).log.xz 004559276.td-b3lyp_6-31g+(d).inp 004559276.td-b3lyp_6-31g+(d).log.xz

004559276.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559276.td-b3lyp_6-31+g(d).gjf (generated)

004559276.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559276.mol 004559276.PUBCHEM 004559276.mol (via Jmol)
004559328.b3lyp_6-31g(d).inp

004559328.b3lyp_6-31g(d).qchem.inp (generated)

004559328.b3lyp_6-31g(d).gjf (generated)

004559328.b3lyp_6-31g(d).firefly.inp (generated)

004559328.b3lyp_6-31g(d).smash.inp (generated)

004559328.b3lyp_6-31g(d).nwchem.inp (generated) 004559328.b3lyp_6-31g(d).log.xz 004559328.td-b3lyp_6-31g+(d).inp 004559328.td-b3lyp_6-31g+(d).log.xz

004559328.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559328.td-b3lyp_6-31+g(d).gjf (generated)

004559328.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559328.mol 004559328.PUBCHEM 004559328.mol (via Jmol)
004559334.b3lyp_6-31g(d).inp

004559334.b3lyp_6-31g(d).qchem.inp (generated)

004559334.b3lyp_6-31g(d).gjf (generated)

004559334.b3lyp_6-31g(d).firefly.inp (generated)

004559334.b3lyp_6-31g(d).smash.inp (generated)

004559334.b3lyp_6-31g(d).nwchem.inp (generated) 004559334.b3lyp_6-31g(d).log.xz 004559334.mol 004559334.PUBCHEM 004559334.mol (via Jmol)
004559410.b3lyp_6-31g(d).inp

004559410.b3lyp_6-31g(d).qchem.inp (generated)

004559410.b3lyp_6-31g(d).gjf (generated)

004559410.b3lyp_6-31g(d).firefly.inp (generated)

004559410.b3lyp_6-31g(d).smash.inp (generated)

004559410.b3lyp_6-31g(d).nwchem.inp (generated) 004559410.b3lyp_6-31g(d).log.xz 004559410.mol 004559410.PUBCHEM 004559410.mol (via Jmol)
004559411.b3lyp_6-31g(d).inp

004559411.b3lyp_6-31g(d).qchem.inp (generated)

004559411.b3lyp_6-31g(d).gjf (generated)

004559411.b3lyp_6-31g(d).firefly.inp (generated)

004559411.b3lyp_6-31g(d).smash.inp (generated)

004559411.b3lyp_6-31g(d).nwchem.inp (generated) 004559411.b3lyp_6-31g(d).log.xz 004559411.td-b3lyp_6-31g+(d).inp 004559411.td-b3lyp_6-31g+(d).log.xz

004559411.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559411.td-b3lyp_6-31+g(d).gjf (generated)

004559411.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559411.mol 004559411.PUBCHEM 004559411.mol (via Jmol)
004559414.b3lyp_6-31g(d).inp

004559414.b3lyp_6-31g(d).qchem.inp (generated)

004559414.b3lyp_6-31g(d).gjf (generated)

004559414.b3lyp_6-31g(d).firefly.inp (generated)

004559414.b3lyp_6-31g(d).smash.inp (generated)

004559414.b3lyp_6-31g(d).nwchem.inp (generated) 004559414.b3lyp_6-31g(d).log.xz 004559414.td-b3lyp_6-31g+(d).inp 004559414.td-b3lyp_6-31g+(d).log.xz

004559414.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559414.td-b3lyp_6-31+g(d).gjf (generated)

004559414.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559414.mol 004559414.PUBCHEM 004559414.mol (via Jmol)
004559417.b3lyp_6-31g(d).inp

004559417.b3lyp_6-31g(d).qchem.inp (generated)

004559417.b3lyp_6-31g(d).gjf (generated)

004559417.b3lyp_6-31g(d).firefly.inp (generated)

004559417.b3lyp_6-31g(d).smash.inp (generated)

004559417.b3lyp_6-31g(d).nwchem.inp (generated) 004559417.b3lyp_6-31g(d).log.xz 004559417.td-b3lyp_6-31g+(d).inp 004559417.td-b3lyp_6-31g+(d).log.xz

004559417.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559417.td-b3lyp_6-31+g(d).gjf (generated)

004559417.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559417.mol 004559417.PUBCHEM 004559417.mol (via Jmol)
004559480.b3lyp_6-31g(d).inp

004559480.b3lyp_6-31g(d).qchem.inp (generated)

004559480.b3lyp_6-31g(d).gjf (generated)

004559480.b3lyp_6-31g(d).firefly.inp (generated)

004559480.b3lyp_6-31g(d).smash.inp (generated)

004559480.b3lyp_6-31g(d).nwchem.inp (generated) 004559480.b3lyp_6-31g(d).log.xz 004559480.td-b3lyp_6-31g+(d).inp 004559480.td-b3lyp_6-31g+(d).log.xz

004559480.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559480.td-b3lyp_6-31+g(d).gjf (generated)

004559480.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559480.mol 004559480.PUBCHEM 004559480.mol (via Jmol)
004559481.b3lyp_6-31g(d).inp

004559481.b3lyp_6-31g(d).qchem.inp (generated)

004559481.b3lyp_6-31g(d).gjf (generated)

004559481.b3lyp_6-31g(d).firefly.inp (generated)

004559481.b3lyp_6-31g(d).smash.inp (generated)

004559481.b3lyp_6-31g(d).nwchem.inp (generated) 004559481.b3lyp_6-31g(d).log.xz 004559481.td-b3lyp_6-31g+(d).inp 004559481.td-b3lyp_6-31g+(d).log.xz

004559481.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559481.td-b3lyp_6-31+g(d).gjf (generated)

004559481.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559481.mol 004559481.PUBCHEM 004559481.mol (via Jmol)
004559482.b3lyp_6-31g(d).inp

004559482.b3lyp_6-31g(d).qchem.inp (generated)

004559482.b3lyp_6-31g(d).gjf (generated)

004559482.b3lyp_6-31g(d).firefly.inp (generated)

004559482.b3lyp_6-31g(d).smash.inp (generated)

004559482.b3lyp_6-31g(d).nwchem.inp (generated) 004559482.b3lyp_6-31g(d).log.xz 004559482.td-b3lyp_6-31g+(d).inp 004559482.td-b3lyp_6-31g+(d).log.xz

004559482.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559482.td-b3lyp_6-31+g(d).gjf (generated)

004559482.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559482.mol 004559482.PUBCHEM 004559482.mol (via Jmol)
004559494.b3lyp_6-31g(d).inp

004559494.b3lyp_6-31g(d).qchem.inp (generated)

004559494.b3lyp_6-31g(d).gjf (generated)

004559494.b3lyp_6-31g(d).firefly.inp (generated)

004559494.b3lyp_6-31g(d).smash.inp (generated)

004559494.b3lyp_6-31g(d).nwchem.inp (generated) 004559494.b3lyp_6-31g(d).log.xz 004559494.td-b3lyp_6-31g+(d).inp 004559494.td-b3lyp_6-31g+(d).log.xz

004559494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559494.td-b3lyp_6-31+g(d).gjf (generated)

004559494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559494.mol 004559494.PUBCHEM 004559494.mol (via Jmol)
004559545.b3lyp_6-31g(d).inp

004559545.b3lyp_6-31g(d).qchem.inp (generated)

004559545.b3lyp_6-31g(d).gjf (generated)

004559545.b3lyp_6-31g(d).firefly.inp (generated)

004559545.b3lyp_6-31g(d).smash.inp (generated)

004559545.b3lyp_6-31g(d).nwchem.inp (generated) 004559545.b3lyp_6-31g(d).log.xz 004559545.td-b3lyp_6-31g+(d).inp 004559545.td-b3lyp_6-31g+(d).log.xz

004559545.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559545.td-b3lyp_6-31+g(d).gjf (generated)

004559545.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559545.mol 004559545.PUBCHEM 004559545.mol (via Jmol)
004559546.b3lyp_6-31g(d).inp

004559546.b3lyp_6-31g(d).qchem.inp (generated)

004559546.b3lyp_6-31g(d).gjf (generated)

004559546.b3lyp_6-31g(d).firefly.inp (generated)

004559546.b3lyp_6-31g(d).smash.inp (generated)

004559546.b3lyp_6-31g(d).nwchem.inp (generated) 004559546.b3lyp_6-31g(d).log.xz 004559546.td-b3lyp_6-31g+(d).inp 004559546.td-b3lyp_6-31g+(d).log.xz

004559546.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559546.td-b3lyp_6-31+g(d).gjf (generated)

004559546.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559546.mol 004559546.PUBCHEM 004559546.mol (via Jmol)
004559549.b3lyp_6-31g(d).inp

004559549.b3lyp_6-31g(d).qchem.inp (generated)

004559549.b3lyp_6-31g(d).gjf (generated)

004559549.b3lyp_6-31g(d).firefly.inp (generated)

004559549.b3lyp_6-31g(d).smash.inp (generated)

004559549.b3lyp_6-31g(d).nwchem.inp (generated) 004559549.b3lyp_6-31g(d).log.xz 004559549.mol 004559549.PUBCHEM 004559549.mol (via Jmol)
004559566.b3lyp_6-31g(d).inp

004559566.b3lyp_6-31g(d).qchem.inp (generated)

004559566.b3lyp_6-31g(d).gjf (generated)

004559566.b3lyp_6-31g(d).firefly.inp (generated)

004559566.b3lyp_6-31g(d).smash.inp (generated)

004559566.b3lyp_6-31g(d).nwchem.inp (generated) 004559566.b3lyp_6-31g(d).log.xz 004559566.td-b3lyp_6-31g+(d).inp 004559566.td-b3lyp_6-31g+(d).log.xz

004559566.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559566.td-b3lyp_6-31+g(d).gjf (generated)

004559566.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559566.mol 004559566.PUBCHEM 004559566.mol (via Jmol)
004559651.b3lyp_6-31g(d).inp

004559651.b3lyp_6-31g(d).qchem.inp (generated)

004559651.b3lyp_6-31g(d).gjf (generated)

004559651.b3lyp_6-31g(d).firefly.inp (generated)

004559651.b3lyp_6-31g(d).smash.inp (generated)

004559651.b3lyp_6-31g(d).nwchem.inp (generated) 004559651.b3lyp_6-31g(d).log.xz 004559651.td-b3lyp_6-31g+(d).inp 004559651.td-b3lyp_6-31g+(d).log.xz

004559651.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559651.td-b3lyp_6-31+g(d).gjf (generated)

004559651.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559651.mol 004559651.PUBCHEM 004559651.mol (via Jmol)
004559662.b3lyp_6-31g(d).inp

004559662.b3lyp_6-31g(d).qchem.inp (generated)

004559662.b3lyp_6-31g(d).gjf (generated)

004559662.b3lyp_6-31g(d).firefly.inp (generated)

004559662.b3lyp_6-31g(d).smash.inp (generated)

004559662.b3lyp_6-31g(d).nwchem.inp (generated) 004559662.b3lyp_6-31g(d).log.xz 004559662.td-b3lyp_6-31g+(d).inp 004559662.td-b3lyp_6-31g+(d).log.xz

004559662.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559662.td-b3lyp_6-31+g(d).gjf (generated)

004559662.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559662.mol 004559662.PUBCHEM 004559662.mol (via Jmol)
004559726.b3lyp_6-31g(d).inp

004559726.b3lyp_6-31g(d).qchem.inp (generated)

004559726.b3lyp_6-31g(d).gjf (generated)

004559726.b3lyp_6-31g(d).firefly.inp (generated)

004559726.b3lyp_6-31g(d).smash.inp (generated)

004559726.b3lyp_6-31g(d).nwchem.inp (generated) 004559726.b3lyp_6-31g(d).log.xz 004559726.td-b3lyp_6-31g+(d).inp 004559726.td-b3lyp_6-31g+(d).log.xz

004559726.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559726.td-b3lyp_6-31+g(d).gjf (generated)

004559726.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559726.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559726.mol 004559726.PUBCHEM 004559726.mol (via Jmol)
004559765.b3lyp_6-31g(d).inp

004559765.b3lyp_6-31g(d).qchem.inp (generated)

004559765.b3lyp_6-31g(d).gjf (generated)

004559765.b3lyp_6-31g(d).firefly.inp (generated)

004559765.b3lyp_6-31g(d).smash.inp (generated)

004559765.b3lyp_6-31g(d).nwchem.inp (generated) 004559765.b3lyp_6-31g(d).log.xz 004559765.td-b3lyp_6-31g+(d).inp 004559765.td-b3lyp_6-31g+(d).log.xz

004559765.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559765.td-b3lyp_6-31+g(d).gjf (generated)

004559765.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559765.mol 004559765.PUBCHEM 004559765.mol (via Jmol)
004559776.b3lyp_6-31g(d).inp

004559776.b3lyp_6-31g(d).qchem.inp (generated)

004559776.b3lyp_6-31g(d).gjf (generated)

004559776.b3lyp_6-31g(d).firefly.inp (generated)

004559776.b3lyp_6-31g(d).smash.inp (generated)

004559776.b3lyp_6-31g(d).nwchem.inp (generated) 004559776.b3lyp_6-31g(d).log.xz 004559776.td-b3lyp_6-31g+(d).inp 004559776.td-b3lyp_6-31g+(d).log.xz

004559776.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559776.td-b3lyp_6-31+g(d).gjf (generated)

004559776.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559776.mol 004559776.PUBCHEM 004559776.mol (via Jmol)
004559830.b3lyp_6-31g(d).inp

004559830.b3lyp_6-31g(d).qchem.inp (generated)

004559830.b3lyp_6-31g(d).gjf (generated)

004559830.b3lyp_6-31g(d).firefly.inp (generated)

004559830.b3lyp_6-31g(d).smash.inp (generated)

004559830.b3lyp_6-31g(d).nwchem.inp (generated) 004559830.b3lyp_6-31g(d).log.xz 004559830.td-b3lyp_6-31g+(d).inp 004559830.td-b3lyp_6-31g+(d).log.xz

004559830.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559830.td-b3lyp_6-31+g(d).gjf (generated)

004559830.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559830.mol 004559830.PUBCHEM 004559830.mol (via Jmol)
004559887.b3lyp_6-31g(d).inp

004559887.b3lyp_6-31g(d).qchem.inp (generated)

004559887.b3lyp_6-31g(d).gjf (generated)

004559887.b3lyp_6-31g(d).firefly.inp (generated)

004559887.b3lyp_6-31g(d).smash.inp (generated)

004559887.b3lyp_6-31g(d).nwchem.inp (generated) 004559887.b3lyp_6-31g(d).log.xz 004559887.td-b3lyp_6-31g+(d).inp 004559887.td-b3lyp_6-31g+(d).log.xz

004559887.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559887.td-b3lyp_6-31+g(d).gjf (generated)

004559887.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559887.mol 004559887.PUBCHEM 004559887.mol (via Jmol)
004559912.b3lyp_6-31g(d).inp

004559912.b3lyp_6-31g(d).qchem.inp (generated)

004559912.b3lyp_6-31g(d).gjf (generated)

004559912.b3lyp_6-31g(d).firefly.inp (generated)

004559912.b3lyp_6-31g(d).smash.inp (generated)

004559912.b3lyp_6-31g(d).nwchem.inp (generated) 004559912.b3lyp_6-31g(d).log.xz 004559912.td-b3lyp_6-31g+(d).inp 004559912.td-b3lyp_6-31g+(d).log.xz

004559912.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559912.td-b3lyp_6-31+g(d).gjf (generated)

004559912.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559912.mol 004559912.PUBCHEM 004559912.mol (via Jmol)
004559923.b3lyp_6-31g(d).inp

004559923.b3lyp_6-31g(d).qchem.inp (generated)

004559923.b3lyp_6-31g(d).gjf (generated)

004559923.b3lyp_6-31g(d).firefly.inp (generated)

004559923.b3lyp_6-31g(d).smash.inp (generated)

004559923.b3lyp_6-31g(d).nwchem.inp (generated) 004559923.b3lyp_6-31g(d).log.xz 004559923.mol 004559923.PUBCHEM 004559923.mol (via Jmol)
004559942.b3lyp_6-31g(d).inp

004559942.b3lyp_6-31g(d).qchem.inp (generated)

004559942.b3lyp_6-31g(d).gjf (generated)

004559942.b3lyp_6-31g(d).firefly.inp (generated)

004559942.b3lyp_6-31g(d).smash.inp (generated)

004559942.b3lyp_6-31g(d).nwchem.inp (generated) 004559942.b3lyp_6-31g(d).log.xz 004559942.td-b3lyp_6-31g+(d).inp 004559942.td-b3lyp_6-31g+(d).log.xz

004559942.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559942.td-b3lyp_6-31+g(d).gjf (generated)

004559942.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559942.mol 004559942.PUBCHEM 004559942.mol (via Jmol)
004559985.b3lyp_6-31g(d).inp

004559985.b3lyp_6-31g(d).qchem.inp (generated)

004559985.b3lyp_6-31g(d).gjf (generated)

004559985.b3lyp_6-31g(d).firefly.inp (generated)

004559985.b3lyp_6-31g(d).smash.inp (generated)

004559985.b3lyp_6-31g(d).nwchem.inp (generated) 004559985.b3lyp_6-31g(d).log.xz 004559985.td-b3lyp_6-31g+(d).inp 004559985.td-b3lyp_6-31g+(d).log.xz

004559985.td-b3lyp_6-31+g(d).qchem.inp (generated)

004559985.td-b3lyp_6-31+g(d).gjf (generated)

004559985.td-b3lyp_6-31+g(d).firefly.inp (generated)

004559985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004559985.mol 004559985.PUBCHEM 004559985.mol (via Jmol)
004560004.b3lyp_6-31g(d).inp

004560004.b3lyp_6-31g(d).qchem.inp (generated)

004560004.b3lyp_6-31g(d).gjf (generated)

004560004.b3lyp_6-31g(d).firefly.inp (generated)

004560004.b3lyp_6-31g(d).smash.inp (generated)

004560004.b3lyp_6-31g(d).nwchem.inp (generated) 004560004.b3lyp_6-31g(d).log.xz 004560004.td-b3lyp_6-31g+(d).inp 004560004.td-b3lyp_6-31g+(d).log.xz

004560004.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560004.td-b3lyp_6-31+g(d).gjf (generated)

004560004.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560004.mol 004560004.PUBCHEM 004560004.mol (via Jmol)
004560020.b3lyp_6-31g(d).inp

004560020.b3lyp_6-31g(d).qchem.inp (generated)

004560020.b3lyp_6-31g(d).gjf (generated)

004560020.b3lyp_6-31g(d).firefly.inp (generated)

004560020.b3lyp_6-31g(d).smash.inp (generated)

004560020.b3lyp_6-31g(d).nwchem.inp (generated) 004560020.b3lyp_6-31g(d).log.xz 004560020.td-b3lyp_6-31g+(d).inp 004560020.td-b3lyp_6-31g+(d).log.xz

004560020.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560020.td-b3lyp_6-31+g(d).gjf (generated)

004560020.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560020.mol 004560020.PUBCHEM 004560020.mol (via Jmol)
004560053.b3lyp_6-31g(d).inp

004560053.b3lyp_6-31g(d).qchem.inp (generated)

004560053.b3lyp_6-31g(d).gjf (generated)

004560053.b3lyp_6-31g(d).firefly.inp (generated)

004560053.b3lyp_6-31g(d).smash.inp (generated)

004560053.b3lyp_6-31g(d).nwchem.inp (generated) 004560053.b3lyp_6-31g(d).log.xz 004560053.td-b3lyp_6-31g+(d).inp 004560053.td-b3lyp_6-31g+(d).log.xz

004560053.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560053.td-b3lyp_6-31+g(d).gjf (generated)

004560053.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560053.mol 004560053.PUBCHEM 004560053.mol (via Jmol)
004560062.b3lyp_6-31g(d).inp

004560062.b3lyp_6-31g(d).qchem.inp (generated)

004560062.b3lyp_6-31g(d).gjf (generated)

004560062.b3lyp_6-31g(d).firefly.inp (generated)

004560062.b3lyp_6-31g(d).smash.inp (generated)

004560062.b3lyp_6-31g(d).nwchem.inp (generated) 004560062.b3lyp_6-31g(d).log.xz 004560062.mol 004560062.PUBCHEM 004560062.mol (via Jmol)
004560119.b3lyp_6-31g(d).inp

004560119.b3lyp_6-31g(d).qchem.inp (generated)

004560119.b3lyp_6-31g(d).gjf (generated)

004560119.b3lyp_6-31g(d).firefly.inp (generated)

004560119.b3lyp_6-31g(d).smash.inp (generated)

004560119.b3lyp_6-31g(d).nwchem.inp (generated) 004560119.b3lyp_6-31g(d).log.xz 004560119.td-b3lyp_6-31g+(d).inp 004560119.td-b3lyp_6-31g+(d).log.xz

004560119.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560119.td-b3lyp_6-31+g(d).gjf (generated)

004560119.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560119.mol 004560119.PUBCHEM 004560119.mol (via Jmol)
004560141.b3lyp_6-31g(d).inp

004560141.b3lyp_6-31g(d).qchem.inp (generated)

004560141.b3lyp_6-31g(d).gjf (generated)

004560141.b3lyp_6-31g(d).firefly.inp (generated)

004560141.b3lyp_6-31g(d).smash.inp (generated)

004560141.b3lyp_6-31g(d).nwchem.inp (generated) 004560141.b3lyp_6-31g(d).log.xz 004560141.td-b3lyp_6-31g+(d).inp 004560141.td-b3lyp_6-31g+(d).log.xz

004560141.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560141.td-b3lyp_6-31+g(d).gjf (generated)

004560141.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560141.mol 004560141.PUBCHEM 004560141.mol (via Jmol)
004560156.b3lyp_6-31g(d).inp

004560156.b3lyp_6-31g(d).qchem.inp (generated)

004560156.b3lyp_6-31g(d).gjf (generated)

004560156.b3lyp_6-31g(d).firefly.inp (generated)

004560156.b3lyp_6-31g(d).smash.inp (generated)

004560156.b3lyp_6-31g(d).nwchem.inp (generated) 004560156.b3lyp_6-31g(d).log.xz 004560156.td-b3lyp_6-31g+(d).inp 004560156.td-b3lyp_6-31g+(d).log.xz

004560156.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560156.td-b3lyp_6-31+g(d).gjf (generated)

004560156.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560156.mol 004560156.PUBCHEM 004560156.mol (via Jmol)
004560244.b3lyp_6-31g(d).inp

004560244.b3lyp_6-31g(d).qchem.inp (generated)

004560244.b3lyp_6-31g(d).gjf (generated)

004560244.b3lyp_6-31g(d).firefly.inp (generated)

004560244.b3lyp_6-31g(d).smash.inp (generated)

004560244.b3lyp_6-31g(d).nwchem.inp (generated) 004560244.b3lyp_6-31g(d).log.xz 004560244.td-b3lyp_6-31g+(d).inp 004560244.td-b3lyp_6-31g+(d).log.xz

004560244.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560244.td-b3lyp_6-31+g(d).gjf (generated)

004560244.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560244.mol 004560244.PUBCHEM 004560244.mol (via Jmol)
004560331.b3lyp_6-31g(d).inp

004560331.b3lyp_6-31g(d).qchem.inp (generated)

004560331.b3lyp_6-31g(d).gjf (generated)

004560331.b3lyp_6-31g(d).firefly.inp (generated)

004560331.b3lyp_6-31g(d).smash.inp (generated)

004560331.b3lyp_6-31g(d).nwchem.inp (generated) 004560331.b3lyp_6-31g(d).log.xz 004560331.td-b3lyp_6-31g+(d).inp 004560331.td-b3lyp_6-31g+(d).log.xz

004560331.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560331.td-b3lyp_6-31+g(d).gjf (generated)

004560331.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560331.mol 004560331.PUBCHEM 004560331.mol (via Jmol)
004560448.b3lyp_6-31g(d).inp

004560448.b3lyp_6-31g(d).qchem.inp (generated)

004560448.b3lyp_6-31g(d).gjf (generated)

004560448.b3lyp_6-31g(d).firefly.inp (generated)

004560448.b3lyp_6-31g(d).smash.inp (generated)

004560448.b3lyp_6-31g(d).nwchem.inp (generated) 004560448.b3lyp_6-31g(d).log.xz 004560448.td-b3lyp_6-31g+(d).inp 004560448.td-b3lyp_6-31g+(d).log.xz

004560448.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560448.td-b3lyp_6-31+g(d).gjf (generated)

004560448.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560448.mol 004560448.PUBCHEM 004560448.mol (via Jmol)
004560475.b3lyp_6-31g(d).inp

004560475.b3lyp_6-31g(d).qchem.inp (generated)

004560475.b3lyp_6-31g(d).gjf (generated)

004560475.b3lyp_6-31g(d).firefly.inp (generated)

004560475.b3lyp_6-31g(d).smash.inp (generated)

004560475.b3lyp_6-31g(d).nwchem.inp (generated) 004560475.b3lyp_6-31g(d).log.xz 004560475.td-b3lyp_6-31g+(d).inp 004560475.td-b3lyp_6-31g+(d).log.xz

004560475.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560475.td-b3lyp_6-31+g(d).gjf (generated)

004560475.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560475.mol 004560475.PUBCHEM 004560475.mol (via Jmol)
004560477.b3lyp_6-31g(d).inp

004560477.b3lyp_6-31g(d).qchem.inp (generated)

004560477.b3lyp_6-31g(d).gjf (generated)

004560477.b3lyp_6-31g(d).firefly.inp (generated)

004560477.b3lyp_6-31g(d).smash.inp (generated)

004560477.b3lyp_6-31g(d).nwchem.inp (generated) 004560477.b3lyp_6-31g(d).log.xz 004560477.td-b3lyp_6-31g+(d).inp 004560477.td-b3lyp_6-31g+(d).log.xz

004560477.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560477.td-b3lyp_6-31+g(d).gjf (generated)

004560477.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560477.mol 004560477.PUBCHEM 004560477.mol (via Jmol)
004560487.b3lyp_6-31g(d).inp

004560487.b3lyp_6-31g(d).qchem.inp (generated)

004560487.b3lyp_6-31g(d).gjf (generated)

004560487.b3lyp_6-31g(d).firefly.inp (generated)

004560487.b3lyp_6-31g(d).smash.inp (generated)

004560487.b3lyp_6-31g(d).nwchem.inp (generated) 004560487.b3lyp_6-31g(d).log.xz 004560487.td-b3lyp_6-31g+(d).inp 004560487.td-b3lyp_6-31g+(d).log.xz

004560487.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560487.td-b3lyp_6-31+g(d).gjf (generated)

004560487.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560487.mol 004560487.PUBCHEM 004560487.mol (via Jmol)
004560492.b3lyp_6-31g(d).inp

004560492.b3lyp_6-31g(d).qchem.inp (generated)

004560492.b3lyp_6-31g(d).gjf (generated)

004560492.b3lyp_6-31g(d).firefly.inp (generated)

004560492.b3lyp_6-31g(d).smash.inp (generated)

004560492.b3lyp_6-31g(d).nwchem.inp (generated) 004560492.b3lyp_6-31g(d).log.xz 004560492.td-b3lyp_6-31g+(d).inp 004560492.td-b3lyp_6-31g+(d).log.xz

004560492.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560492.td-b3lyp_6-31+g(d).gjf (generated)

004560492.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560492.mol 004560492.PUBCHEM 004560492.mol (via Jmol)
004560556.b3lyp_6-31g(d).inp

004560556.b3lyp_6-31g(d).qchem.inp (generated)

004560556.b3lyp_6-31g(d).gjf (generated)

004560556.b3lyp_6-31g(d).firefly.inp (generated)

004560556.b3lyp_6-31g(d).smash.inp (generated)

004560556.b3lyp_6-31g(d).nwchem.inp (generated) 004560556.b3lyp_6-31g(d).log.xz 004560556.td-b3lyp_6-31g+(d).inp 004560556.td-b3lyp_6-31g+(d).log.xz

004560556.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560556.td-b3lyp_6-31+g(d).gjf (generated)

004560556.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560556.mol 004560556.PUBCHEM 004560556.mol (via Jmol)
004560587.b3lyp_6-31g(d).inp

004560587.b3lyp_6-31g(d).qchem.inp (generated)

004560587.b3lyp_6-31g(d).gjf (generated)

004560587.b3lyp_6-31g(d).firefly.inp (generated)

004560587.b3lyp_6-31g(d).smash.inp (generated)

004560587.b3lyp_6-31g(d).nwchem.inp (generated) 004560587.b3lyp_6-31g(d).log.xz 004560587.td-b3lyp_6-31g+(d).inp 004560587.td-b3lyp_6-31g+(d).log.xz

004560587.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560587.td-b3lyp_6-31+g(d).gjf (generated)

004560587.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560587.mol 004560587.PUBCHEM 004560587.mol (via Jmol)
004560593.b3lyp_6-31g(d).inp

004560593.b3lyp_6-31g(d).qchem.inp (generated)

004560593.b3lyp_6-31g(d).gjf (generated)

004560593.b3lyp_6-31g(d).firefly.inp (generated)

004560593.b3lyp_6-31g(d).smash.inp (generated)

004560593.b3lyp_6-31g(d).nwchem.inp (generated) 004560593.b3lyp_6-31g(d).log.xz 004560593.mol 004560593.PUBCHEM 004560593.mol (via Jmol)
004560617.b3lyp_6-31g(d).inp

004560617.b3lyp_6-31g(d).qchem.inp (generated)

004560617.b3lyp_6-31g(d).gjf (generated)

004560617.b3lyp_6-31g(d).firefly.inp (generated)

004560617.b3lyp_6-31g(d).smash.inp (generated)

004560617.b3lyp_6-31g(d).nwchem.inp (generated) 004560617.b3lyp_6-31g(d).log.xz 004560617.mol 004560617.PUBCHEM 004560617.mol (via Jmol)
004560618.b3lyp_6-31g(d).inp

004560618.b3lyp_6-31g(d).qchem.inp (generated)

004560618.b3lyp_6-31g(d).gjf (generated)

004560618.b3lyp_6-31g(d).firefly.inp (generated)

004560618.b3lyp_6-31g(d).smash.inp (generated)

004560618.b3lyp_6-31g(d).nwchem.inp (generated) 004560618.b3lyp_6-31g(d).log.xz 004560618.td-b3lyp_6-31g+(d).inp 004560618.td-b3lyp_6-31g+(d).log.xz

004560618.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560618.td-b3lyp_6-31+g(d).gjf (generated)

004560618.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560618.mol 004560618.PUBCHEM 004560618.mol (via Jmol)
004560737.b3lyp_6-31g(d).inp

004560737.b3lyp_6-31g(d).qchem.inp (generated)

004560737.b3lyp_6-31g(d).gjf (generated)

004560737.b3lyp_6-31g(d).firefly.inp (generated)

004560737.b3lyp_6-31g(d).smash.inp (generated)

004560737.b3lyp_6-31g(d).nwchem.inp (generated) 004560737.b3lyp_6-31g(d).log.xz 004560737.td-b3lyp_6-31g+(d).inp 004560737.td-b3lyp_6-31g+(d).log.xz

004560737.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560737.td-b3lyp_6-31+g(d).gjf (generated)

004560737.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560737.mol 004560737.PUBCHEM 004560737.mol (via Jmol)
004560738.b3lyp_6-31g(d).inp

004560738.b3lyp_6-31g(d).qchem.inp (generated)

004560738.b3lyp_6-31g(d).gjf (generated)

004560738.b3lyp_6-31g(d).firefly.inp (generated)

004560738.b3lyp_6-31g(d).smash.inp (generated)

004560738.b3lyp_6-31g(d).nwchem.inp (generated) 004560738.b3lyp_6-31g(d).log.xz 004560738.td-b3lyp_6-31g+(d).inp 004560738.td-b3lyp_6-31g+(d).log.xz

004560738.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560738.td-b3lyp_6-31+g(d).gjf (generated)

004560738.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560738.mol 004560738.PUBCHEM 004560738.mol (via Jmol)
004560813.b3lyp_6-31g(d).inp

004560813.b3lyp_6-31g(d).qchem.inp (generated)

004560813.b3lyp_6-31g(d).gjf (generated)

004560813.b3lyp_6-31g(d).firefly.inp (generated)

004560813.b3lyp_6-31g(d).smash.inp (generated)

004560813.b3lyp_6-31g(d).nwchem.inp (generated) 004560813.b3lyp_6-31g(d).log.xz 004560813.td-b3lyp_6-31g+(d).inp 004560813.td-b3lyp_6-31g+(d).log.xz

004560813.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560813.td-b3lyp_6-31+g(d).gjf (generated)

004560813.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560813.mol 004560813.PUBCHEM 004560813.mol (via Jmol)
004560814.b3lyp_6-31g(d).inp

004560814.b3lyp_6-31g(d).qchem.inp (generated)

004560814.b3lyp_6-31g(d).gjf (generated)

004560814.b3lyp_6-31g(d).firefly.inp (generated)

004560814.b3lyp_6-31g(d).smash.inp (generated)

004560814.b3lyp_6-31g(d).nwchem.inp (generated) 004560814.b3lyp_6-31g(d).log.xz 004560814.td-b3lyp_6-31g+(d).inp 004560814.td-b3lyp_6-31g+(d).log.xz

004560814.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560814.td-b3lyp_6-31+g(d).gjf (generated)

004560814.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560814.mol 004560814.PUBCHEM 004560814.mol (via Jmol)
004560817.b3lyp_6-31g(d).inp

004560817.b3lyp_6-31g(d).qchem.inp (generated)

004560817.b3lyp_6-31g(d).gjf (generated)

004560817.b3lyp_6-31g(d).firefly.inp (generated)

004560817.b3lyp_6-31g(d).smash.inp (generated)

004560817.b3lyp_6-31g(d).nwchem.inp (generated) 004560817.b3lyp_6-31g(d).log.xz 004560817.td-b3lyp_6-31g+(d).inp 004560817.td-b3lyp_6-31g+(d).log.xz

004560817.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560817.td-b3lyp_6-31+g(d).gjf (generated)

004560817.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560817.mol 004560817.PUBCHEM 004560817.mol (via Jmol)
004560824.b3lyp_6-31g(d).inp

004560824.b3lyp_6-31g(d).qchem.inp (generated)

004560824.b3lyp_6-31g(d).gjf (generated)

004560824.b3lyp_6-31g(d).firefly.inp (generated)

004560824.b3lyp_6-31g(d).smash.inp (generated)

004560824.b3lyp_6-31g(d).nwchem.inp (generated) 004560824.b3lyp_6-31g(d).log.xz 004560824.td-b3lyp_6-31g+(d).inp 004560824.td-b3lyp_6-31g+(d).log.xz

004560824.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560824.td-b3lyp_6-31+g(d).gjf (generated)

004560824.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560824.mol 004560824.PUBCHEM 004560824.mol (via Jmol)
004560848.b3lyp_6-31g(d).inp

004560848.b3lyp_6-31g(d).qchem.inp (generated)

004560848.b3lyp_6-31g(d).gjf (generated)

004560848.b3lyp_6-31g(d).firefly.inp (generated)

004560848.b3lyp_6-31g(d).smash.inp (generated)

004560848.b3lyp_6-31g(d).nwchem.inp (generated) 004560848.b3lyp_6-31g(d).log.xz 004560848.mol 004560848.PUBCHEM 004560848.mol (via Jmol)
004560895.b3lyp_6-31g(d).inp

004560895.b3lyp_6-31g(d).qchem.inp (generated)

004560895.b3lyp_6-31g(d).gjf (generated)

004560895.b3lyp_6-31g(d).firefly.inp (generated)

004560895.b3lyp_6-31g(d).smash.inp (generated)

004560895.b3lyp_6-31g(d).nwchem.inp (generated) 004560895.b3lyp_6-31g(d).log.xz 004560895.mol 004560895.PUBCHEM 004560895.mol (via Jmol)
004560919.b3lyp_6-31g(d).inp

004560919.b3lyp_6-31g(d).qchem.inp (generated)

004560919.b3lyp_6-31g(d).gjf (generated)

004560919.b3lyp_6-31g(d).firefly.inp (generated)

004560919.b3lyp_6-31g(d).smash.inp (generated)

004560919.b3lyp_6-31g(d).nwchem.inp (generated) 004560919.b3lyp_6-31g(d).log.xz 004560919.td-b3lyp_6-31g+(d).inp 004560919.td-b3lyp_6-31g+(d).log.xz

004560919.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560919.td-b3lyp_6-31+g(d).gjf (generated)

004560919.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560919.mol 004560919.PUBCHEM 004560919.mol (via Jmol)
004560966.b3lyp_6-31g(d).inp

004560966.b3lyp_6-31g(d).qchem.inp (generated)

004560966.b3lyp_6-31g(d).gjf (generated)

004560966.b3lyp_6-31g(d).firefly.inp (generated)

004560966.b3lyp_6-31g(d).smash.inp (generated)

004560966.b3lyp_6-31g(d).nwchem.inp (generated) 004560966.b3lyp_6-31g(d).log.xz 004560966.td-b3lyp_6-31g+(d).inp 004560966.td-b3lyp_6-31g+(d).log.xz

004560966.td-b3lyp_6-31+g(d).qchem.inp (generated)

004560966.td-b3lyp_6-31+g(d).gjf (generated)

004560966.td-b3lyp_6-31+g(d).firefly.inp (generated)

004560966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004560966.mol 004560966.PUBCHEM 004560966.mol (via Jmol)
004561008.b3lyp_6-31g(d).inp

004561008.b3lyp_6-31g(d).qchem.inp (generated)

004561008.b3lyp_6-31g(d).gjf (generated)

004561008.b3lyp_6-31g(d).firefly.inp (generated)

004561008.b3lyp_6-31g(d).smash.inp (generated)

004561008.b3lyp_6-31g(d).nwchem.inp (generated) 004561008.b3lyp_6-31g(d).log.xz 004561008.td-b3lyp_6-31g+(d).inp 004561008.td-b3lyp_6-31g+(d).log.xz

004561008.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561008.td-b3lyp_6-31+g(d).gjf (generated)

004561008.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561008.mol 004561008.PUBCHEM 004561008.mol (via Jmol)
004561118.b3lyp_6-31g(d).inp

004561118.b3lyp_6-31g(d).qchem.inp (generated)

004561118.b3lyp_6-31g(d).gjf (generated)

004561118.b3lyp_6-31g(d).firefly.inp (generated)

004561118.b3lyp_6-31g(d).smash.inp (generated)

004561118.b3lyp_6-31g(d).nwchem.inp (generated) 004561118.b3lyp_6-31g(d).log.xz 004561118.td-b3lyp_6-31g+(d).inp 004561118.td-b3lyp_6-31g+(d).log.xz

004561118.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561118.td-b3lyp_6-31+g(d).gjf (generated)

004561118.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561118.mol 004561118.PUBCHEM 004561118.mol (via Jmol)
004561223.b3lyp_6-31g(d).inp

004561223.b3lyp_6-31g(d).qchem.inp (generated)

004561223.b3lyp_6-31g(d).gjf (generated)

004561223.b3lyp_6-31g(d).firefly.inp (generated)

004561223.b3lyp_6-31g(d).smash.inp (generated)

004561223.b3lyp_6-31g(d).nwchem.inp (generated) 004561223.b3lyp_6-31g(d).log.xz 004561223.td-b3lyp_6-31g+(d).inp 004561223.td-b3lyp_6-31g+(d).log.xz

004561223.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561223.td-b3lyp_6-31+g(d).gjf (generated)

004561223.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561223.mol 004561223.PUBCHEM 004561223.mol (via Jmol)
004561244.b3lyp_6-31g(d).inp

004561244.b3lyp_6-31g(d).qchem.inp (generated)

004561244.b3lyp_6-31g(d).gjf (generated)

004561244.b3lyp_6-31g(d).firefly.inp (generated)

004561244.b3lyp_6-31g(d).smash.inp (generated)

004561244.b3lyp_6-31g(d).nwchem.inp (generated) 004561244.b3lyp_6-31g(d).log.xz 004561244.td-b3lyp_6-31g+(d).inp 004561244.td-b3lyp_6-31g+(d).log.xz

004561244.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561244.td-b3lyp_6-31+g(d).gjf (generated)

004561244.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561244.mol 004561244.PUBCHEM 004561244.mol (via Jmol)
004561249.b3lyp_6-31g(d).inp

004561249.b3lyp_6-31g(d).qchem.inp (generated)

004561249.b3lyp_6-31g(d).gjf (generated)

004561249.b3lyp_6-31g(d).firefly.inp (generated)

004561249.b3lyp_6-31g(d).smash.inp (generated)

004561249.b3lyp_6-31g(d).nwchem.inp (generated) 004561249.b3lyp_6-31g(d).log.xz 004561249.mol 004561249.PUBCHEM 004561249.mol (via Jmol)
004561270.b3lyp_6-31g(d).inp

004561270.b3lyp_6-31g(d).qchem.inp (generated)

004561270.b3lyp_6-31g(d).gjf (generated)

004561270.b3lyp_6-31g(d).firefly.inp (generated)

004561270.b3lyp_6-31g(d).smash.inp (generated)

004561270.b3lyp_6-31g(d).nwchem.inp (generated) 004561270.b3lyp_6-31g(d).log.xz 004561270.td-b3lyp_6-31g+(d).inp 004561270.td-b3lyp_6-31g+(d).log.xz

004561270.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561270.td-b3lyp_6-31+g(d).gjf (generated)

004561270.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561270.mol 004561270.PUBCHEM 004561270.mol (via Jmol)
004561274.b3lyp_6-31g(d).inp

004561274.b3lyp_6-31g(d).qchem.inp (generated)

004561274.b3lyp_6-31g(d).gjf (generated)

004561274.b3lyp_6-31g(d).firefly.inp (generated)

004561274.b3lyp_6-31g(d).smash.inp (generated)

004561274.b3lyp_6-31g(d).nwchem.inp (generated) 004561274.b3lyp_6-31g(d).log.xz 004561274.td-b3lyp_6-31g+(d).inp 004561274.td-b3lyp_6-31g+(d).log.xz

004561274.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561274.td-b3lyp_6-31+g(d).gjf (generated)

004561274.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561274.mol 004561274.PUBCHEM 004561274.mol (via Jmol)
004561276.b3lyp_6-31g(d).inp

004561276.b3lyp_6-31g(d).qchem.inp (generated)

004561276.b3lyp_6-31g(d).gjf (generated)

004561276.b3lyp_6-31g(d).firefly.inp (generated)

004561276.b3lyp_6-31g(d).smash.inp (generated)

004561276.b3lyp_6-31g(d).nwchem.inp (generated) 004561276.b3lyp_6-31g(d).log.xz 004561276.mol 004561276.PUBCHEM 004561276.mol (via Jmol)
004561298.b3lyp_6-31g(d).inp

004561298.b3lyp_6-31g(d).qchem.inp (generated)

004561298.b3lyp_6-31g(d).gjf (generated)

004561298.b3lyp_6-31g(d).firefly.inp (generated)

004561298.b3lyp_6-31g(d).smash.inp (generated)

004561298.b3lyp_6-31g(d).nwchem.inp (generated) 004561298.b3lyp_6-31g(d).log.xz 004561298.td-b3lyp_6-31g+(d).inp 004561298.td-b3lyp_6-31g+(d).log.xz

004561298.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561298.td-b3lyp_6-31+g(d).gjf (generated)

004561298.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561298.mol 004561298.PUBCHEM 004561298.mol (via Jmol)
004561318.b3lyp_6-31g(d).inp

004561318.b3lyp_6-31g(d).qchem.inp (generated)

004561318.b3lyp_6-31g(d).gjf (generated)

004561318.b3lyp_6-31g(d).firefly.inp (generated)

004561318.b3lyp_6-31g(d).smash.inp (generated)

004561318.b3lyp_6-31g(d).nwchem.inp (generated) 004561318.b3lyp_6-31g(d).log.xz 004561318.td-b3lyp_6-31g+(d).inp 004561318.td-b3lyp_6-31g+(d).log.xz

004561318.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561318.td-b3lyp_6-31+g(d).gjf (generated)

004561318.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561318.mol 004561318.PUBCHEM 004561318.mol (via Jmol)
004561389.b3lyp_6-31g(d).inp

004561389.b3lyp_6-31g(d).qchem.inp (generated)

004561389.b3lyp_6-31g(d).gjf (generated)

004561389.b3lyp_6-31g(d).firefly.inp (generated)

004561389.b3lyp_6-31g(d).smash.inp (generated)

004561389.b3lyp_6-31g(d).nwchem.inp (generated) 004561389.b3lyp_6-31g(d).log.xz 004561389.td-b3lyp_6-31g+(d).inp 004561389.td-b3lyp_6-31g+(d).log.xz

004561389.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561389.td-b3lyp_6-31+g(d).gjf (generated)

004561389.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561389.mol 004561389.PUBCHEM 004561389.mol (via Jmol)
004561478.b3lyp_6-31g(d).inp

004561478.b3lyp_6-31g(d).qchem.inp (generated)

004561478.b3lyp_6-31g(d).gjf (generated)

004561478.b3lyp_6-31g(d).firefly.inp (generated)

004561478.b3lyp_6-31g(d).smash.inp (generated)

004561478.b3lyp_6-31g(d).nwchem.inp (generated) 004561478.b3lyp_6-31g(d).log.xz 004561478.td-b3lyp_6-31g+(d).inp 004561478.td-b3lyp_6-31g+(d).log.xz

004561478.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561478.td-b3lyp_6-31+g(d).gjf (generated)

004561478.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561478.mol 004561478.PUBCHEM 004561478.mol (via Jmol)
004561497.b3lyp_6-31g(d).inp

004561497.b3lyp_6-31g(d).qchem.inp (generated)

004561497.b3lyp_6-31g(d).gjf (generated)

004561497.b3lyp_6-31g(d).firefly.inp (generated)

004561497.b3lyp_6-31g(d).smash.inp (generated)

004561497.b3lyp_6-31g(d).nwchem.inp (generated) 004561497.b3lyp_6-31g(d).log.xz 004561497.td-b3lyp_6-31g+(d).inp 004561497.td-b3lyp_6-31g+(d).log.xz

004561497.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561497.td-b3lyp_6-31+g(d).gjf (generated)

004561497.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561497.mol 004561497.PUBCHEM 004561497.mol (via Jmol)
004561506.b3lyp_6-31g(d).inp

004561506.b3lyp_6-31g(d).qchem.inp (generated)

004561506.b3lyp_6-31g(d).gjf (generated)

004561506.b3lyp_6-31g(d).firefly.inp (generated)

004561506.b3lyp_6-31g(d).smash.inp (generated)

004561506.b3lyp_6-31g(d).nwchem.inp (generated) 004561506.b3lyp_6-31g(d).log.xz 004561506.td-b3lyp_6-31g+(d).inp 004561506.td-b3lyp_6-31g+(d).log.xz

004561506.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561506.td-b3lyp_6-31+g(d).gjf (generated)

004561506.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561506.mol 004561506.PUBCHEM 004561506.mol (via Jmol)
004561544.b3lyp_6-31g(d).inp

004561544.b3lyp_6-31g(d).qchem.inp (generated)

004561544.b3lyp_6-31g(d).gjf (generated)

004561544.b3lyp_6-31g(d).firefly.inp (generated)

004561544.b3lyp_6-31g(d).smash.inp (generated)

004561544.b3lyp_6-31g(d).nwchem.inp (generated) 004561544.b3lyp_6-31g(d).log.xz 004561544.td-b3lyp_6-31g+(d).inp 004561544.td-b3lyp_6-31g+(d).log.xz

004561544.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561544.td-b3lyp_6-31+g(d).gjf (generated)

004561544.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561544.mol 004561544.PUBCHEM 004561544.mol (via Jmol)
004561601.b3lyp_6-31g(d).inp

004561601.b3lyp_6-31g(d).qchem.inp (generated)

004561601.b3lyp_6-31g(d).gjf (generated)

004561601.b3lyp_6-31g(d).firefly.inp (generated)

004561601.b3lyp_6-31g(d).smash.inp (generated)

004561601.b3lyp_6-31g(d).nwchem.inp (generated) 004561601.b3lyp_6-31g(d).log.xz 004561601.td-b3lyp_6-31g+(d).inp 004561601.td-b3lyp_6-31g+(d).log.xz

004561601.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561601.td-b3lyp_6-31+g(d).gjf (generated)

004561601.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561601.mol 004561601.PUBCHEM 004561601.mol (via Jmol)
004561602.b3lyp_6-31g(d).inp

004561602.b3lyp_6-31g(d).qchem.inp (generated)

004561602.b3lyp_6-31g(d).gjf (generated)

004561602.b3lyp_6-31g(d).firefly.inp (generated)

004561602.b3lyp_6-31g(d).smash.inp (generated)

004561602.b3lyp_6-31g(d).nwchem.inp (generated) 004561602.b3lyp_6-31g(d).log.xz 004561602.td-b3lyp_6-31g+(d).inp 004561602.td-b3lyp_6-31g+(d).log.xz

004561602.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561602.td-b3lyp_6-31+g(d).gjf (generated)

004561602.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561602.mol 004561602.PUBCHEM 004561602.mol (via Jmol)
004561643.b3lyp_6-31g(d).inp

004561643.b3lyp_6-31g(d).qchem.inp (generated)

004561643.b3lyp_6-31g(d).gjf (generated)

004561643.b3lyp_6-31g(d).firefly.inp (generated)

004561643.b3lyp_6-31g(d).smash.inp (generated)

004561643.b3lyp_6-31g(d).nwchem.inp (generated) 004561643.b3lyp_6-31g(d).log.xz 004561643.td-b3lyp_6-31g+(d).inp 004561643.td-b3lyp_6-31g+(d).log.xz

004561643.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561643.td-b3lyp_6-31+g(d).gjf (generated)

004561643.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561643.mol 004561643.PUBCHEM 004561643.mol (via Jmol)
004561662.b3lyp_6-31g(d).inp

004561662.b3lyp_6-31g(d).qchem.inp (generated)

004561662.b3lyp_6-31g(d).gjf (generated)

004561662.b3lyp_6-31g(d).firefly.inp (generated)

004561662.b3lyp_6-31g(d).smash.inp (generated)

004561662.b3lyp_6-31g(d).nwchem.inp (generated) 004561662.b3lyp_6-31g(d).log.xz 004561662.td-b3lyp_6-31g+(d).inp 004561662.td-b3lyp_6-31g+(d).log.xz

004561662.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561662.td-b3lyp_6-31+g(d).gjf (generated)

004561662.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561662.mol 004561662.PUBCHEM 004561662.mol (via Jmol)
004561673.b3lyp_6-31g(d).inp

004561673.b3lyp_6-31g(d).qchem.inp (generated)

004561673.b3lyp_6-31g(d).gjf (generated)

004561673.b3lyp_6-31g(d).firefly.inp (generated)

004561673.b3lyp_6-31g(d).smash.inp (generated)

004561673.b3lyp_6-31g(d).nwchem.inp (generated) 004561673.b3lyp_6-31g(d).log.xz 004561673.mol 004561673.PUBCHEM 004561673.mol (via Jmol)
004561709.b3lyp_6-31g(d).inp

004561709.b3lyp_6-31g(d).qchem.inp (generated)

004561709.b3lyp_6-31g(d).gjf (generated)

004561709.b3lyp_6-31g(d).firefly.inp (generated)

004561709.b3lyp_6-31g(d).smash.inp (generated)

004561709.b3lyp_6-31g(d).nwchem.inp (generated) 004561709.b3lyp_6-31g(d).log.xz 004561709.mol 004561709.PUBCHEM 004561709.mol (via Jmol)
004561770.b3lyp_6-31g(d).inp

004561770.b3lyp_6-31g(d).qchem.inp (generated)

004561770.b3lyp_6-31g(d).gjf (generated)

004561770.b3lyp_6-31g(d).firefly.inp (generated)

004561770.b3lyp_6-31g(d).smash.inp (generated)

004561770.b3lyp_6-31g(d).nwchem.inp (generated) 004561770.b3lyp_6-31g(d).log.xz 004561770.td-b3lyp_6-31g+(d).inp 004561770.td-b3lyp_6-31g+(d).log.xz

004561770.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561770.td-b3lyp_6-31+g(d).gjf (generated)

004561770.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561770.mol 004561770.PUBCHEM 004561770.mol (via Jmol)
004561802.b3lyp_6-31g(d).inp

004561802.b3lyp_6-31g(d).qchem.inp (generated)

004561802.b3lyp_6-31g(d).gjf (generated)

004561802.b3lyp_6-31g(d).firefly.inp (generated)

004561802.b3lyp_6-31g(d).smash.inp (generated)

004561802.b3lyp_6-31g(d).nwchem.inp (generated) 004561802.b3lyp_6-31g(d).log.xz 004561802.td-b3lyp_6-31g+(d).inp 004561802.td-b3lyp_6-31g+(d).log.xz

004561802.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561802.td-b3lyp_6-31+g(d).gjf (generated)

004561802.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561802.mol 004561802.PUBCHEM 004561802.mol (via Jmol)
004561806.b3lyp_6-31g(d).inp

004561806.b3lyp_6-31g(d).qchem.inp (generated)

004561806.b3lyp_6-31g(d).gjf (generated)

004561806.b3lyp_6-31g(d).firefly.inp (generated)

004561806.b3lyp_6-31g(d).smash.inp (generated)

004561806.b3lyp_6-31g(d).nwchem.inp (generated) 004561806.b3lyp_6-31g(d).log.xz 004561806.td-b3lyp_6-31g+(d).inp 004561806.td-b3lyp_6-31g+(d).log.xz

004561806.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561806.td-b3lyp_6-31+g(d).gjf (generated)

004561806.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561806.mol 004561806.PUBCHEM 004561806.mol (via Jmol)
004561835.b3lyp_6-31g(d).inp

004561835.b3lyp_6-31g(d).qchem.inp (generated)

004561835.b3lyp_6-31g(d).gjf (generated)

004561835.b3lyp_6-31g(d).firefly.inp (generated)

004561835.b3lyp_6-31g(d).smash.inp (generated)

004561835.b3lyp_6-31g(d).nwchem.inp (generated) 004561835.b3lyp_6-31g(d).log.xz 004561835.td-b3lyp_6-31g+(d).inp 004561835.td-b3lyp_6-31g+(d).log.xz

004561835.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561835.td-b3lyp_6-31+g(d).gjf (generated)

004561835.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561835.mol 004561835.PUBCHEM 004561835.mol (via Jmol)
004561881.b3lyp_6-31g(d).inp

004561881.b3lyp_6-31g(d).qchem.inp (generated)

004561881.b3lyp_6-31g(d).gjf (generated)

004561881.b3lyp_6-31g(d).firefly.inp (generated)

004561881.b3lyp_6-31g(d).smash.inp (generated)

004561881.b3lyp_6-31g(d).nwchem.inp (generated) 004561881.b3lyp_6-31g(d).log.xz 004561881.mol 004561881.PUBCHEM 004561881.mol (via Jmol)
004561942.b3lyp_6-31g(d).inp

004561942.b3lyp_6-31g(d).qchem.inp (generated)

004561942.b3lyp_6-31g(d).gjf (generated)

004561942.b3lyp_6-31g(d).firefly.inp (generated)

004561942.b3lyp_6-31g(d).smash.inp (generated)

004561942.b3lyp_6-31g(d).nwchem.inp (generated) 004561942.b3lyp_6-31g(d).log.xz 004561942.td-b3lyp_6-31g+(d).inp 004561942.td-b3lyp_6-31g+(d).log.xz

004561942.td-b3lyp_6-31+g(d).qchem.inp (generated)

004561942.td-b3lyp_6-31+g(d).gjf (generated)

004561942.td-b3lyp_6-31+g(d).firefly.inp (generated)

004561942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004561942.mol 004561942.PUBCHEM 004561942.mol (via Jmol)
004562025.b3lyp_6-31g(d).inp

004562025.b3lyp_6-31g(d).qchem.inp (generated)

004562025.b3lyp_6-31g(d).gjf (generated)

004562025.b3lyp_6-31g(d).firefly.inp (generated)

004562025.b3lyp_6-31g(d).smash.inp (generated)

004562025.b3lyp_6-31g(d).nwchem.inp (generated) 004562025.b3lyp_6-31g(d).log.xz 004562025.mol 004562025.PUBCHEM 004562025.mol (via Jmol)
004562043.b3lyp_6-31g(d).inp

004562043.b3lyp_6-31g(d).qchem.inp (generated)

004562043.b3lyp_6-31g(d).gjf (generated)

004562043.b3lyp_6-31g(d).firefly.inp (generated)

004562043.b3lyp_6-31g(d).smash.inp (generated)

004562043.b3lyp_6-31g(d).nwchem.inp (generated) 004562043.b3lyp_6-31g(d).log.xz 004562043.mol 004562043.PUBCHEM 004562043.mol (via Jmol)
004562048.b3lyp_6-31g(d).inp

004562048.b3lyp_6-31g(d).qchem.inp (generated)

004562048.b3lyp_6-31g(d).gjf (generated)

004562048.b3lyp_6-31g(d).firefly.inp (generated)

004562048.b3lyp_6-31g(d).smash.inp (generated)

004562048.b3lyp_6-31g(d).nwchem.inp (generated) 004562048.b3lyp_6-31g(d).log.xz 004562048.td-b3lyp_6-31g+(d).inp 004562048.td-b3lyp_6-31g+(d).log.xz

004562048.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562048.td-b3lyp_6-31+g(d).gjf (generated)

004562048.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562048.mol 004562048.PUBCHEM 004562048.mol (via Jmol)
004562057.b3lyp_6-31g(d).inp

004562057.b3lyp_6-31g(d).qchem.inp (generated)

004562057.b3lyp_6-31g(d).gjf (generated)

004562057.b3lyp_6-31g(d).firefly.inp (generated)

004562057.b3lyp_6-31g(d).smash.inp (generated)

004562057.b3lyp_6-31g(d).nwchem.inp (generated) 004562057.b3lyp_6-31g(d).log.xz 004562057.td-b3lyp_6-31g+(d).inp 004562057.td-b3lyp_6-31g+(d).log.xz

004562057.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562057.td-b3lyp_6-31+g(d).gjf (generated)

004562057.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562057.mol 004562057.PUBCHEM 004562057.mol (via Jmol)
004562059.b3lyp_6-31g(d).inp

004562059.b3lyp_6-31g(d).qchem.inp (generated)

004562059.b3lyp_6-31g(d).gjf (generated)

004562059.b3lyp_6-31g(d).firefly.inp (generated)

004562059.b3lyp_6-31g(d).smash.inp (generated)

004562059.b3lyp_6-31g(d).nwchem.inp (generated) 004562059.b3lyp_6-31g(d).log.xz 004562059.td-b3lyp_6-31g+(d).inp 004562059.td-b3lyp_6-31g+(d).log.xz

004562059.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562059.td-b3lyp_6-31+g(d).gjf (generated)

004562059.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562059.mol 004562059.PUBCHEM 004562059.mol (via Jmol)
004562078.b3lyp_6-31g(d).inp

004562078.b3lyp_6-31g(d).qchem.inp (generated)

004562078.b3lyp_6-31g(d).gjf (generated)

004562078.b3lyp_6-31g(d).firefly.inp (generated)

004562078.b3lyp_6-31g(d).smash.inp (generated)

004562078.b3lyp_6-31g(d).nwchem.inp (generated) 004562078.b3lyp_6-31g(d).log.xz 004562078.td-b3lyp_6-31g+(d).inp 004562078.td-b3lyp_6-31g+(d).log.xz

004562078.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562078.td-b3lyp_6-31+g(d).gjf (generated)

004562078.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562078.mol 004562078.PUBCHEM 004562078.mol (via Jmol)
004562079.b3lyp_6-31g(d).inp

004562079.b3lyp_6-31g(d).qchem.inp (generated)

004562079.b3lyp_6-31g(d).gjf (generated)

004562079.b3lyp_6-31g(d).firefly.inp (generated)

004562079.b3lyp_6-31g(d).smash.inp (generated)

004562079.b3lyp_6-31g(d).nwchem.inp (generated) 004562079.b3lyp_6-31g(d).log.xz 004562079.td-b3lyp_6-31g+(d).inp 004562079.td-b3lyp_6-31g+(d).log.xz

004562079.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562079.td-b3lyp_6-31+g(d).gjf (generated)

004562079.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562079.mol 004562079.PUBCHEM 004562079.mol (via Jmol)
004562080.b3lyp_6-31g(d).inp

004562080.b3lyp_6-31g(d).qchem.inp (generated)

004562080.b3lyp_6-31g(d).gjf (generated)

004562080.b3lyp_6-31g(d).firefly.inp (generated)

004562080.b3lyp_6-31g(d).smash.inp (generated)

004562080.b3lyp_6-31g(d).nwchem.inp (generated) 004562080.b3lyp_6-31g(d).log.xz 004562080.td-b3lyp_6-31g+(d).inp 004562080.td-b3lyp_6-31g+(d).log.xz

004562080.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562080.td-b3lyp_6-31+g(d).gjf (generated)

004562080.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562080.mol 004562080.PUBCHEM 004562080.mol (via Jmol)
004562081.b3lyp_6-31g(d).inp

004562081.b3lyp_6-31g(d).qchem.inp (generated)

004562081.b3lyp_6-31g(d).gjf (generated)

004562081.b3lyp_6-31g(d).firefly.inp (generated)

004562081.b3lyp_6-31g(d).smash.inp (generated)

004562081.b3lyp_6-31g(d).nwchem.inp (generated) 004562081.b3lyp_6-31g(d).log.xz 004562081.td-b3lyp_6-31g+(d).inp 004562081.td-b3lyp_6-31g+(d).log.xz

004562081.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562081.td-b3lyp_6-31+g(d).gjf (generated)

004562081.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562081.mol 004562081.PUBCHEM 004562081.mol (via Jmol)
004562082.b3lyp_6-31g(d).inp

004562082.b3lyp_6-31g(d).qchem.inp (generated)

004562082.b3lyp_6-31g(d).gjf (generated)

004562082.b3lyp_6-31g(d).firefly.inp (generated)

004562082.b3lyp_6-31g(d).smash.inp (generated)

004562082.b3lyp_6-31g(d).nwchem.inp (generated) 004562082.b3lyp_6-31g(d).log.xz 004562082.td-b3lyp_6-31g+(d).inp 004562082.td-b3lyp_6-31g+(d).log.xz

004562082.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562082.td-b3lyp_6-31+g(d).gjf (generated)

004562082.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562082.mol 004562082.PUBCHEM 004562082.mol (via Jmol)
004562083.b3lyp_6-31g(d).inp

004562083.b3lyp_6-31g(d).qchem.inp (generated)

004562083.b3lyp_6-31g(d).gjf (generated)

004562083.b3lyp_6-31g(d).firefly.inp (generated)

004562083.b3lyp_6-31g(d).smash.inp (generated)

004562083.b3lyp_6-31g(d).nwchem.inp (generated) 004562083.b3lyp_6-31g(d).log.xz 004562083.td-b3lyp_6-31g+(d).inp 004562083.td-b3lyp_6-31g+(d).log.xz

004562083.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562083.td-b3lyp_6-31+g(d).gjf (generated)

004562083.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562083.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562083.mol 004562083.PUBCHEM 004562083.mol (via Jmol)
004562084.b3lyp_6-31g(d).inp

004562084.b3lyp_6-31g(d).qchem.inp (generated)

004562084.b3lyp_6-31g(d).gjf (generated)

004562084.b3lyp_6-31g(d).firefly.inp (generated)

004562084.b3lyp_6-31g(d).smash.inp (generated)

004562084.b3lyp_6-31g(d).nwchem.inp (generated) 004562084.b3lyp_6-31g(d).log.xz 004562084.td-b3lyp_6-31g+(d).inp 004562084.td-b3lyp_6-31g+(d).log.xz

004562084.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562084.td-b3lyp_6-31+g(d).gjf (generated)

004562084.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562084.mol 004562084.PUBCHEM 004562084.mol (via Jmol)
004562085.b3lyp_6-31g(d).inp

004562085.b3lyp_6-31g(d).qchem.inp (generated)

004562085.b3lyp_6-31g(d).gjf (generated)

004562085.b3lyp_6-31g(d).firefly.inp (generated)

004562085.b3lyp_6-31g(d).smash.inp (generated)

004562085.b3lyp_6-31g(d).nwchem.inp (generated) 004562085.b3lyp_6-31g(d).log.xz 004562085.td-b3lyp_6-31g+(d).inp 004562085.td-b3lyp_6-31g+(d).log.xz

004562085.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562085.td-b3lyp_6-31+g(d).gjf (generated)

004562085.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562085.mol 004562085.PUBCHEM 004562085.mol (via Jmol)
004562099.b3lyp_6-31g(d).inp

004562099.b3lyp_6-31g(d).qchem.inp (generated)

004562099.b3lyp_6-31g(d).gjf (generated)

004562099.b3lyp_6-31g(d).firefly.inp (generated)

004562099.b3lyp_6-31g(d).smash.inp (generated)

004562099.b3lyp_6-31g(d).nwchem.inp (generated) 004562099.b3lyp_6-31g(d).log.xz 004562099.td-b3lyp_6-31g+(d).inp 004562099.td-b3lyp_6-31g+(d).log.xz

004562099.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562099.td-b3lyp_6-31+g(d).gjf (generated)

004562099.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562099.mol 004562099.PUBCHEM 004562099.mol (via Jmol)
004562168.b3lyp_6-31g(d).inp

004562168.b3lyp_6-31g(d).qchem.inp (generated)

004562168.b3lyp_6-31g(d).gjf (generated)

004562168.b3lyp_6-31g(d).firefly.inp (generated)

004562168.b3lyp_6-31g(d).smash.inp (generated)

004562168.b3lyp_6-31g(d).nwchem.inp (generated) 004562168.b3lyp_6-31g(d).log.xz 004562168.td-b3lyp_6-31g+(d).inp 004562168.td-b3lyp_6-31g+(d).log.xz

004562168.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562168.td-b3lyp_6-31+g(d).gjf (generated)

004562168.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562168.mol 004562168.PUBCHEM 004562168.mol (via Jmol)
004562186.b3lyp_6-31g(d).inp

004562186.b3lyp_6-31g(d).qchem.inp (generated)

004562186.b3lyp_6-31g(d).gjf (generated)

004562186.b3lyp_6-31g(d).firefly.inp (generated)

004562186.b3lyp_6-31g(d).smash.inp (generated)

004562186.b3lyp_6-31g(d).nwchem.inp (generated) 004562186.b3lyp_6-31g(d).log.xz 004562186.td-b3lyp_6-31g+(d).inp 004562186.td-b3lyp_6-31g+(d).log.xz

004562186.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562186.td-b3lyp_6-31+g(d).gjf (generated)

004562186.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562186.mol 004562186.PUBCHEM 004562186.mol (via Jmol)
004562282.b3lyp_6-31g(d).inp

004562282.b3lyp_6-31g(d).qchem.inp (generated)

004562282.b3lyp_6-31g(d).gjf (generated)

004562282.b3lyp_6-31g(d).firefly.inp (generated)

004562282.b3lyp_6-31g(d).smash.inp (generated)

004562282.b3lyp_6-31g(d).nwchem.inp (generated) 004562282.b3lyp_6-31g(d).log.xz 004562282.td-b3lyp_6-31g+(d).inp 004562282.td-b3lyp_6-31g+(d).log.xz

004562282.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562282.td-b3lyp_6-31+g(d).gjf (generated)

004562282.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562282.mol 004562282.PUBCHEM 004562282.mol (via Jmol)
004562283.b3lyp_6-31g(d).inp

004562283.b3lyp_6-31g(d).qchem.inp (generated)

004562283.b3lyp_6-31g(d).gjf (generated)

004562283.b3lyp_6-31g(d).firefly.inp (generated)

004562283.b3lyp_6-31g(d).smash.inp (generated)

004562283.b3lyp_6-31g(d).nwchem.inp (generated) 004562283.b3lyp_6-31g(d).log.xz 004562283.td-b3lyp_6-31g+(d).inp 004562283.td-b3lyp_6-31g+(d).log.xz

004562283.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562283.td-b3lyp_6-31+g(d).gjf (generated)

004562283.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562283.mol 004562283.PUBCHEM 004562283.mol (via Jmol)
004562286.b3lyp_6-31g(d).inp

004562286.b3lyp_6-31g(d).qchem.inp (generated)

004562286.b3lyp_6-31g(d).gjf (generated)

004562286.b3lyp_6-31g(d).firefly.inp (generated)

004562286.b3lyp_6-31g(d).smash.inp (generated)

004562286.b3lyp_6-31g(d).nwchem.inp (generated) 004562286.b3lyp_6-31g(d).log.xz 004562286.td-b3lyp_6-31g+(d).inp 004562286.td-b3lyp_6-31g+(d).log.xz

004562286.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562286.td-b3lyp_6-31+g(d).gjf (generated)

004562286.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562286.mol 004562286.PUBCHEM 004562286.mol (via Jmol)
004562291.b3lyp_6-31g(d).inp

004562291.b3lyp_6-31g(d).qchem.inp (generated)

004562291.b3lyp_6-31g(d).gjf (generated)

004562291.b3lyp_6-31g(d).firefly.inp (generated)

004562291.b3lyp_6-31g(d).smash.inp (generated)

004562291.b3lyp_6-31g(d).nwchem.inp (generated) 004562291.b3lyp_6-31g(d).log.xz 004562291.mol 004562291.PUBCHEM 004562291.mol (via Jmol)
004562380.b3lyp_6-31g(d).inp

004562380.b3lyp_6-31g(d).qchem.inp (generated)

004562380.b3lyp_6-31g(d).gjf (generated)

004562380.b3lyp_6-31g(d).firefly.inp (generated)

004562380.b3lyp_6-31g(d).smash.inp (generated)

004562380.b3lyp_6-31g(d).nwchem.inp (generated) 004562380.b3lyp_6-31g(d).log.xz 004562380.td-b3lyp_6-31g+(d).inp 004562380.td-b3lyp_6-31g+(d).log.xz

004562380.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562380.td-b3lyp_6-31+g(d).gjf (generated)

004562380.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562380.mol 004562380.PUBCHEM 004562380.mol (via Jmol)
004562410.b3lyp_6-31g(d).inp

004562410.b3lyp_6-31g(d).qchem.inp (generated)

004562410.b3lyp_6-31g(d).gjf (generated)

004562410.b3lyp_6-31g(d).firefly.inp (generated)

004562410.b3lyp_6-31g(d).smash.inp (generated)

004562410.b3lyp_6-31g(d).nwchem.inp (generated) 004562410.b3lyp_6-31g(d).log.xz 004562410.td-b3lyp_6-31g+(d).inp 004562410.td-b3lyp_6-31g+(d).log.xz

004562410.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562410.td-b3lyp_6-31+g(d).gjf (generated)

004562410.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562410.mol 004562410.PUBCHEM 004562410.mol (via Jmol)
004562417.b3lyp_6-31g(d).inp

004562417.b3lyp_6-31g(d).qchem.inp (generated)

004562417.b3lyp_6-31g(d).gjf (generated)

004562417.b3lyp_6-31g(d).firefly.inp (generated)

004562417.b3lyp_6-31g(d).smash.inp (generated)

004562417.b3lyp_6-31g(d).nwchem.inp (generated) 004562417.b3lyp_6-31g(d).log.xz 004562417.td-b3lyp_6-31g+(d).inp 004562417.td-b3lyp_6-31g+(d).log.xz

004562417.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562417.td-b3lyp_6-31+g(d).gjf (generated)

004562417.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562417.mol 004562417.PUBCHEM 004562417.mol (via Jmol)
004562539.b3lyp_6-31g(d).inp

004562539.b3lyp_6-31g(d).qchem.inp (generated)

004562539.b3lyp_6-31g(d).gjf (generated)

004562539.b3lyp_6-31g(d).firefly.inp (generated)

004562539.b3lyp_6-31g(d).smash.inp (generated)

004562539.b3lyp_6-31g(d).nwchem.inp (generated) 004562539.b3lyp_6-31g(d).log.xz 004562539.td-b3lyp_6-31g+(d).inp 004562539.td-b3lyp_6-31g+(d).log.xz

004562539.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562539.td-b3lyp_6-31+g(d).gjf (generated)

004562539.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562539.mol 004562539.PUBCHEM 004562539.mol (via Jmol)
004562547.b3lyp_6-31g(d).inp

004562547.b3lyp_6-31g(d).qchem.inp (generated)

004562547.b3lyp_6-31g(d).gjf (generated)

004562547.b3lyp_6-31g(d).firefly.inp (generated)

004562547.b3lyp_6-31g(d).smash.inp (generated)

004562547.b3lyp_6-31g(d).nwchem.inp (generated) 004562547.b3lyp_6-31g(d).log.xz 004562547.td-b3lyp_6-31g+(d).inp 004562547.td-b3lyp_6-31g+(d).log.xz

004562547.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562547.td-b3lyp_6-31+g(d).gjf (generated)

004562547.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562547.mol 004562547.PUBCHEM 004562547.mol (via Jmol)
004562553.b3lyp_6-31g(d).inp

004562553.b3lyp_6-31g(d).qchem.inp (generated)

004562553.b3lyp_6-31g(d).gjf (generated)

004562553.b3lyp_6-31g(d).firefly.inp (generated)

004562553.b3lyp_6-31g(d).smash.inp (generated)

004562553.b3lyp_6-31g(d).nwchem.inp (generated) 004562553.b3lyp_6-31g(d).log.xz 004562553.td-b3lyp_6-31g+(d).inp 004562553.td-b3lyp_6-31g+(d).log.xz

004562553.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562553.td-b3lyp_6-31+g(d).gjf (generated)

004562553.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562553.mol 004562553.PUBCHEM 004562553.mol (via Jmol)
004562563.b3lyp_6-31g(d).inp

004562563.b3lyp_6-31g(d).qchem.inp (generated)

004562563.b3lyp_6-31g(d).gjf (generated)

004562563.b3lyp_6-31g(d).firefly.inp (generated)

004562563.b3lyp_6-31g(d).smash.inp (generated)

004562563.b3lyp_6-31g(d).nwchem.inp (generated) 004562563.b3lyp_6-31g(d).log.xz 004562563.td-b3lyp_6-31g+(d).inp 004562563.td-b3lyp_6-31g+(d).log.xz

004562563.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562563.td-b3lyp_6-31+g(d).gjf (generated)

004562563.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562563.mol 004562563.PUBCHEM 004562563.mol (via Jmol)
004562585.b3lyp_6-31g(d).inp

004562585.b3lyp_6-31g(d).qchem.inp (generated)

004562585.b3lyp_6-31g(d).gjf (generated)

004562585.b3lyp_6-31g(d).firefly.inp (generated)

004562585.b3lyp_6-31g(d).smash.inp (generated)

004562585.b3lyp_6-31g(d).nwchem.inp (generated) 004562585.b3lyp_6-31g(d).log.xz 004562585.td-b3lyp_6-31g+(d).inp 004562585.td-b3lyp_6-31g+(d).log.xz

004562585.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562585.td-b3lyp_6-31+g(d).gjf (generated)

004562585.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562585.mol 004562585.PUBCHEM 004562585.mol (via Jmol)
004562641.b3lyp_6-31g(d).inp

004562641.b3lyp_6-31g(d).qchem.inp (generated)

004562641.b3lyp_6-31g(d).gjf (generated)

004562641.b3lyp_6-31g(d).firefly.inp (generated)

004562641.b3lyp_6-31g(d).smash.inp (generated)

004562641.b3lyp_6-31g(d).nwchem.inp (generated) 004562641.b3lyp_6-31g(d).log.xz 004562641.td-b3lyp_6-31g+(d).inp 004562641.td-b3lyp_6-31g+(d).log.xz

004562641.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562641.td-b3lyp_6-31+g(d).gjf (generated)

004562641.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562641.mol 004562641.PUBCHEM 004562641.mol (via Jmol)
004562647.b3lyp_6-31g(d).inp

004562647.b3lyp_6-31g(d).qchem.inp (generated)

004562647.b3lyp_6-31g(d).gjf (generated)

004562647.b3lyp_6-31g(d).firefly.inp (generated)

004562647.b3lyp_6-31g(d).smash.inp (generated)

004562647.b3lyp_6-31g(d).nwchem.inp (generated) 004562647.b3lyp_6-31g(d).log.xz 004562647.td-b3lyp_6-31g+(d).inp 004562647.td-b3lyp_6-31g+(d).log.xz

004562647.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562647.td-b3lyp_6-31+g(d).gjf (generated)

004562647.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562647.mol 004562647.PUBCHEM 004562647.mol (via Jmol)
004562648.b3lyp_6-31g(d).inp

004562648.b3lyp_6-31g(d).qchem.inp (generated)

004562648.b3lyp_6-31g(d).gjf (generated)

004562648.b3lyp_6-31g(d).firefly.inp (generated)

004562648.b3lyp_6-31g(d).smash.inp (generated)

004562648.b3lyp_6-31g(d).nwchem.inp (generated) 004562648.b3lyp_6-31g(d).log.xz 004562648.td-b3lyp_6-31g+(d).inp 004562648.td-b3lyp_6-31g+(d).log.xz

004562648.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562648.td-b3lyp_6-31+g(d).gjf (generated)

004562648.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562648.mol 004562648.PUBCHEM 004562648.mol (via Jmol)
004562711.b3lyp_6-31g(d).inp

004562711.b3lyp_6-31g(d).qchem.inp (generated)

004562711.b3lyp_6-31g(d).gjf (generated)

004562711.b3lyp_6-31g(d).firefly.inp (generated)

004562711.b3lyp_6-31g(d).smash.inp (generated)

004562711.b3lyp_6-31g(d).nwchem.inp (generated) 004562711.b3lyp_6-31g(d).log.xz 004562711.td-b3lyp_6-31g+(d).inp 004562711.td-b3lyp_6-31g+(d).log.xz

004562711.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562711.td-b3lyp_6-31+g(d).gjf (generated)

004562711.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562711.mol 004562711.PUBCHEM 004562711.mol (via Jmol)
004562713.b3lyp_6-31g(d).inp

004562713.b3lyp_6-31g(d).qchem.inp (generated)

004562713.b3lyp_6-31g(d).gjf (generated)

004562713.b3lyp_6-31g(d).firefly.inp (generated)

004562713.b3lyp_6-31g(d).smash.inp (generated)

004562713.b3lyp_6-31g(d).nwchem.inp (generated) 004562713.b3lyp_6-31g(d).log.xz 004562713.td-b3lyp_6-31g+(d).inp 004562713.td-b3lyp_6-31g+(d).log.xz

004562713.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562713.td-b3lyp_6-31+g(d).gjf (generated)

004562713.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562713.mol 004562713.PUBCHEM 004562713.mol (via Jmol)
004562769.b3lyp_6-31g(d).inp

004562769.b3lyp_6-31g(d).qchem.inp (generated)

004562769.b3lyp_6-31g(d).gjf (generated)

004562769.b3lyp_6-31g(d).firefly.inp (generated)

004562769.b3lyp_6-31g(d).smash.inp (generated)

004562769.b3lyp_6-31g(d).nwchem.inp (generated) 004562769.b3lyp_6-31g(d).log.xz 004562769.td-b3lyp_6-31g+(d).inp 004562769.td-b3lyp_6-31g+(d).log.xz

004562769.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562769.td-b3lyp_6-31+g(d).gjf (generated)

004562769.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562769.mol 004562769.PUBCHEM 004562769.mol (via Jmol)
004562798.b3lyp_6-31g(d).inp

004562798.b3lyp_6-31g(d).qchem.inp (generated)

004562798.b3lyp_6-31g(d).gjf (generated)

004562798.b3lyp_6-31g(d).firefly.inp (generated)

004562798.b3lyp_6-31g(d).smash.inp (generated)

004562798.b3lyp_6-31g(d).nwchem.inp (generated) 004562798.b3lyp_6-31g(d).log.xz 004562798.mol 004562798.PUBCHEM 004562798.mol (via Jmol)
004562853.b3lyp_6-31g(d).inp

004562853.b3lyp_6-31g(d).qchem.inp (generated)

004562853.b3lyp_6-31g(d).gjf (generated)

004562853.b3lyp_6-31g(d).firefly.inp (generated)

004562853.b3lyp_6-31g(d).smash.inp (generated)

004562853.b3lyp_6-31g(d).nwchem.inp (generated) 004562853.b3lyp_6-31g(d).log.xz 004562853.td-b3lyp_6-31g+(d).inp 004562853.td-b3lyp_6-31g+(d).log.xz

004562853.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562853.td-b3lyp_6-31+g(d).gjf (generated)

004562853.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562853.mol 004562853.PUBCHEM 004562853.mol (via Jmol)
004562873.b3lyp_6-31g(d).inp

004562873.b3lyp_6-31g(d).qchem.inp (generated)

004562873.b3lyp_6-31g(d).gjf (generated)

004562873.b3lyp_6-31g(d).firefly.inp (generated)

004562873.b3lyp_6-31g(d).smash.inp (generated)

004562873.b3lyp_6-31g(d).nwchem.inp (generated) 004562873.b3lyp_6-31g(d).log.xz 004562873.td-b3lyp_6-31g+(d).inp 004562873.td-b3lyp_6-31g+(d).log.xz

004562873.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562873.td-b3lyp_6-31+g(d).gjf (generated)

004562873.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562873.mol 004562873.PUBCHEM 004562873.mol (via Jmol)
004562919.b3lyp_6-31g(d).inp

004562919.b3lyp_6-31g(d).qchem.inp (generated)

004562919.b3lyp_6-31g(d).gjf (generated)

004562919.b3lyp_6-31g(d).firefly.inp (generated)

004562919.b3lyp_6-31g(d).smash.inp (generated)

004562919.b3lyp_6-31g(d).nwchem.inp (generated) 004562919.b3lyp_6-31g(d).log.xz 004562919.td-b3lyp_6-31g+(d).inp 004562919.td-b3lyp_6-31g+(d).log.xz

004562919.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562919.td-b3lyp_6-31+g(d).gjf (generated)

004562919.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562919.mol 004562919.PUBCHEM 004562919.mol (via Jmol)
004562956.b3lyp_6-31g(d).inp

004562956.b3lyp_6-31g(d).qchem.inp (generated)

004562956.b3lyp_6-31g(d).gjf (generated)

004562956.b3lyp_6-31g(d).firefly.inp (generated)

004562956.b3lyp_6-31g(d).smash.inp (generated)

004562956.b3lyp_6-31g(d).nwchem.inp (generated) 004562956.b3lyp_6-31g(d).log.xz 004562956.td-b3lyp_6-31g+(d).inp 004562956.td-b3lyp_6-31g+(d).log.xz

004562956.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562956.td-b3lyp_6-31+g(d).gjf (generated)

004562956.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562956.mol 004562956.PUBCHEM 004562956.mol (via Jmol)
004562976.b3lyp_6-31g(d).inp

004562976.b3lyp_6-31g(d).qchem.inp (generated)

004562976.b3lyp_6-31g(d).gjf (generated)

004562976.b3lyp_6-31g(d).firefly.inp (generated)

004562976.b3lyp_6-31g(d).smash.inp (generated)

004562976.b3lyp_6-31g(d).nwchem.inp (generated) 004562976.b3lyp_6-31g(d).log.xz 004562976.td-b3lyp_6-31g+(d).inp 004562976.td-b3lyp_6-31g+(d).log.xz

004562976.td-b3lyp_6-31+g(d).qchem.inp (generated)

004562976.td-b3lyp_6-31+g(d).gjf (generated)

004562976.td-b3lyp_6-31+g(d).firefly.inp (generated)

004562976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004562976.mol 004562976.PUBCHEM 004562976.mol (via Jmol)
004563031.b3lyp_6-31g(d).inp

004563031.b3lyp_6-31g(d).qchem.inp (generated)

004563031.b3lyp_6-31g(d).gjf (generated)

004563031.b3lyp_6-31g(d).firefly.inp (generated)

004563031.b3lyp_6-31g(d).smash.inp (generated)

004563031.b3lyp_6-31g(d).nwchem.inp (generated) 004563031.b3lyp_6-31g(d).log.xz 004563031.td-b3lyp_6-31g+(d).inp 004563031.td-b3lyp_6-31g+(d).log.xz

004563031.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563031.td-b3lyp_6-31+g(d).gjf (generated)

004563031.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563031.mol 004563031.PUBCHEM 004563031.mol (via Jmol)
004563032.b3lyp_6-31g(d).inp

004563032.b3lyp_6-31g(d).qchem.inp (generated)

004563032.b3lyp_6-31g(d).gjf (generated)

004563032.b3lyp_6-31g(d).firefly.inp (generated)

004563032.b3lyp_6-31g(d).smash.inp (generated)

004563032.b3lyp_6-31g(d).nwchem.inp (generated) 004563032.b3lyp_6-31g(d).log.xz 004563032.td-b3lyp_6-31g+(d).inp 004563032.td-b3lyp_6-31g+(d).log.xz

004563032.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563032.td-b3lyp_6-31+g(d).gjf (generated)

004563032.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563032.mol 004563032.PUBCHEM 004563032.mol (via Jmol)
004563066.b3lyp_6-31g(d).inp

004563066.b3lyp_6-31g(d).qchem.inp (generated)

004563066.b3lyp_6-31g(d).gjf (generated)

004563066.b3lyp_6-31g(d).firefly.inp (generated)

004563066.b3lyp_6-31g(d).smash.inp (generated)

004563066.b3lyp_6-31g(d).nwchem.inp (generated) 004563066.b3lyp_6-31g(d).log.xz 004563066.td-b3lyp_6-31g+(d).inp 004563066.td-b3lyp_6-31g+(d).log.xz

004563066.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563066.td-b3lyp_6-31+g(d).gjf (generated)

004563066.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563066.mol 004563066.PUBCHEM 004563066.mol (via Jmol)
004563078.b3lyp_6-31g(d).inp

004563078.b3lyp_6-31g(d).qchem.inp (generated)

004563078.b3lyp_6-31g(d).gjf (generated)

004563078.b3lyp_6-31g(d).firefly.inp (generated)

004563078.b3lyp_6-31g(d).smash.inp (generated)

004563078.b3lyp_6-31g(d).nwchem.inp (generated) 004563078.b3lyp_6-31g(d).log.xz 004563078.mol 004563078.PUBCHEM 004563078.mol (via Jmol)
004563102.b3lyp_6-31g(d).inp

004563102.b3lyp_6-31g(d).qchem.inp (generated)

004563102.b3lyp_6-31g(d).gjf (generated)

004563102.b3lyp_6-31g(d).firefly.inp (generated)

004563102.b3lyp_6-31g(d).smash.inp (generated)

004563102.b3lyp_6-31g(d).nwchem.inp (generated) 004563102.b3lyp_6-31g(d).log.xz 004563102.mol 004563102.PUBCHEM 004563102.mol (via Jmol)
004563111.b3lyp_6-31g(d).inp

004563111.b3lyp_6-31g(d).qchem.inp (generated)

004563111.b3lyp_6-31g(d).gjf (generated)

004563111.b3lyp_6-31g(d).firefly.inp (generated)

004563111.b3lyp_6-31g(d).smash.inp (generated)

004563111.b3lyp_6-31g(d).nwchem.inp (generated) 004563111.b3lyp_6-31g(d).log.xz 004563111.td-b3lyp_6-31g+(d).inp 004563111.td-b3lyp_6-31g+(d).log.xz

004563111.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563111.td-b3lyp_6-31+g(d).gjf (generated)

004563111.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563111.mol 004563111.PUBCHEM 004563111.mol (via Jmol)
004563237.b3lyp_6-31g(d).inp

004563237.b3lyp_6-31g(d).qchem.inp (generated)

004563237.b3lyp_6-31g(d).gjf (generated)

004563237.b3lyp_6-31g(d).firefly.inp (generated)

004563237.b3lyp_6-31g(d).smash.inp (generated)

004563237.b3lyp_6-31g(d).nwchem.inp (generated) 004563237.b3lyp_6-31g(d).log.xz 004563237.td-b3lyp_6-31g+(d).inp 004563237.td-b3lyp_6-31g+(d).log.xz

004563237.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563237.td-b3lyp_6-31+g(d).gjf (generated)

004563237.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563237.mol 004563237.PUBCHEM 004563237.mol (via Jmol)
004563248.b3lyp_6-31g(d).inp

004563248.b3lyp_6-31g(d).qchem.inp (generated)

004563248.b3lyp_6-31g(d).gjf (generated)

004563248.b3lyp_6-31g(d).firefly.inp (generated)

004563248.b3lyp_6-31g(d).smash.inp (generated)

004563248.b3lyp_6-31g(d).nwchem.inp (generated) 004563248.b3lyp_6-31g(d).log.xz 004563248.td-b3lyp_6-31g+(d).inp 004563248.td-b3lyp_6-31g+(d).log.xz

004563248.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563248.td-b3lyp_6-31+g(d).gjf (generated)

004563248.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563248.mol 004563248.PUBCHEM 004563248.mol (via Jmol)
004563324.b3lyp_6-31g(d).inp

004563324.b3lyp_6-31g(d).qchem.inp (generated)

004563324.b3lyp_6-31g(d).gjf (generated)

004563324.b3lyp_6-31g(d).firefly.inp (generated)

004563324.b3lyp_6-31g(d).smash.inp (generated)

004563324.b3lyp_6-31g(d).nwchem.inp (generated) 004563324.b3lyp_6-31g(d).log.xz 004563324.td-b3lyp_6-31g+(d).inp 004563324.td-b3lyp_6-31g+(d).log.xz

004563324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563324.td-b3lyp_6-31+g(d).gjf (generated)

004563324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563324.mol 004563324.PUBCHEM 004563324.mol (via Jmol)
004563447.b3lyp_6-31g(d).inp

004563447.b3lyp_6-31g(d).qchem.inp (generated)

004563447.b3lyp_6-31g(d).gjf (generated)

004563447.b3lyp_6-31g(d).firefly.inp (generated)

004563447.b3lyp_6-31g(d).smash.inp (generated)

004563447.b3lyp_6-31g(d).nwchem.inp (generated) 004563447.b3lyp_6-31g(d).log.xz 004563447.mol 004563447.PUBCHEM 004563447.mol (via Jmol)
004563451.b3lyp_6-31g(d).inp

004563451.b3lyp_6-31g(d).qchem.inp (generated)

004563451.b3lyp_6-31g(d).gjf (generated)

004563451.b3lyp_6-31g(d).firefly.inp (generated)

004563451.b3lyp_6-31g(d).smash.inp (generated)

004563451.b3lyp_6-31g(d).nwchem.inp (generated) 004563451.b3lyp_6-31g(d).log.xz 004563451.td-b3lyp_6-31g+(d).inp 004563451.td-b3lyp_6-31g+(d).log.xz

004563451.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563451.td-b3lyp_6-31+g(d).gjf (generated)

004563451.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563451.mol 004563451.PUBCHEM 004563451.mol (via Jmol)
004563457.b3lyp_6-31g(d).inp

004563457.b3lyp_6-31g(d).qchem.inp (generated)

004563457.b3lyp_6-31g(d).gjf (generated)

004563457.b3lyp_6-31g(d).firefly.inp (generated)

004563457.b3lyp_6-31g(d).smash.inp (generated)

004563457.b3lyp_6-31g(d).nwchem.inp (generated) 004563457.b3lyp_6-31g(d).log.xz 004563457.mol 004563457.PUBCHEM 004563457.mol (via Jmol)
004563477.b3lyp_6-31g(d).inp

004563477.b3lyp_6-31g(d).qchem.inp (generated)

004563477.b3lyp_6-31g(d).gjf (generated)

004563477.b3lyp_6-31g(d).firefly.inp (generated)

004563477.b3lyp_6-31g(d).smash.inp (generated)

004563477.b3lyp_6-31g(d).nwchem.inp (generated) 004563477.b3lyp_6-31g(d).log.xz 004563477.td-b3lyp_6-31g+(d).inp 004563477.td-b3lyp_6-31g+(d).log.xz

004563477.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563477.td-b3lyp_6-31+g(d).gjf (generated)

004563477.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563477.mol 004563477.PUBCHEM 004563477.mol (via Jmol)
004563503.b3lyp_6-31g(d).inp

004563503.b3lyp_6-31g(d).qchem.inp (generated)

004563503.b3lyp_6-31g(d).gjf (generated)

004563503.b3lyp_6-31g(d).firefly.inp (generated)

004563503.b3lyp_6-31g(d).smash.inp (generated)

004563503.b3lyp_6-31g(d).nwchem.inp (generated) 004563503.b3lyp_6-31g(d).log.xz 004563503.td-b3lyp_6-31g+(d).inp 004563503.td-b3lyp_6-31g+(d).log.xz

004563503.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563503.td-b3lyp_6-31+g(d).gjf (generated)

004563503.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563503.mol 004563503.PUBCHEM 004563503.mol (via Jmol)
004563528.b3lyp_6-31g(d).inp

004563528.b3lyp_6-31g(d).qchem.inp (generated)

004563528.b3lyp_6-31g(d).gjf (generated)

004563528.b3lyp_6-31g(d).firefly.inp (generated)

004563528.b3lyp_6-31g(d).smash.inp (generated)

004563528.b3lyp_6-31g(d).nwchem.inp (generated) 004563528.b3lyp_6-31g(d).log.xz 004563528.td-b3lyp_6-31g+(d).inp 004563528.td-b3lyp_6-31g+(d).log.xz

004563528.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563528.td-b3lyp_6-31+g(d).gjf (generated)

004563528.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563528.mol 004563528.PUBCHEM 004563528.mol (via Jmol)
004563559.b3lyp_6-31g(d).inp

004563559.b3lyp_6-31g(d).qchem.inp (generated)

004563559.b3lyp_6-31g(d).gjf (generated)

004563559.b3lyp_6-31g(d).firefly.inp (generated)

004563559.b3lyp_6-31g(d).smash.inp (generated)

004563559.b3lyp_6-31g(d).nwchem.inp (generated) 004563559.b3lyp_6-31g(d).log.xz 004563559.td-b3lyp_6-31g+(d).inp 004563559.td-b3lyp_6-31g+(d).log.xz

004563559.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563559.td-b3lyp_6-31+g(d).gjf (generated)

004563559.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563559.mol 004563559.PUBCHEM 004563559.mol (via Jmol)
004563563.b3lyp_6-31g(d).inp

004563563.b3lyp_6-31g(d).qchem.inp (generated)

004563563.b3lyp_6-31g(d).gjf (generated)

004563563.b3lyp_6-31g(d).firefly.inp (generated)

004563563.b3lyp_6-31g(d).smash.inp (generated)

004563563.b3lyp_6-31g(d).nwchem.inp (generated) 004563563.b3lyp_6-31g(d).log.xz 004563563.mol 004563563.PUBCHEM 004563563.mol (via Jmol)
004563568.b3lyp_6-31g(d).inp

004563568.b3lyp_6-31g(d).qchem.inp (generated)

004563568.b3lyp_6-31g(d).gjf (generated)

004563568.b3lyp_6-31g(d).firefly.inp (generated)

004563568.b3lyp_6-31g(d).smash.inp (generated)

004563568.b3lyp_6-31g(d).nwchem.inp (generated) 004563568.b3lyp_6-31g(d).log.xz 004563568.td-b3lyp_6-31g+(d).inp 004563568.td-b3lyp_6-31g+(d).log.xz

004563568.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563568.td-b3lyp_6-31+g(d).gjf (generated)

004563568.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563568.mol 004563568.PUBCHEM 004563568.mol (via Jmol)
004563591.b3lyp_6-31g(d).inp

004563591.b3lyp_6-31g(d).qchem.inp (generated)

004563591.b3lyp_6-31g(d).gjf (generated)

004563591.b3lyp_6-31g(d).firefly.inp (generated)

004563591.b3lyp_6-31g(d).smash.inp (generated)

004563591.b3lyp_6-31g(d).nwchem.inp (generated) 004563591.b3lyp_6-31g(d).log.xz 004563591.td-b3lyp_6-31g+(d).inp 004563591.td-b3lyp_6-31g+(d).log.xz

004563591.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563591.td-b3lyp_6-31+g(d).gjf (generated)

004563591.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563591.mol 004563591.PUBCHEM 004563591.mol (via Jmol)
004563709.b3lyp_6-31g(d).inp

004563709.b3lyp_6-31g(d).qchem.inp (generated)

004563709.b3lyp_6-31g(d).gjf (generated)

004563709.b3lyp_6-31g(d).firefly.inp (generated)

004563709.b3lyp_6-31g(d).smash.inp (generated)

004563709.b3lyp_6-31g(d).nwchem.inp (generated) 004563709.b3lyp_6-31g(d).log.xz 004563709.td-b3lyp_6-31g+(d).inp 004563709.td-b3lyp_6-31g+(d).log.xz

004563709.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563709.td-b3lyp_6-31+g(d).gjf (generated)

004563709.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563709.mol 004563709.PUBCHEM 004563709.mol (via Jmol)
004563761.b3lyp_6-31g(d).inp

004563761.b3lyp_6-31g(d).qchem.inp (generated)

004563761.b3lyp_6-31g(d).gjf (generated)

004563761.b3lyp_6-31g(d).firefly.inp (generated)

004563761.b3lyp_6-31g(d).smash.inp (generated)

004563761.b3lyp_6-31g(d).nwchem.inp (generated) 004563761.b3lyp_6-31g(d).log.xz 004563761.td-b3lyp_6-31g+(d).inp 004563761.td-b3lyp_6-31g+(d).log.xz

004563761.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563761.td-b3lyp_6-31+g(d).gjf (generated)

004563761.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563761.mol 004563761.PUBCHEM 004563761.mol (via Jmol)
004563857.b3lyp_6-31g(d).inp

004563857.b3lyp_6-31g(d).qchem.inp (generated)

004563857.b3lyp_6-31g(d).gjf (generated)

004563857.b3lyp_6-31g(d).firefly.inp (generated)

004563857.b3lyp_6-31g(d).smash.inp (generated)

004563857.b3lyp_6-31g(d).nwchem.inp (generated) 004563857.b3lyp_6-31g(d).log.xz 004563857.td-b3lyp_6-31g+(d).inp 004563857.td-b3lyp_6-31g+(d).log.xz

004563857.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563857.td-b3lyp_6-31+g(d).gjf (generated)

004563857.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563857.mol 004563857.PUBCHEM 004563857.mol (via Jmol)
004563859.b3lyp_6-31g(d).inp

004563859.b3lyp_6-31g(d).qchem.inp (generated)

004563859.b3lyp_6-31g(d).gjf (generated)

004563859.b3lyp_6-31g(d).firefly.inp (generated)

004563859.b3lyp_6-31g(d).smash.inp (generated)

004563859.b3lyp_6-31g(d).nwchem.inp (generated) 004563859.b3lyp_6-31g(d).log.xz 004563859.td-b3lyp_6-31g+(d).inp 004563859.td-b3lyp_6-31g+(d).log.xz

004563859.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563859.td-b3lyp_6-31+g(d).gjf (generated)

004563859.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563859.mol 004563859.PUBCHEM 004563859.mol (via Jmol)
004563900.b3lyp_6-31g(d).inp

004563900.b3lyp_6-31g(d).qchem.inp (generated)

004563900.b3lyp_6-31g(d).gjf (generated)

004563900.b3lyp_6-31g(d).firefly.inp (generated)

004563900.b3lyp_6-31g(d).smash.inp (generated)

004563900.b3lyp_6-31g(d).nwchem.inp (generated) 004563900.b3lyp_6-31g(d).log.xz 004563900.td-b3lyp_6-31g+(d).inp 004563900.td-b3lyp_6-31g+(d).log.xz

004563900.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563900.td-b3lyp_6-31+g(d).gjf (generated)

004563900.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563900.mol 004563900.PUBCHEM 004563900.mol (via Jmol)
004563901.b3lyp_6-31g(d).inp

004563901.b3lyp_6-31g(d).qchem.inp (generated)

004563901.b3lyp_6-31g(d).gjf (generated)

004563901.b3lyp_6-31g(d).firefly.inp (generated)

004563901.b3lyp_6-31g(d).smash.inp (generated)

004563901.b3lyp_6-31g(d).nwchem.inp (generated) 004563901.b3lyp_6-31g(d).log.xz 004563901.td-b3lyp_6-31g+(d).inp 004563901.td-b3lyp_6-31g+(d).log.xz

004563901.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563901.td-b3lyp_6-31+g(d).gjf (generated)

004563901.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563901.mol 004563901.PUBCHEM 004563901.mol (via Jmol)
004563922.b3lyp_6-31g(d).inp

004563922.b3lyp_6-31g(d).qchem.inp (generated)

004563922.b3lyp_6-31g(d).gjf (generated)

004563922.b3lyp_6-31g(d).firefly.inp (generated)

004563922.b3lyp_6-31g(d).smash.inp (generated)

004563922.b3lyp_6-31g(d).nwchem.inp (generated) 004563922.b3lyp_6-31g(d).log.xz 004563922.td-b3lyp_6-31g+(d).inp 004563922.td-b3lyp_6-31g+(d).log.xz

004563922.td-b3lyp_6-31+g(d).qchem.inp (generated)

004563922.td-b3lyp_6-31+g(d).gjf (generated)

004563922.td-b3lyp_6-31+g(d).firefly.inp (generated)

004563922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004563922.mol 004563922.PUBCHEM 004563922.mol (via Jmol)
004564024.b3lyp_6-31g(d).inp

004564024.b3lyp_6-31g(d).qchem.inp (generated)

004564024.b3lyp_6-31g(d).gjf (generated)

004564024.b3lyp_6-31g(d).firefly.inp (generated)

004564024.b3lyp_6-31g(d).smash.inp (generated)

004564024.b3lyp_6-31g(d).nwchem.inp (generated) 004564024.b3lyp_6-31g(d).log.xz 004564024.td-b3lyp_6-31g+(d).inp 004564024.td-b3lyp_6-31g+(d).log.xz

004564024.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564024.td-b3lyp_6-31+g(d).gjf (generated)

004564024.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564024.mol 004564024.PUBCHEM 004564024.mol (via Jmol)
004564124.b3lyp_6-31g(d).inp

004564124.b3lyp_6-31g(d).qchem.inp (generated)

004564124.b3lyp_6-31g(d).gjf (generated)

004564124.b3lyp_6-31g(d).firefly.inp (generated)

004564124.b3lyp_6-31g(d).smash.inp (generated)

004564124.b3lyp_6-31g(d).nwchem.inp (generated) 004564124.b3lyp_6-31g(d).log.xz 004564124.td-b3lyp_6-31g+(d).inp 004564124.td-b3lyp_6-31g+(d).log.xz

004564124.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564124.td-b3lyp_6-31+g(d).gjf (generated)

004564124.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564124.mol 004564124.PUBCHEM 004564124.mol (via Jmol)
004564161.b3lyp_6-31g(d).inp

004564161.b3lyp_6-31g(d).qchem.inp (generated)

004564161.b3lyp_6-31g(d).gjf (generated)

004564161.b3lyp_6-31g(d).firefly.inp (generated)

004564161.b3lyp_6-31g(d).smash.inp (generated)

004564161.b3lyp_6-31g(d).nwchem.inp (generated) 004564161.b3lyp_6-31g(d).log.xz 004564161.td-b3lyp_6-31g+(d).inp 004564161.td-b3lyp_6-31g+(d).log.xz

004564161.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564161.td-b3lyp_6-31+g(d).gjf (generated)

004564161.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564161.mol 004564161.PUBCHEM 004564161.mol (via Jmol)
004564162.b3lyp_6-31g(d).inp

004564162.b3lyp_6-31g(d).qchem.inp (generated)

004564162.b3lyp_6-31g(d).gjf (generated)

004564162.b3lyp_6-31g(d).firefly.inp (generated)

004564162.b3lyp_6-31g(d).smash.inp (generated)

004564162.b3lyp_6-31g(d).nwchem.inp (generated) 004564162.b3lyp_6-31g(d).log.xz 004564162.td-b3lyp_6-31g+(d).inp 004564162.td-b3lyp_6-31g+(d).log.xz

004564162.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564162.td-b3lyp_6-31+g(d).gjf (generated)

004564162.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564162.mol 004564162.PUBCHEM 004564162.mol (via Jmol)
004564241.b3lyp_6-31g(d).inp

004564241.b3lyp_6-31g(d).qchem.inp (generated)

004564241.b3lyp_6-31g(d).gjf (generated)

004564241.b3lyp_6-31g(d).firefly.inp (generated)

004564241.b3lyp_6-31g(d).smash.inp (generated)

004564241.b3lyp_6-31g(d).nwchem.inp (generated) 004564241.b3lyp_6-31g(d).log.xz 004564241.mol 004564241.PUBCHEM 004564241.mol (via Jmol)
004564244.b3lyp_6-31g(d).inp

004564244.b3lyp_6-31g(d).qchem.inp (generated)

004564244.b3lyp_6-31g(d).gjf (generated)

004564244.b3lyp_6-31g(d).firefly.inp (generated)

004564244.b3lyp_6-31g(d).smash.inp (generated)

004564244.b3lyp_6-31g(d).nwchem.inp (generated) 004564244.b3lyp_6-31g(d).log.xz 004564244.td-b3lyp_6-31g+(d).inp 004564244.td-b3lyp_6-31g+(d).log.xz

004564244.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564244.td-b3lyp_6-31+g(d).gjf (generated)

004564244.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564244.mol 004564244.PUBCHEM 004564244.mol (via Jmol)
004564251.b3lyp_6-31g(d).inp

004564251.b3lyp_6-31g(d).qchem.inp (generated)

004564251.b3lyp_6-31g(d).gjf (generated)

004564251.b3lyp_6-31g(d).firefly.inp (generated)

004564251.b3lyp_6-31g(d).smash.inp (generated)

004564251.b3lyp_6-31g(d).nwchem.inp (generated) 004564251.b3lyp_6-31g(d).log.xz 004564251.mol 004564251.PUBCHEM 004564251.mol (via Jmol)
004564319.b3lyp_6-31g(d).inp

004564319.b3lyp_6-31g(d).qchem.inp (generated)

004564319.b3lyp_6-31g(d).gjf (generated)

004564319.b3lyp_6-31g(d).firefly.inp (generated)

004564319.b3lyp_6-31g(d).smash.inp (generated)

004564319.b3lyp_6-31g(d).nwchem.inp (generated) 004564319.b3lyp_6-31g(d).log.xz 004564319.td-b3lyp_6-31g+(d).inp 004564319.td-b3lyp_6-31g+(d).log.xz

004564319.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564319.td-b3lyp_6-31+g(d).gjf (generated)

004564319.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564319.mol 004564319.PUBCHEM 004564319.mol (via Jmol)
004564338.b3lyp_6-31g(d).inp

004564338.b3lyp_6-31g(d).qchem.inp (generated)

004564338.b3lyp_6-31g(d).gjf (generated)

004564338.b3lyp_6-31g(d).firefly.inp (generated)

004564338.b3lyp_6-31g(d).smash.inp (generated)

004564338.b3lyp_6-31g(d).nwchem.inp (generated) 004564338.b3lyp_6-31g(d).log.xz 004564338.td-b3lyp_6-31g+(d).inp 004564338.td-b3lyp_6-31g+(d).log.xz

004564338.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564338.td-b3lyp_6-31+g(d).gjf (generated)

004564338.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564338.mol 004564338.PUBCHEM 004564338.mol (via Jmol)
004564343.b3lyp_6-31g(d).inp

004564343.b3lyp_6-31g(d).qchem.inp (generated)

004564343.b3lyp_6-31g(d).gjf (generated)

004564343.b3lyp_6-31g(d).firefly.inp (generated)

004564343.b3lyp_6-31g(d).smash.inp (generated)

004564343.b3lyp_6-31g(d).nwchem.inp (generated) 004564343.b3lyp_6-31g(d).log.xz 004564343.td-b3lyp_6-31g+(d).inp 004564343.td-b3lyp_6-31g+(d).log.xz

004564343.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564343.td-b3lyp_6-31+g(d).gjf (generated)

004564343.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564343.mol 004564343.PUBCHEM 004564343.mol (via Jmol)
004564353.b3lyp_6-31g(d).inp

004564353.b3lyp_6-31g(d).qchem.inp (generated)

004564353.b3lyp_6-31g(d).gjf (generated)

004564353.b3lyp_6-31g(d).firefly.inp (generated)

004564353.b3lyp_6-31g(d).smash.inp (generated)

004564353.b3lyp_6-31g(d).nwchem.inp (generated) 004564353.b3lyp_6-31g(d).log.xz 004564353.td-b3lyp_6-31g+(d).inp 004564353.td-b3lyp_6-31g+(d).log.xz

004564353.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564353.td-b3lyp_6-31+g(d).gjf (generated)

004564353.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564353.mol 004564353.PUBCHEM 004564353.mol (via Jmol)
004564363.b3lyp_6-31g(d).inp

004564363.b3lyp_6-31g(d).qchem.inp (generated)

004564363.b3lyp_6-31g(d).gjf (generated)

004564363.b3lyp_6-31g(d).firefly.inp (generated)

004564363.b3lyp_6-31g(d).smash.inp (generated)

004564363.b3lyp_6-31g(d).nwchem.inp (generated) 004564363.b3lyp_6-31g(d).log.xz 004564363.mol 004564363.PUBCHEM 004564363.mol (via Jmol)
004564397.b3lyp_6-31g(d).inp

004564397.b3lyp_6-31g(d).qchem.inp (generated)

004564397.b3lyp_6-31g(d).gjf (generated)

004564397.b3lyp_6-31g(d).firefly.inp (generated)

004564397.b3lyp_6-31g(d).smash.inp (generated)

004564397.b3lyp_6-31g(d).nwchem.inp (generated) 004564397.b3lyp_6-31g(d).log.xz 004564397.td-b3lyp_6-31g+(d).inp 004564397.td-b3lyp_6-31g+(d).log.xz

004564397.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564397.td-b3lyp_6-31+g(d).gjf (generated)

004564397.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564397.mol 004564397.PUBCHEM 004564397.mol (via Jmol)
004564417.b3lyp_6-31g(d).inp

004564417.b3lyp_6-31g(d).qchem.inp (generated)

004564417.b3lyp_6-31g(d).gjf (generated)

004564417.b3lyp_6-31g(d).firefly.inp (generated)

004564417.b3lyp_6-31g(d).smash.inp (generated)

004564417.b3lyp_6-31g(d).nwchem.inp (generated) 004564417.b3lyp_6-31g(d).log.xz 004564417.td-b3lyp_6-31g+(d).inp 004564417.td-b3lyp_6-31g+(d).log.xz

004564417.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564417.td-b3lyp_6-31+g(d).gjf (generated)

004564417.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564417.mol 004564417.PUBCHEM 004564417.mol (via Jmol)
004564491.b3lyp_6-31g(d).inp

004564491.b3lyp_6-31g(d).qchem.inp (generated)

004564491.b3lyp_6-31g(d).gjf (generated)

004564491.b3lyp_6-31g(d).firefly.inp (generated)

004564491.b3lyp_6-31g(d).smash.inp (generated)

004564491.b3lyp_6-31g(d).nwchem.inp (generated) 004564491.b3lyp_6-31g(d).log.xz 004564491.td-b3lyp_6-31g+(d).inp 004564491.td-b3lyp_6-31g+(d).log.xz

004564491.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564491.td-b3lyp_6-31+g(d).gjf (generated)

004564491.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564491.mol 004564491.PUBCHEM 004564491.mol (via Jmol)
004564493.b3lyp_6-31g(d).inp

004564493.b3lyp_6-31g(d).qchem.inp (generated)

004564493.b3lyp_6-31g(d).gjf (generated)

004564493.b3lyp_6-31g(d).firefly.inp (generated)

004564493.b3lyp_6-31g(d).smash.inp (generated)

004564493.b3lyp_6-31g(d).nwchem.inp (generated) 004564493.b3lyp_6-31g(d).log.xz 004564493.td-b3lyp_6-31g+(d).inp 004564493.td-b3lyp_6-31g+(d).log.xz

004564493.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564493.td-b3lyp_6-31+g(d).gjf (generated)

004564493.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564493.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564493.mol 004564493.PUBCHEM 004564493.mol (via Jmol)
004564495.b3lyp_6-31g(d).inp

004564495.b3lyp_6-31g(d).qchem.inp (generated)

004564495.b3lyp_6-31g(d).gjf (generated)

004564495.b3lyp_6-31g(d).firefly.inp (generated)

004564495.b3lyp_6-31g(d).smash.inp (generated)

004564495.b3lyp_6-31g(d).nwchem.inp (generated) 004564495.b3lyp_6-31g(d).log.xz 004564495.mol 004564495.PUBCHEM 004564495.mol (via Jmol)
004564507.b3lyp_6-31g(d).inp

004564507.b3lyp_6-31g(d).qchem.inp (generated)

004564507.b3lyp_6-31g(d).gjf (generated)

004564507.b3lyp_6-31g(d).firefly.inp (generated)

004564507.b3lyp_6-31g(d).smash.inp (generated)

004564507.b3lyp_6-31g(d).nwchem.inp (generated) 004564507.b3lyp_6-31g(d).log.xz 004564507.mol 004564507.PUBCHEM 004564507.mol (via Jmol)
004564544.b3lyp_6-31g(d).inp

004564544.b3lyp_6-31g(d).qchem.inp (generated)

004564544.b3lyp_6-31g(d).gjf (generated)

004564544.b3lyp_6-31g(d).firefly.inp (generated)

004564544.b3lyp_6-31g(d).smash.inp (generated)

004564544.b3lyp_6-31g(d).nwchem.inp (generated) 004564544.b3lyp_6-31g(d).log.xz 004564544.td-b3lyp_6-31g+(d).inp 004564544.td-b3lyp_6-31g+(d).log.xz

004564544.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564544.td-b3lyp_6-31+g(d).gjf (generated)

004564544.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564544.mol 004564544.PUBCHEM 004564544.mol (via Jmol)
004564563.b3lyp_6-31g(d).inp

004564563.b3lyp_6-31g(d).qchem.inp (generated)

004564563.b3lyp_6-31g(d).gjf (generated)

004564563.b3lyp_6-31g(d).firefly.inp (generated)

004564563.b3lyp_6-31g(d).smash.inp (generated)

004564563.b3lyp_6-31g(d).nwchem.inp (generated) 004564563.b3lyp_6-31g(d).log.xz 004564563.td-b3lyp_6-31g+(d).inp 004564563.td-b3lyp_6-31g+(d).log.xz

004564563.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564563.td-b3lyp_6-31+g(d).gjf (generated)

004564563.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564563.mol 004564563.PUBCHEM 004564563.mol (via Jmol)
004564574.b3lyp_6-31g(d).inp

004564574.b3lyp_6-31g(d).qchem.inp (generated)

004564574.b3lyp_6-31g(d).gjf (generated)

004564574.b3lyp_6-31g(d).firefly.inp (generated)

004564574.b3lyp_6-31g(d).smash.inp (generated)

004564574.b3lyp_6-31g(d).nwchem.inp (generated) 004564574.b3lyp_6-31g(d).log.xz 004564574.td-b3lyp_6-31g+(d).inp 004564574.td-b3lyp_6-31g+(d).log.xz

004564574.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564574.td-b3lyp_6-31+g(d).gjf (generated)

004564574.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564574.mol 004564574.PUBCHEM 004564574.mol (via Jmol)
004564603.b3lyp_6-31g(d).inp

004564603.b3lyp_6-31g(d).qchem.inp (generated)

004564603.b3lyp_6-31g(d).gjf (generated)

004564603.b3lyp_6-31g(d).firefly.inp (generated)

004564603.b3lyp_6-31g(d).smash.inp (generated)

004564603.b3lyp_6-31g(d).nwchem.inp (generated) 004564603.b3lyp_6-31g(d).log.xz 004564603.mol 004564603.PUBCHEM 004564603.mol (via Jmol)
004564607.b3lyp_6-31g(d).inp

004564607.b3lyp_6-31g(d).qchem.inp (generated)

004564607.b3lyp_6-31g(d).gjf (generated)

004564607.b3lyp_6-31g(d).firefly.inp (generated)

004564607.b3lyp_6-31g(d).smash.inp (generated)

004564607.b3lyp_6-31g(d).nwchem.inp (generated) 004564607.b3lyp_6-31g(d).log.xz 004564607.td-b3lyp_6-31g+(d).inp 004564607.td-b3lyp_6-31g+(d).log.xz

004564607.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564607.td-b3lyp_6-31+g(d).gjf (generated)

004564607.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564607.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564607.mol 004564607.PUBCHEM 004564607.mol (via Jmol)
004564655.b3lyp_6-31g(d).inp

004564655.b3lyp_6-31g(d).qchem.inp (generated)

004564655.b3lyp_6-31g(d).gjf (generated)

004564655.b3lyp_6-31g(d).firefly.inp (generated)

004564655.b3lyp_6-31g(d).smash.inp (generated)

004564655.b3lyp_6-31g(d).nwchem.inp (generated) 004564655.b3lyp_6-31g(d).log.xz 004564655.td-b3lyp_6-31g+(d).inp 004564655.td-b3lyp_6-31g+(d).log.xz

004564655.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564655.td-b3lyp_6-31+g(d).gjf (generated)

004564655.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564655.mol 004564655.PUBCHEM 004564655.mol (via Jmol)
004564656.b3lyp_6-31g(d).inp

004564656.b3lyp_6-31g(d).qchem.inp (generated)

004564656.b3lyp_6-31g(d).gjf (generated)

004564656.b3lyp_6-31g(d).firefly.inp (generated)

004564656.b3lyp_6-31g(d).smash.inp (generated)

004564656.b3lyp_6-31g(d).nwchem.inp (generated) 004564656.b3lyp_6-31g(d).log.xz 004564656.td-b3lyp_6-31g+(d).inp 004564656.td-b3lyp_6-31g+(d).log.xz

004564656.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564656.td-b3lyp_6-31+g(d).gjf (generated)

004564656.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564656.mol 004564656.PUBCHEM 004564656.mol (via Jmol)
004564691.b3lyp_6-31g(d).inp

004564691.b3lyp_6-31g(d).qchem.inp (generated)

004564691.b3lyp_6-31g(d).gjf (generated)

004564691.b3lyp_6-31g(d).firefly.inp (generated)

004564691.b3lyp_6-31g(d).smash.inp (generated)

004564691.b3lyp_6-31g(d).nwchem.inp (generated) 004564691.b3lyp_6-31g(d).log.xz 004564691.td-b3lyp_6-31g+(d).inp 004564691.td-b3lyp_6-31g+(d).log.xz

004564691.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564691.td-b3lyp_6-31+g(d).gjf (generated)

004564691.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564691.mol 004564691.PUBCHEM 004564691.mol (via Jmol)
004564694.b3lyp_6-31g(d).inp

004564694.b3lyp_6-31g(d).qchem.inp (generated)

004564694.b3lyp_6-31g(d).gjf (generated)

004564694.b3lyp_6-31g(d).firefly.inp (generated)

004564694.b3lyp_6-31g(d).smash.inp (generated)

004564694.b3lyp_6-31g(d).nwchem.inp (generated) 004564694.b3lyp_6-31g(d).log.xz 004564694.td-b3lyp_6-31g+(d).inp 004564694.td-b3lyp_6-31g+(d).log.xz

004564694.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564694.td-b3lyp_6-31+g(d).gjf (generated)

004564694.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564694.mol 004564694.PUBCHEM 004564694.mol (via Jmol)
004564697.b3lyp_6-31g(d).inp

004564697.b3lyp_6-31g(d).qchem.inp (generated)

004564697.b3lyp_6-31g(d).gjf (generated)

004564697.b3lyp_6-31g(d).firefly.inp (generated)

004564697.b3lyp_6-31g(d).smash.inp (generated)

004564697.b3lyp_6-31g(d).nwchem.inp (generated) 004564697.b3lyp_6-31g(d).log.xz 004564697.mol 004564697.PUBCHEM 004564697.mol (via Jmol)
004564728.b3lyp_6-31g(d).inp

004564728.b3lyp_6-31g(d).qchem.inp (generated)

004564728.b3lyp_6-31g(d).gjf (generated)

004564728.b3lyp_6-31g(d).firefly.inp (generated)

004564728.b3lyp_6-31g(d).smash.inp (generated)

004564728.b3lyp_6-31g(d).nwchem.inp (generated) 004564728.b3lyp_6-31g(d).log.xz 004564728.td-b3lyp_6-31g+(d).inp 004564728.td-b3lyp_6-31g+(d).log.xz

004564728.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564728.td-b3lyp_6-31+g(d).gjf (generated)

004564728.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564728.mol 004564728.PUBCHEM 004564728.mol (via Jmol)
004564730.b3lyp_6-31g(d).inp

004564730.b3lyp_6-31g(d).qchem.inp (generated)

004564730.b3lyp_6-31g(d).gjf (generated)

004564730.b3lyp_6-31g(d).firefly.inp (generated)

004564730.b3lyp_6-31g(d).smash.inp (generated)

004564730.b3lyp_6-31g(d).nwchem.inp (generated) 004564730.b3lyp_6-31g(d).log.xz 004564730.mol 004564730.PUBCHEM 004564730.mol (via Jmol)
004564757.b3lyp_6-31g(d).inp

004564757.b3lyp_6-31g(d).qchem.inp (generated)

004564757.b3lyp_6-31g(d).gjf (generated)

004564757.b3lyp_6-31g(d).firefly.inp (generated)

004564757.b3lyp_6-31g(d).smash.inp (generated)

004564757.b3lyp_6-31g(d).nwchem.inp (generated) 004564757.b3lyp_6-31g(d).log.xz 004564757.td-b3lyp_6-31g+(d).inp 004564757.td-b3lyp_6-31g+(d).log.xz

004564757.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564757.td-b3lyp_6-31+g(d).gjf (generated)

004564757.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564757.mol 004564757.PUBCHEM 004564757.mol (via Jmol)
004564786.b3lyp_6-31g(d).inp

004564786.b3lyp_6-31g(d).qchem.inp (generated)

004564786.b3lyp_6-31g(d).gjf (generated)

004564786.b3lyp_6-31g(d).firefly.inp (generated)

004564786.b3lyp_6-31g(d).smash.inp (generated)

004564786.b3lyp_6-31g(d).nwchem.inp (generated) 004564786.b3lyp_6-31g(d).log.xz 004564786.td-b3lyp_6-31g+(d).inp 004564786.td-b3lyp_6-31g+(d).log.xz

004564786.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564786.td-b3lyp_6-31+g(d).gjf (generated)

004564786.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564786.mol 004564786.PUBCHEM 004564786.mol (via Jmol)
004564787.b3lyp_6-31g(d).inp

004564787.b3lyp_6-31g(d).qchem.inp (generated)

004564787.b3lyp_6-31g(d).gjf (generated)

004564787.b3lyp_6-31g(d).firefly.inp (generated)

004564787.b3lyp_6-31g(d).smash.inp (generated)

004564787.b3lyp_6-31g(d).nwchem.inp (generated) 004564787.b3lyp_6-31g(d).log.xz 004564787.td-b3lyp_6-31g+(d).inp 004564787.td-b3lyp_6-31g+(d).log.xz

004564787.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564787.td-b3lyp_6-31+g(d).gjf (generated)

004564787.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564787.mol 004564787.PUBCHEM 004564787.mol (via Jmol)
004564803.b3lyp_6-31g(d).inp

004564803.b3lyp_6-31g(d).qchem.inp (generated)

004564803.b3lyp_6-31g(d).gjf (generated)

004564803.b3lyp_6-31g(d).firefly.inp (generated)

004564803.b3lyp_6-31g(d).smash.inp (generated)

004564803.b3lyp_6-31g(d).nwchem.inp (generated) 004564803.b3lyp_6-31g(d).log.xz 004564803.td-b3lyp_6-31g+(d).inp 004564803.td-b3lyp_6-31g+(d).log.xz

004564803.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564803.td-b3lyp_6-31+g(d).gjf (generated)

004564803.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564803.mol 004564803.PUBCHEM 004564803.mol (via Jmol)
004564836.b3lyp_6-31g(d).inp

004564836.b3lyp_6-31g(d).qchem.inp (generated)

004564836.b3lyp_6-31g(d).gjf (generated)

004564836.b3lyp_6-31g(d).firefly.inp (generated)

004564836.b3lyp_6-31g(d).smash.inp (generated)

004564836.b3lyp_6-31g(d).nwchem.inp (generated) 004564836.b3lyp_6-31g(d).log.xz 004564836.td-b3lyp_6-31g+(d).inp 004564836.td-b3lyp_6-31g+(d).log.xz

004564836.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564836.td-b3lyp_6-31+g(d).gjf (generated)

004564836.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564836.mol 004564836.PUBCHEM 004564836.mol (via Jmol)
004564839.b3lyp_6-31g(d).inp

004564839.b3lyp_6-31g(d).qchem.inp (generated)

004564839.b3lyp_6-31g(d).gjf (generated)

004564839.b3lyp_6-31g(d).firefly.inp (generated)

004564839.b3lyp_6-31g(d).smash.inp (generated)

004564839.b3lyp_6-31g(d).nwchem.inp (generated) 004564839.b3lyp_6-31g(d).log.xz 004564839.td-b3lyp_6-31g+(d).inp 004564839.td-b3lyp_6-31g+(d).log.xz

004564839.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564839.td-b3lyp_6-31+g(d).gjf (generated)

004564839.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564839.mol 004564839.PUBCHEM 004564839.mol (via Jmol)
004564841.b3lyp_6-31g(d).inp

004564841.b3lyp_6-31g(d).qchem.inp (generated)

004564841.b3lyp_6-31g(d).gjf (generated)

004564841.b3lyp_6-31g(d).firefly.inp (generated)

004564841.b3lyp_6-31g(d).smash.inp (generated)

004564841.b3lyp_6-31g(d).nwchem.inp (generated) 004564841.b3lyp_6-31g(d).log.xz 004564841.td-b3lyp_6-31g+(d).inp 004564841.td-b3lyp_6-31g+(d).log.xz

004564841.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564841.td-b3lyp_6-31+g(d).gjf (generated)

004564841.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564841.mol 004564841.PUBCHEM 004564841.mol (via Jmol)
004564862.b3lyp_6-31g(d).inp

004564862.b3lyp_6-31g(d).qchem.inp (generated)

004564862.b3lyp_6-31g(d).gjf (generated)

004564862.b3lyp_6-31g(d).firefly.inp (generated)

004564862.b3lyp_6-31g(d).smash.inp (generated)

004564862.b3lyp_6-31g(d).nwchem.inp (generated) 004564862.b3lyp_6-31g(d).log.xz 004564862.td-b3lyp_6-31g+(d).inp 004564862.td-b3lyp_6-31g+(d).log.xz

004564862.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564862.td-b3lyp_6-31+g(d).gjf (generated)

004564862.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564862.mol 004564862.PUBCHEM 004564862.mol (via Jmol)
004564871.b3lyp_6-31g(d).inp

004564871.b3lyp_6-31g(d).qchem.inp (generated)

004564871.b3lyp_6-31g(d).gjf (generated)

004564871.b3lyp_6-31g(d).firefly.inp (generated)

004564871.b3lyp_6-31g(d).smash.inp (generated)

004564871.b3lyp_6-31g(d).nwchem.inp (generated) 004564871.b3lyp_6-31g(d).log.xz 004564871.td-b3lyp_6-31g+(d).inp 004564871.td-b3lyp_6-31g+(d).log.xz

004564871.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564871.td-b3lyp_6-31+g(d).gjf (generated)

004564871.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564871.mol 004564871.PUBCHEM 004564871.mol (via Jmol)
004564890.b3lyp_6-31g(d).inp

004564890.b3lyp_6-31g(d).qchem.inp (generated)

004564890.b3lyp_6-31g(d).gjf (generated)

004564890.b3lyp_6-31g(d).firefly.inp (generated)

004564890.b3lyp_6-31g(d).smash.inp (generated)

004564890.b3lyp_6-31g(d).nwchem.inp (generated) 004564890.b3lyp_6-31g(d).log.xz 004564890.td-b3lyp_6-31g+(d).inp 004564890.td-b3lyp_6-31g+(d).log.xz

004564890.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564890.td-b3lyp_6-31+g(d).gjf (generated)

004564890.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564890.mol 004564890.PUBCHEM 004564890.mol (via Jmol)
004564900.b3lyp_6-31g(d).inp

004564900.b3lyp_6-31g(d).qchem.inp (generated)

004564900.b3lyp_6-31g(d).gjf (generated)

004564900.b3lyp_6-31g(d).firefly.inp (generated)

004564900.b3lyp_6-31g(d).smash.inp (generated)

004564900.b3lyp_6-31g(d).nwchem.inp (generated) 004564900.b3lyp_6-31g(d).log.xz 004564900.td-b3lyp_6-31g+(d).inp 004564900.td-b3lyp_6-31g+(d).log.xz

004564900.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564900.td-b3lyp_6-31+g(d).gjf (generated)

004564900.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564900.mol 004564900.PUBCHEM 004564900.mol (via Jmol)
004564924.b3lyp_6-31g(d).inp

004564924.b3lyp_6-31g(d).qchem.inp (generated)

004564924.b3lyp_6-31g(d).gjf (generated)

004564924.b3lyp_6-31g(d).firefly.inp (generated)

004564924.b3lyp_6-31g(d).smash.inp (generated)

004564924.b3lyp_6-31g(d).nwchem.inp (generated) 004564924.b3lyp_6-31g(d).log.xz 004564924.td-b3lyp_6-31g+(d).inp 004564924.td-b3lyp_6-31g+(d).log.xz

004564924.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564924.td-b3lyp_6-31+g(d).gjf (generated)

004564924.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564924.mol 004564924.PUBCHEM 004564924.mol (via Jmol)
004564944.b3lyp_6-31g(d).inp

004564944.b3lyp_6-31g(d).qchem.inp (generated)

004564944.b3lyp_6-31g(d).gjf (generated)

004564944.b3lyp_6-31g(d).firefly.inp (generated)

004564944.b3lyp_6-31g(d).smash.inp (generated)

004564944.b3lyp_6-31g(d).nwchem.inp (generated) 004564944.b3lyp_6-31g(d).log.xz 004564944.td-b3lyp_6-31g+(d).inp 004564944.td-b3lyp_6-31g+(d).log.xz

004564944.td-b3lyp_6-31+g(d).qchem.inp (generated)

004564944.td-b3lyp_6-31+g(d).gjf (generated)

004564944.td-b3lyp_6-31+g(d).firefly.inp (generated)

004564944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004564944.mol 004564944.PUBCHEM 004564944.mol (via Jmol)
004565154.b3lyp_6-31g(d).inp

004565154.b3lyp_6-31g(d).qchem.inp (generated)

004565154.b3lyp_6-31g(d).gjf (generated)

004565154.b3lyp_6-31g(d).firefly.inp (generated)

004565154.b3lyp_6-31g(d).smash.inp (generated)

004565154.b3lyp_6-31g(d).nwchem.inp (generated) 004565154.b3lyp_6-31g(d).log.xz 004565154.td-b3lyp_6-31g+(d).inp 004565154.td-b3lyp_6-31g+(d).log.xz

004565154.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565154.td-b3lyp_6-31+g(d).gjf (generated)

004565154.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565154.mol 004565154.PUBCHEM 004565154.mol (via Jmol)
004565165.b3lyp_6-31g(d).inp

004565165.b3lyp_6-31g(d).qchem.inp (generated)

004565165.b3lyp_6-31g(d).gjf (generated)

004565165.b3lyp_6-31g(d).firefly.inp (generated)

004565165.b3lyp_6-31g(d).smash.inp (generated)

004565165.b3lyp_6-31g(d).nwchem.inp (generated) 004565165.b3lyp_6-31g(d).log.xz 004565165.mol 004565165.PUBCHEM 004565165.mol (via Jmol)
004565199.b3lyp_6-31g(d).inp

004565199.b3lyp_6-31g(d).qchem.inp (generated)

004565199.b3lyp_6-31g(d).gjf (generated)

004565199.b3lyp_6-31g(d).firefly.inp (generated)

004565199.b3lyp_6-31g(d).smash.inp (generated)

004565199.b3lyp_6-31g(d).nwchem.inp (generated) 004565199.b3lyp_6-31g(d).log.xz 004565199.td-b3lyp_6-31g+(d).inp 004565199.td-b3lyp_6-31g+(d).log.xz

004565199.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565199.td-b3lyp_6-31+g(d).gjf (generated)

004565199.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565199.mol 004565199.PUBCHEM 004565199.mol (via Jmol)
004565213.b3lyp_6-31g(d).inp

004565213.b3lyp_6-31g(d).qchem.inp (generated)

004565213.b3lyp_6-31g(d).gjf (generated)

004565213.b3lyp_6-31g(d).firefly.inp (generated)

004565213.b3lyp_6-31g(d).smash.inp (generated)

004565213.b3lyp_6-31g(d).nwchem.inp (generated) 004565213.b3lyp_6-31g(d).log.xz 004565213.td-b3lyp_6-31g+(d).inp 004565213.td-b3lyp_6-31g+(d).log.xz

004565213.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565213.td-b3lyp_6-31+g(d).gjf (generated)

004565213.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565213.mol 004565213.PUBCHEM 004565213.mol (via Jmol)
004565273.b3lyp_6-31g(d).inp

004565273.b3lyp_6-31g(d).qchem.inp (generated)

004565273.b3lyp_6-31g(d).gjf (generated)

004565273.b3lyp_6-31g(d).firefly.inp (generated)

004565273.b3lyp_6-31g(d).smash.inp (generated)

004565273.b3lyp_6-31g(d).nwchem.inp (generated) 004565273.b3lyp_6-31g(d).log.xz 004565273.td-b3lyp_6-31g+(d).inp 004565273.td-b3lyp_6-31g+(d).log.xz

004565273.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565273.td-b3lyp_6-31+g(d).gjf (generated)

004565273.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565273.mol 004565273.PUBCHEM 004565273.mol (via Jmol)
004565284.b3lyp_6-31g(d).inp

004565284.b3lyp_6-31g(d).qchem.inp (generated)

004565284.b3lyp_6-31g(d).gjf (generated)

004565284.b3lyp_6-31g(d).firefly.inp (generated)

004565284.b3lyp_6-31g(d).smash.inp (generated)

004565284.b3lyp_6-31g(d).nwchem.inp (generated) 004565284.b3lyp_6-31g(d).log.xz 004565284.mol 004565284.PUBCHEM 004565284.mol (via Jmol)
004565480.b3lyp_6-31g(d).inp

004565480.b3lyp_6-31g(d).qchem.inp (generated)

004565480.b3lyp_6-31g(d).gjf (generated)

004565480.b3lyp_6-31g(d).firefly.inp (generated)

004565480.b3lyp_6-31g(d).smash.inp (generated)

004565480.b3lyp_6-31g(d).nwchem.inp (generated) 004565480.b3lyp_6-31g(d).log.xz 004565480.td-b3lyp_6-31g+(d).inp 004565480.td-b3lyp_6-31g+(d).log.xz

004565480.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565480.td-b3lyp_6-31+g(d).gjf (generated)

004565480.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565480.mol 004565480.PUBCHEM 004565480.mol (via Jmol)
004565551.b3lyp_6-31g(d).inp

004565551.b3lyp_6-31g(d).qchem.inp (generated)

004565551.b3lyp_6-31g(d).gjf (generated)

004565551.b3lyp_6-31g(d).firefly.inp (generated)

004565551.b3lyp_6-31g(d).smash.inp (generated)

004565551.b3lyp_6-31g(d).nwchem.inp (generated) 004565551.b3lyp_6-31g(d).log.xz 004565551.td-b3lyp_6-31g+(d).inp 004565551.td-b3lyp_6-31g+(d).log.xz

004565551.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565551.td-b3lyp_6-31+g(d).gjf (generated)

004565551.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565551.mol 004565551.PUBCHEM 004565551.mol (via Jmol)
004565554.b3lyp_6-31g(d).inp

004565554.b3lyp_6-31g(d).qchem.inp (generated)

004565554.b3lyp_6-31g(d).gjf (generated)

004565554.b3lyp_6-31g(d).firefly.inp (generated)

004565554.b3lyp_6-31g(d).smash.inp (generated)

004565554.b3lyp_6-31g(d).nwchem.inp (generated) 004565554.b3lyp_6-31g(d).log.xz 004565554.td-b3lyp_6-31g+(d).inp 004565554.td-b3lyp_6-31g+(d).log.xz

004565554.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565554.td-b3lyp_6-31+g(d).gjf (generated)

004565554.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565554.mol 004565554.PUBCHEM 004565554.mol (via Jmol)
004565598.b3lyp_6-31g(d).inp

004565598.b3lyp_6-31g(d).qchem.inp (generated)

004565598.b3lyp_6-31g(d).gjf (generated)

004565598.b3lyp_6-31g(d).firefly.inp (generated)

004565598.b3lyp_6-31g(d).smash.inp (generated)

004565598.b3lyp_6-31g(d).nwchem.inp (generated) 004565598.b3lyp_6-31g(d).log.xz 004565598.td-b3lyp_6-31g+(d).inp 004565598.td-b3lyp_6-31g+(d).log.xz

004565598.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565598.td-b3lyp_6-31+g(d).gjf (generated)

004565598.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565598.mol 004565598.PUBCHEM 004565598.mol (via Jmol)
004565666.b3lyp_6-31g(d).inp

004565666.b3lyp_6-31g(d).qchem.inp (generated)

004565666.b3lyp_6-31g(d).gjf (generated)

004565666.b3lyp_6-31g(d).firefly.inp (generated)

004565666.b3lyp_6-31g(d).smash.inp (generated)

004565666.b3lyp_6-31g(d).nwchem.inp (generated) 004565666.b3lyp_6-31g(d).log.xz 004565666.td-b3lyp_6-31g+(d).inp 004565666.td-b3lyp_6-31g+(d).log.xz

004565666.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565666.td-b3lyp_6-31+g(d).gjf (generated)

004565666.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565666.mol 004565666.PUBCHEM 004565666.mol (via Jmol)
004565777.b3lyp_6-31g(d).inp

004565777.b3lyp_6-31g(d).qchem.inp (generated)

004565777.b3lyp_6-31g(d).gjf (generated)

004565777.b3lyp_6-31g(d).firefly.inp (generated)

004565777.b3lyp_6-31g(d).smash.inp (generated)

004565777.b3lyp_6-31g(d).nwchem.inp (generated) 004565777.b3lyp_6-31g(d).log.xz 004565777.td-b3lyp_6-31g+(d).inp 004565777.td-b3lyp_6-31g+(d).log.xz

004565777.td-b3lyp_6-31+g(d).qchem.inp (generated)

004565777.td-b3lyp_6-31+g(d).gjf (generated)

004565777.td-b3lyp_6-31+g(d).firefly.inp (generated)

004565777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004565777.mol 004565777.PUBCHEM 004565777.mol (via Jmol)
004565788.b3lyp_6-31g(d).inp

004565788.b3lyp_6-31g(d).qchem.inp (generated)

004565788.b3lyp_6-31g(d).gjf (generated)

004565788.b3lyp_6-31g(d).firefly.inp (generated)

004565788.b3lyp_6-31g(d).smash.inp (generated)

004565788.b3lyp_6-31g(d).nwchem.inp (generated) 004565788.b3lyp_6-31g(d).log.xz 004565788.td-b3lyp_6-31g+(d).inp 004565788.td-b3lyp_6-31g+(d).log.xz

004565788.td-b3lyp_6-31+g(d).qchem.inp (generated)