Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 261 (199) in this page
047175191.b3lyp_6-31g(d).inp

047175191.b3lyp_6-31g(d).qchem.inp (generated)

047175191.b3lyp_6-31g(d).gjf (generated)

047175191.b3lyp_6-31g(d).firefly.inp (generated)

047175191.b3lyp_6-31g(d).smash.inp (generated)

047175191.b3lyp_6-31g(d).nwchem.inp (generated) 047175191.b3lyp_6-31g(d).log.xz 047175191.td-b3lyp_6-31g+(d).inp 047175191.td-b3lyp_6-31g+(d).log.xz

047175191.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175191.td-b3lyp_6-31+g(d).gjf (generated)

047175191.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175191.mol 047175191.PUBCHEM 047175191.mol (via Jmol)
047175227.b3lyp_6-31g(d).inp

047175227.b3lyp_6-31g(d).qchem.inp (generated)

047175227.b3lyp_6-31g(d).gjf (generated)

047175227.b3lyp_6-31g(d).firefly.inp (generated)

047175227.b3lyp_6-31g(d).smash.inp (generated)

047175227.b3lyp_6-31g(d).nwchem.inp (generated) 047175227.b3lyp_6-31g(d).log.xz 047175227.td-b3lyp_6-31g+(d).inp 047175227.td-b3lyp_6-31g+(d).log.xz

047175227.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175227.td-b3lyp_6-31+g(d).gjf (generated)

047175227.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175227.mol 047175227.PUBCHEM 047175227.mol (via Jmol)
047175422.b3lyp_6-31g(d).inp

047175422.b3lyp_6-31g(d).qchem.inp (generated)

047175422.b3lyp_6-31g(d).gjf (generated)

047175422.b3lyp_6-31g(d).firefly.inp (generated)

047175422.b3lyp_6-31g(d).smash.inp (generated)

047175422.b3lyp_6-31g(d).nwchem.inp (generated) 047175422.b3lyp_6-31g(d).log.xz 047175422.td-b3lyp_6-31g+(d).inp 047175422.td-b3lyp_6-31g+(d).log.xz

047175422.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175422.td-b3lyp_6-31+g(d).gjf (generated)

047175422.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175422.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175422.mol 047175422.PUBCHEM 047175422.mol (via Jmol)
047175800.b3lyp_6-31g(d).inp

047175800.b3lyp_6-31g(d).qchem.inp (generated)

047175800.b3lyp_6-31g(d).gjf (generated)

047175800.b3lyp_6-31g(d).firefly.inp (generated)

047175800.b3lyp_6-31g(d).smash.inp (generated)

047175800.b3lyp_6-31g(d).nwchem.inp (generated) 047175800.b3lyp_6-31g(d).log.xz 047175800.td-b3lyp_6-31g+(d).inp 047175800.td-b3lyp_6-31g+(d).log.xz

047175800.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175800.td-b3lyp_6-31+g(d).gjf (generated)

047175800.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175800.mol 047175800.PUBCHEM 047175800.mol (via Jmol)
047175883.b3lyp_6-31g(d).inp

047175883.b3lyp_6-31g(d).qchem.inp (generated)

047175883.b3lyp_6-31g(d).gjf (generated)

047175883.b3lyp_6-31g(d).firefly.inp (generated)

047175883.b3lyp_6-31g(d).smash.inp (generated)

047175883.b3lyp_6-31g(d).nwchem.inp (generated) 047175883.b3lyp_6-31g(d).log.xz 047175883.td-b3lyp_6-31g+(d).inp 047175883.td-b3lyp_6-31g+(d).log.xz

047175883.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175883.td-b3lyp_6-31+g(d).gjf (generated)

047175883.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175883.mol 047175883.PUBCHEM 047175883.mol (via Jmol)
047175884.b3lyp_6-31g(d).inp

047175884.b3lyp_6-31g(d).qchem.inp (generated)

047175884.b3lyp_6-31g(d).gjf (generated)

047175884.b3lyp_6-31g(d).firefly.inp (generated)

047175884.b3lyp_6-31g(d).smash.inp (generated)

047175884.b3lyp_6-31g(d).nwchem.inp (generated) 047175884.b3lyp_6-31g(d).log.xz 047175884.td-b3lyp_6-31g+(d).inp 047175884.td-b3lyp_6-31g+(d).log.xz

047175884.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175884.td-b3lyp_6-31+g(d).gjf (generated)

047175884.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175884.mol 047175884.PUBCHEM 047175884.mol (via Jmol)
047175890.b3lyp_6-31g(d).inp

047175890.b3lyp_6-31g(d).qchem.inp (generated)

047175890.b3lyp_6-31g(d).gjf (generated)

047175890.b3lyp_6-31g(d).firefly.inp (generated)

047175890.b3lyp_6-31g(d).smash.inp (generated)

047175890.b3lyp_6-31g(d).nwchem.inp (generated) 047175890.b3lyp_6-31g(d).log.xz 047175890.mol 047175890.PUBCHEM 047175890.mol (via Jmol)
047175901.b3lyp_6-31g(d).inp

047175901.b3lyp_6-31g(d).qchem.inp (generated)

047175901.b3lyp_6-31g(d).gjf (generated)

047175901.b3lyp_6-31g(d).firefly.inp (generated)

047175901.b3lyp_6-31g(d).smash.inp (generated)

047175901.b3lyp_6-31g(d).nwchem.inp (generated) 047175901.b3lyp_6-31g(d).log.xz 047175901.td-b3lyp_6-31g+(d).inp 047175901.td-b3lyp_6-31g+(d).log.xz

047175901.td-b3lyp_6-31+g(d).qchem.inp (generated)

047175901.td-b3lyp_6-31+g(d).gjf (generated)

047175901.td-b3lyp_6-31+g(d).firefly.inp (generated)

047175901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047175901.mol 047175901.PUBCHEM 047175901.mol (via Jmol)
047176070.b3lyp_6-31g(d).inp

047176070.b3lyp_6-31g(d).qchem.inp (generated)

047176070.b3lyp_6-31g(d).gjf (generated)

047176070.b3lyp_6-31g(d).firefly.inp (generated)

047176070.b3lyp_6-31g(d).smash.inp (generated)

047176070.b3lyp_6-31g(d).nwchem.inp (generated) 047176070.b3lyp_6-31g(d).log.xz 047176070.td-b3lyp_6-31g+(d).inp 047176070.td-b3lyp_6-31g+(d).log.xz

047176070.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176070.td-b3lyp_6-31+g(d).gjf (generated)

047176070.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176070.mol 047176070.PUBCHEM 047176070.mol (via Jmol)
047176072.b3lyp_6-31g(d).inp

047176072.b3lyp_6-31g(d).qchem.inp (generated)

047176072.b3lyp_6-31g(d).gjf (generated)

047176072.b3lyp_6-31g(d).firefly.inp (generated)

047176072.b3lyp_6-31g(d).smash.inp (generated)

047176072.b3lyp_6-31g(d).nwchem.inp (generated) 047176072.b3lyp_6-31g(d).log.xz 047176072.td-b3lyp_6-31g+(d).inp 047176072.td-b3lyp_6-31g+(d).log.xz

047176072.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176072.td-b3lyp_6-31+g(d).gjf (generated)

047176072.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176072.mol 047176072.PUBCHEM 047176072.mol (via Jmol)
047176298.b3lyp_6-31g(d).inp

047176298.b3lyp_6-31g(d).qchem.inp (generated)

047176298.b3lyp_6-31g(d).gjf (generated)

047176298.b3lyp_6-31g(d).firefly.inp (generated)

047176298.b3lyp_6-31g(d).smash.inp (generated)

047176298.b3lyp_6-31g(d).nwchem.inp (generated) 047176298.b3lyp_6-31g(d).log.xz 047176298.td-b3lyp_6-31g+(d).inp 047176298.td-b3lyp_6-31g+(d).log.xz

047176298.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176298.td-b3lyp_6-31+g(d).gjf (generated)

047176298.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176298.mol 047176298.PUBCHEM 047176298.mol (via Jmol)
047176368.b3lyp_6-31g(d).inp

047176368.b3lyp_6-31g(d).qchem.inp (generated)

047176368.b3lyp_6-31g(d).gjf (generated)

047176368.b3lyp_6-31g(d).firefly.inp (generated)

047176368.b3lyp_6-31g(d).smash.inp (generated)

047176368.b3lyp_6-31g(d).nwchem.inp (generated) 047176368.b3lyp_6-31g(d).log.xz 047176368.td-b3lyp_6-31g+(d).inp 047176368.td-b3lyp_6-31g+(d).log.xz

047176368.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176368.td-b3lyp_6-31+g(d).gjf (generated)

047176368.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176368.mol 047176368.PUBCHEM 047176368.mol (via Jmol)
047176418.b3lyp_6-31g(d).inp

047176418.b3lyp_6-31g(d).qchem.inp (generated)

047176418.b3lyp_6-31g(d).gjf (generated)

047176418.b3lyp_6-31g(d).firefly.inp (generated)

047176418.b3lyp_6-31g(d).smash.inp (generated)

047176418.b3lyp_6-31g(d).nwchem.inp (generated) 047176418.b3lyp_6-31g(d).log.xz 047176418.td-b3lyp_6-31g+(d).inp 047176418.td-b3lyp_6-31g+(d).log.xz

047176418.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176418.td-b3lyp_6-31+g(d).gjf (generated)

047176418.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176418.mol 047176418.PUBCHEM 047176418.mol (via Jmol)
047176449.b3lyp_6-31g(d).inp

047176449.b3lyp_6-31g(d).qchem.inp (generated)

047176449.b3lyp_6-31g(d).gjf (generated)

047176449.b3lyp_6-31g(d).firefly.inp (generated)

047176449.b3lyp_6-31g(d).smash.inp (generated)

047176449.b3lyp_6-31g(d).nwchem.inp (generated) 047176449.b3lyp_6-31g(d).log.xz 047176449.td-b3lyp_6-31g+(d).inp 047176449.td-b3lyp_6-31g+(d).log.xz

047176449.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176449.td-b3lyp_6-31+g(d).gjf (generated)

047176449.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176449.mol 047176449.PUBCHEM 047176449.mol (via Jmol)
047176467.b3lyp_6-31g(d).inp

047176467.b3lyp_6-31g(d).qchem.inp (generated)

047176467.b3lyp_6-31g(d).gjf (generated)

047176467.b3lyp_6-31g(d).firefly.inp (generated)

047176467.b3lyp_6-31g(d).smash.inp (generated)

047176467.b3lyp_6-31g(d).nwchem.inp (generated) 047176467.b3lyp_6-31g(d).log.xz 047176467.mol 047176467.PUBCHEM 047176467.mol (via Jmol)
047176646.b3lyp_6-31g(d).inp

047176646.b3lyp_6-31g(d).qchem.inp (generated)

047176646.b3lyp_6-31g(d).gjf (generated)

047176646.b3lyp_6-31g(d).firefly.inp (generated)

047176646.b3lyp_6-31g(d).smash.inp (generated)

047176646.b3lyp_6-31g(d).nwchem.inp (generated) 047176646.b3lyp_6-31g(d).log.xz 047176646.mol 047176646.PUBCHEM 047176646.mol (via Jmol)
047176676.b3lyp_6-31g(d).inp

047176676.b3lyp_6-31g(d).qchem.inp (generated)

047176676.b3lyp_6-31g(d).gjf (generated)

047176676.b3lyp_6-31g(d).firefly.inp (generated)

047176676.b3lyp_6-31g(d).smash.inp (generated)

047176676.b3lyp_6-31g(d).nwchem.inp (generated) 047176676.b3lyp_6-31g(d).log.xz 047176676.mol 047176676.PUBCHEM 047176676.mol (via Jmol)
047176741.b3lyp_6-31g(d).inp

047176741.b3lyp_6-31g(d).qchem.inp (generated)

047176741.b3lyp_6-31g(d).gjf (generated)

047176741.b3lyp_6-31g(d).firefly.inp (generated)

047176741.b3lyp_6-31g(d).smash.inp (generated)

047176741.b3lyp_6-31g(d).nwchem.inp (generated) 047176741.b3lyp_6-31g(d).log.xz 047176741.td-b3lyp_6-31g+(d).inp 047176741.td-b3lyp_6-31g+(d).log.xz

047176741.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176741.td-b3lyp_6-31+g(d).gjf (generated)

047176741.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176741.mol 047176741.PUBCHEM 047176741.mol (via Jmol)
047176768.b3lyp_6-31g(d).inp

047176768.b3lyp_6-31g(d).qchem.inp (generated)

047176768.b3lyp_6-31g(d).gjf (generated)

047176768.b3lyp_6-31g(d).firefly.inp (generated)

047176768.b3lyp_6-31g(d).smash.inp (generated)

047176768.b3lyp_6-31g(d).nwchem.inp (generated) 047176768.b3lyp_6-31g(d).log.xz 047176768.td-b3lyp_6-31g+(d).inp 047176768.td-b3lyp_6-31g+(d).log.xz

047176768.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176768.td-b3lyp_6-31+g(d).gjf (generated)

047176768.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176768.mol 047176768.PUBCHEM 047176768.mol (via Jmol)
047176776.b3lyp_6-31g(d).inp

047176776.b3lyp_6-31g(d).qchem.inp (generated)

047176776.b3lyp_6-31g(d).gjf (generated)

047176776.b3lyp_6-31g(d).firefly.inp (generated)

047176776.b3lyp_6-31g(d).smash.inp (generated)

047176776.b3lyp_6-31g(d).nwchem.inp (generated) 047176776.b3lyp_6-31g(d).log.xz 047176776.td-b3lyp_6-31g+(d).inp 047176776.td-b3lyp_6-31g+(d).log.xz

047176776.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176776.td-b3lyp_6-31+g(d).gjf (generated)

047176776.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176776.mol 047176776.PUBCHEM 047176776.mol (via Jmol)
047176791.b3lyp_6-31g(d).inp

047176791.b3lyp_6-31g(d).qchem.inp (generated)

047176791.b3lyp_6-31g(d).gjf (generated)

047176791.b3lyp_6-31g(d).firefly.inp (generated)

047176791.b3lyp_6-31g(d).smash.inp (generated)

047176791.b3lyp_6-31g(d).nwchem.inp (generated) 047176791.b3lyp_6-31g(d).log.xz 047176791.mol 047176791.PUBCHEM 047176791.mol (via Jmol)
047176909.b3lyp_6-31g(d).inp

047176909.b3lyp_6-31g(d).qchem.inp (generated)

047176909.b3lyp_6-31g(d).gjf (generated)

047176909.b3lyp_6-31g(d).firefly.inp (generated)

047176909.b3lyp_6-31g(d).smash.inp (generated)

047176909.b3lyp_6-31g(d).nwchem.inp (generated) 047176909.b3lyp_6-31g(d).log.xz 047176909.mol 047176909.PUBCHEM 047176909.mol (via Jmol)
047176915.b3lyp_6-31g(d).inp

047176915.b3lyp_6-31g(d).qchem.inp (generated)

047176915.b3lyp_6-31g(d).gjf (generated)

047176915.b3lyp_6-31g(d).firefly.inp (generated)

047176915.b3lyp_6-31g(d).smash.inp (generated)

047176915.b3lyp_6-31g(d).nwchem.inp (generated) 047176915.b3lyp_6-31g(d).log.xz 047176915.td-b3lyp_6-31g+(d).inp 047176915.td-b3lyp_6-31g+(d).log.xz

047176915.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176915.td-b3lyp_6-31+g(d).gjf (generated)

047176915.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176915.mol 047176915.PUBCHEM 047176915.mol (via Jmol)
047176984.b3lyp_6-31g(d).inp

047176984.b3lyp_6-31g(d).qchem.inp (generated)

047176984.b3lyp_6-31g(d).gjf (generated)

047176984.b3lyp_6-31g(d).firefly.inp (generated)

047176984.b3lyp_6-31g(d).smash.inp (generated)

047176984.b3lyp_6-31g(d).nwchem.inp (generated) 047176984.b3lyp_6-31g(d).log.xz 047176984.td-b3lyp_6-31g+(d).inp 047176984.td-b3lyp_6-31g+(d).log.xz

047176984.td-b3lyp_6-31+g(d).qchem.inp (generated)

047176984.td-b3lyp_6-31+g(d).gjf (generated)

047176984.td-b3lyp_6-31+g(d).firefly.inp (generated)

047176984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047176984.mol 047176984.PUBCHEM 047176984.mol (via Jmol)
047177003.b3lyp_6-31g(d).inp

047177003.b3lyp_6-31g(d).qchem.inp (generated)

047177003.b3lyp_6-31g(d).gjf (generated)

047177003.b3lyp_6-31g(d).firefly.inp (generated)

047177003.b3lyp_6-31g(d).smash.inp (generated)

047177003.b3lyp_6-31g(d).nwchem.inp (generated) 047177003.b3lyp_6-31g(d).log.xz 047177003.td-b3lyp_6-31g+(d).inp 047177003.td-b3lyp_6-31g+(d).log.xz

047177003.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177003.td-b3lyp_6-31+g(d).gjf (generated)

047177003.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177003.mol 047177003.PUBCHEM 047177003.mol (via Jmol)
047177008.b3lyp_6-31g(d).inp

047177008.b3lyp_6-31g(d).qchem.inp (generated)

047177008.b3lyp_6-31g(d).gjf (generated)

047177008.b3lyp_6-31g(d).firefly.inp (generated)

047177008.b3lyp_6-31g(d).smash.inp (generated)

047177008.b3lyp_6-31g(d).nwchem.inp (generated) 047177008.b3lyp_6-31g(d).log.xz 047177008.td-b3lyp_6-31g+(d).inp 047177008.td-b3lyp_6-31g+(d).log.xz

047177008.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177008.td-b3lyp_6-31+g(d).gjf (generated)

047177008.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177008.mol 047177008.PUBCHEM 047177008.mol (via Jmol)
047177136.b3lyp_6-31g(d).inp

047177136.b3lyp_6-31g(d).qchem.inp (generated)

047177136.b3lyp_6-31g(d).gjf (generated)

047177136.b3lyp_6-31g(d).firefly.inp (generated)

047177136.b3lyp_6-31g(d).smash.inp (generated)

047177136.b3lyp_6-31g(d).nwchem.inp (generated) 047177136.b3lyp_6-31g(d).log.xz 047177136.td-b3lyp_6-31g+(d).inp 047177136.td-b3lyp_6-31g+(d).log.xz

047177136.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177136.td-b3lyp_6-31+g(d).gjf (generated)

047177136.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177136.mol 047177136.PUBCHEM 047177136.mol (via Jmol)
047177147.b3lyp_6-31g(d).inp

047177147.b3lyp_6-31g(d).qchem.inp (generated)

047177147.b3lyp_6-31g(d).gjf (generated)

047177147.b3lyp_6-31g(d).firefly.inp (generated)

047177147.b3lyp_6-31g(d).smash.inp (generated)

047177147.b3lyp_6-31g(d).nwchem.inp (generated) 047177147.b3lyp_6-31g(d).log.xz 047177147.td-b3lyp_6-31g+(d).inp 047177147.td-b3lyp_6-31g+(d).log.xz

047177147.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177147.td-b3lyp_6-31+g(d).gjf (generated)

047177147.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177147.mol 047177147.PUBCHEM 047177147.mol (via Jmol)
047177213.b3lyp_6-31g(d).inp

047177213.b3lyp_6-31g(d).qchem.inp (generated)

047177213.b3lyp_6-31g(d).gjf (generated)

047177213.b3lyp_6-31g(d).firefly.inp (generated)

047177213.b3lyp_6-31g(d).smash.inp (generated)

047177213.b3lyp_6-31g(d).nwchem.inp (generated) 047177213.b3lyp_6-31g(d).log.xz 047177213.td-b3lyp_6-31g+(d).inp 047177213.td-b3lyp_6-31g+(d).log.xz

047177213.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177213.td-b3lyp_6-31+g(d).gjf (generated)

047177213.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177213.mol 047177213.PUBCHEM 047177213.mol (via Jmol)
047177220.b3lyp_6-31g(d).inp

047177220.b3lyp_6-31g(d).qchem.inp (generated)

047177220.b3lyp_6-31g(d).gjf (generated)

047177220.b3lyp_6-31g(d).firefly.inp (generated)

047177220.b3lyp_6-31g(d).smash.inp (generated)

047177220.b3lyp_6-31g(d).nwchem.inp (generated) 047177220.b3lyp_6-31g(d).log.xz 047177220.td-b3lyp_6-31g+(d).inp 047177220.td-b3lyp_6-31g+(d).log.xz

047177220.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177220.td-b3lyp_6-31+g(d).gjf (generated)

047177220.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177220.mol 047177220.PUBCHEM 047177220.mol (via Jmol)
047177227.b3lyp_6-31g(d).inp

047177227.b3lyp_6-31g(d).qchem.inp (generated)

047177227.b3lyp_6-31g(d).gjf (generated)

047177227.b3lyp_6-31g(d).firefly.inp (generated)

047177227.b3lyp_6-31g(d).smash.inp (generated)

047177227.b3lyp_6-31g(d).nwchem.inp (generated) 047177227.b3lyp_6-31g(d).log.xz 047177227.td-b3lyp_6-31g+(d).inp 047177227.td-b3lyp_6-31g+(d).log.xz

047177227.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177227.td-b3lyp_6-31+g(d).gjf (generated)

047177227.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177227.mol 047177227.PUBCHEM 047177227.mol (via Jmol)
047177241.b3lyp_6-31g(d).inp

047177241.b3lyp_6-31g(d).qchem.inp (generated)

047177241.b3lyp_6-31g(d).gjf (generated)

047177241.b3lyp_6-31g(d).firefly.inp (generated)

047177241.b3lyp_6-31g(d).smash.inp (generated)

047177241.b3lyp_6-31g(d).nwchem.inp (generated) 047177241.b3lyp_6-31g(d).log.xz 047177241.td-b3lyp_6-31g+(d).inp 047177241.td-b3lyp_6-31g+(d).log.xz

047177241.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177241.td-b3lyp_6-31+g(d).gjf (generated)

047177241.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177241.mol 047177241.PUBCHEM 047177241.mol (via Jmol)
047177260.b3lyp_6-31g(d).inp

047177260.b3lyp_6-31g(d).qchem.inp (generated)

047177260.b3lyp_6-31g(d).gjf (generated)

047177260.b3lyp_6-31g(d).firefly.inp (generated)

047177260.b3lyp_6-31g(d).smash.inp (generated)

047177260.b3lyp_6-31g(d).nwchem.inp (generated) 047177260.b3lyp_6-31g(d).log.xz 047177260.td-b3lyp_6-31g+(d).inp 047177260.td-b3lyp_6-31g+(d).log.xz

047177260.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177260.td-b3lyp_6-31+g(d).gjf (generated)

047177260.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177260.mol 047177260.PUBCHEM 047177260.mol (via Jmol)
047177269.b3lyp_6-31g(d).inp

047177269.b3lyp_6-31g(d).qchem.inp (generated)

047177269.b3lyp_6-31g(d).gjf (generated)

047177269.b3lyp_6-31g(d).firefly.inp (generated)

047177269.b3lyp_6-31g(d).smash.inp (generated)

047177269.b3lyp_6-31g(d).nwchem.inp (generated) 047177269.b3lyp_6-31g(d).log.xz 047177269.td-b3lyp_6-31g+(d).inp 047177269.td-b3lyp_6-31g+(d).log.xz

047177269.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177269.td-b3lyp_6-31+g(d).gjf (generated)

047177269.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177269.mol 047177269.PUBCHEM 047177269.mol (via Jmol)
047177283.b3lyp_6-31g(d).inp

047177283.b3lyp_6-31g(d).qchem.inp (generated)

047177283.b3lyp_6-31g(d).gjf (generated)

047177283.b3lyp_6-31g(d).firefly.inp (generated)

047177283.b3lyp_6-31g(d).smash.inp (generated)

047177283.b3lyp_6-31g(d).nwchem.inp (generated) 047177283.b3lyp_6-31g(d).log.xz 047177283.td-b3lyp_6-31g+(d).inp 047177283.td-b3lyp_6-31g+(d).log.xz

047177283.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177283.td-b3lyp_6-31+g(d).gjf (generated)

047177283.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177283.mol 047177283.PUBCHEM 047177283.mol (via Jmol)
047177286.b3lyp_6-31g(d).inp

047177286.b3lyp_6-31g(d).qchem.inp (generated)

047177286.b3lyp_6-31g(d).gjf (generated)

047177286.b3lyp_6-31g(d).firefly.inp (generated)

047177286.b3lyp_6-31g(d).smash.inp (generated)

047177286.b3lyp_6-31g(d).nwchem.inp (generated) 047177286.b3lyp_6-31g(d).log.xz 047177286.td-b3lyp_6-31g+(d).inp 047177286.td-b3lyp_6-31g+(d).log.xz

047177286.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177286.td-b3lyp_6-31+g(d).gjf (generated)

047177286.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177286.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177286.mol 047177286.PUBCHEM 047177286.mol (via Jmol)
047177293.b3lyp_6-31g(d).inp

047177293.b3lyp_6-31g(d).qchem.inp (generated)

047177293.b3lyp_6-31g(d).gjf (generated)

047177293.b3lyp_6-31g(d).firefly.inp (generated)

047177293.b3lyp_6-31g(d).smash.inp (generated)

047177293.b3lyp_6-31g(d).nwchem.inp (generated) 047177293.b3lyp_6-31g(d).log.xz 047177293.td-b3lyp_6-31g+(d).inp 047177293.td-b3lyp_6-31g+(d).log.xz

047177293.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177293.td-b3lyp_6-31+g(d).gjf (generated)

047177293.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177293.mol 047177293.PUBCHEM 047177293.mol (via Jmol)
047177362.b3lyp_6-31g(d).inp

047177362.b3lyp_6-31g(d).qchem.inp (generated)

047177362.b3lyp_6-31g(d).gjf (generated)

047177362.b3lyp_6-31g(d).firefly.inp (generated)

047177362.b3lyp_6-31g(d).smash.inp (generated)

047177362.b3lyp_6-31g(d).nwchem.inp (generated) 047177362.b3lyp_6-31g(d).log.xz 047177362.td-b3lyp_6-31g+(d).inp 047177362.td-b3lyp_6-31g+(d).log.xz

047177362.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177362.td-b3lyp_6-31+g(d).gjf (generated)

047177362.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177362.mol 047177362.PUBCHEM 047177362.mol (via Jmol)
047177379.b3lyp_6-31g(d).inp

047177379.b3lyp_6-31g(d).qchem.inp (generated)

047177379.b3lyp_6-31g(d).gjf (generated)

047177379.b3lyp_6-31g(d).firefly.inp (generated)

047177379.b3lyp_6-31g(d).smash.inp (generated)

047177379.b3lyp_6-31g(d).nwchem.inp (generated) 047177379.b3lyp_6-31g(d).log.xz 047177379.mol 047177379.PUBCHEM 047177379.mol (via Jmol)
047177386.b3lyp_6-31g(d).inp

047177386.b3lyp_6-31g(d).qchem.inp (generated)

047177386.b3lyp_6-31g(d).gjf (generated)

047177386.b3lyp_6-31g(d).firefly.inp (generated)

047177386.b3lyp_6-31g(d).smash.inp (generated)

047177386.b3lyp_6-31g(d).nwchem.inp (generated) 047177386.b3lyp_6-31g(d).log.xz 047177386.td-b3lyp_6-31g+(d).inp 047177386.td-b3lyp_6-31g+(d).log.xz

047177386.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177386.td-b3lyp_6-31+g(d).gjf (generated)

047177386.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177386.mol 047177386.PUBCHEM 047177386.mol (via Jmol)
047177432.b3lyp_6-31g(d).inp

047177432.b3lyp_6-31g(d).qchem.inp (generated)

047177432.b3lyp_6-31g(d).gjf (generated)

047177432.b3lyp_6-31g(d).firefly.inp (generated)

047177432.b3lyp_6-31g(d).smash.inp (generated)

047177432.b3lyp_6-31g(d).nwchem.inp (generated) 047177432.b3lyp_6-31g(d).log.xz 047177432.mol 047177432.PUBCHEM 047177432.mol (via Jmol)
047177639.b3lyp_6-31g(d).inp

047177639.b3lyp_6-31g(d).qchem.inp (generated)

047177639.b3lyp_6-31g(d).gjf (generated)

047177639.b3lyp_6-31g(d).firefly.inp (generated)

047177639.b3lyp_6-31g(d).smash.inp (generated)

047177639.b3lyp_6-31g(d).nwchem.inp (generated) 047177639.b3lyp_6-31g(d).log.xz 047177639.td-b3lyp_6-31g+(d).inp 047177639.td-b3lyp_6-31g+(d).log.xz

047177639.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177639.td-b3lyp_6-31+g(d).gjf (generated)

047177639.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177639.mol 047177639.PUBCHEM 047177639.mol (via Jmol)
047177646.b3lyp_6-31g(d).inp

047177646.b3lyp_6-31g(d).qchem.inp (generated)

047177646.b3lyp_6-31g(d).gjf (generated)

047177646.b3lyp_6-31g(d).firefly.inp (generated)

047177646.b3lyp_6-31g(d).smash.inp (generated)

047177646.b3lyp_6-31g(d).nwchem.inp (generated) 047177646.b3lyp_6-31g(d).log.xz 047177646.td-b3lyp_6-31g+(d).inp 047177646.td-b3lyp_6-31g+(d).log.xz

047177646.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177646.td-b3lyp_6-31+g(d).gjf (generated)

047177646.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177646.mol 047177646.PUBCHEM 047177646.mol (via Jmol)
047177762.b3lyp_6-31g(d).inp

047177762.b3lyp_6-31g(d).qchem.inp (generated)

047177762.b3lyp_6-31g(d).gjf (generated)

047177762.b3lyp_6-31g(d).firefly.inp (generated)

047177762.b3lyp_6-31g(d).smash.inp (generated)

047177762.b3lyp_6-31g(d).nwchem.inp (generated) 047177762.b3lyp_6-31g(d).log.xz 047177762.mol 047177762.PUBCHEM 047177762.mol (via Jmol)
047177838.b3lyp_6-31g(d).inp

047177838.b3lyp_6-31g(d).qchem.inp (generated)

047177838.b3lyp_6-31g(d).gjf (generated)

047177838.b3lyp_6-31g(d).firefly.inp (generated)

047177838.b3lyp_6-31g(d).smash.inp (generated)

047177838.b3lyp_6-31g(d).nwchem.inp (generated) 047177838.b3lyp_6-31g(d).log.xz 047177838.td-b3lyp_6-31g+(d).inp 047177838.td-b3lyp_6-31g+(d).log.xz

047177838.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177838.td-b3lyp_6-31+g(d).gjf (generated)

047177838.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177838.mol 047177838.PUBCHEM 047177838.mol (via Jmol)
047177849.b3lyp_6-31g(d).inp

047177849.b3lyp_6-31g(d).qchem.inp (generated)

047177849.b3lyp_6-31g(d).gjf (generated)

047177849.b3lyp_6-31g(d).firefly.inp (generated)

047177849.b3lyp_6-31g(d).smash.inp (generated)

047177849.b3lyp_6-31g(d).nwchem.inp (generated) 047177849.b3lyp_6-31g(d).log.xz 047177849.td-b3lyp_6-31g+(d).inp 047177849.td-b3lyp_6-31g+(d).log.xz

047177849.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177849.td-b3lyp_6-31+g(d).gjf (generated)

047177849.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177849.mol 047177849.PUBCHEM 047177849.mol (via Jmol)
047177879.b3lyp_6-31g(d).inp

047177879.b3lyp_6-31g(d).qchem.inp (generated)

047177879.b3lyp_6-31g(d).gjf (generated)

047177879.b3lyp_6-31g(d).firefly.inp (generated)

047177879.b3lyp_6-31g(d).smash.inp (generated)

047177879.b3lyp_6-31g(d).nwchem.inp (generated) 047177879.b3lyp_6-31g(d).log.xz 047177879.td-b3lyp_6-31g+(d).inp 047177879.td-b3lyp_6-31g+(d).log.xz

047177879.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177879.td-b3lyp_6-31+g(d).gjf (generated)

047177879.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177879.mol 047177879.PUBCHEM 047177879.mol (via Jmol)
047177944.b3lyp_6-31g(d).inp

047177944.b3lyp_6-31g(d).qchem.inp (generated)

047177944.b3lyp_6-31g(d).gjf (generated)

047177944.b3lyp_6-31g(d).firefly.inp (generated)

047177944.b3lyp_6-31g(d).smash.inp (generated)

047177944.b3lyp_6-31g(d).nwchem.inp (generated) 047177944.b3lyp_6-31g(d).log.xz 047177944.td-b3lyp_6-31g+(d).inp 047177944.td-b3lyp_6-31g+(d).log.xz

047177944.td-b3lyp_6-31+g(d).qchem.inp (generated)

047177944.td-b3lyp_6-31+g(d).gjf (generated)

047177944.td-b3lyp_6-31+g(d).firefly.inp (generated)

047177944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047177944.mol 047177944.PUBCHEM 047177944.mol (via Jmol)
047178154.b3lyp_6-31g(d).inp

047178154.b3lyp_6-31g(d).qchem.inp (generated)

047178154.b3lyp_6-31g(d).gjf (generated)

047178154.b3lyp_6-31g(d).firefly.inp (generated)

047178154.b3lyp_6-31g(d).smash.inp (generated)

047178154.b3lyp_6-31g(d).nwchem.inp (generated) 047178154.b3lyp_6-31g(d).log.xz 047178154.td-b3lyp_6-31g+(d).inp 047178154.td-b3lyp_6-31g+(d).log.xz

047178154.td-b3lyp_6-31+g(d).qchem.inp (generated)

047178154.td-b3lyp_6-31+g(d).gjf (generated)

047178154.td-b3lyp_6-31+g(d).firefly.inp (generated)

047178154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047178154.mol 047178154.PUBCHEM 047178154.mol (via Jmol)
047178277.b3lyp_6-31g(d).inp

047178277.b3lyp_6-31g(d).qchem.inp (generated)

047178277.b3lyp_6-31g(d).gjf (generated)

047178277.b3lyp_6-31g(d).firefly.inp (generated)

047178277.b3lyp_6-31g(d).smash.inp (generated)

047178277.b3lyp_6-31g(d).nwchem.inp (generated) 047178277.b3lyp_6-31g(d).log.xz 047178277.td-b3lyp_6-31g+(d).inp 047178277.td-b3lyp_6-31g+(d).log.xz

047178277.td-b3lyp_6-31+g(d).qchem.inp (generated)

047178277.td-b3lyp_6-31+g(d).gjf (generated)

047178277.td-b3lyp_6-31+g(d).firefly.inp (generated)

047178277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047178277.mol 047178277.PUBCHEM 047178277.mol (via Jmol)
047178408.b3lyp_6-31g(d).inp

047178408.b3lyp_6-31g(d).qchem.inp (generated)

047178408.b3lyp_6-31g(d).gjf (generated)

047178408.b3lyp_6-31g(d).firefly.inp (generated)

047178408.b3lyp_6-31g(d).smash.inp (generated)

047178408.b3lyp_6-31g(d).nwchem.inp (generated) 047178408.b3lyp_6-31g(d).log.xz 047178408.td-b3lyp_6-31g+(d).inp 047178408.td-b3lyp_6-31g+(d).log.xz

047178408.td-b3lyp_6-31+g(d).qchem.inp (generated)

047178408.td-b3lyp_6-31+g(d).gjf (generated)

047178408.td-b3lyp_6-31+g(d).firefly.inp (generated)

047178408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047178408.mol 047178408.PUBCHEM 047178408.mol (via Jmol)
047178465.b3lyp_6-31g(d).inp

047178465.b3lyp_6-31g(d).qchem.inp (generated)

047178465.b3lyp_6-31g(d).gjf (generated)

047178465.b3lyp_6-31g(d).firefly.inp (generated)

047178465.b3lyp_6-31g(d).smash.inp (generated)

047178465.b3lyp_6-31g(d).nwchem.inp (generated) 047178465.b3lyp_6-31g(d).log.xz 047178465.td-b3lyp_6-31g+(d).inp 047178465.td-b3lyp_6-31g+(d).log.xz

047178465.td-b3lyp_6-31+g(d).qchem.inp (generated)

047178465.td-b3lyp_6-31+g(d).gjf (generated)

047178465.td-b3lyp_6-31+g(d).firefly.inp (generated)

047178465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047178465.mol 047178465.PUBCHEM 047178465.mol (via Jmol)
047178524.b3lyp_6-31g(d).inp

047178524.b3lyp_6-31g(d).qchem.inp (generated)

047178524.b3lyp_6-31g(d).gjf (generated)

047178524.b3lyp_6-31g(d).firefly.inp (generated)

047178524.b3lyp_6-31g(d).smash.inp (generated)

047178524.b3lyp_6-31g(d).nwchem.inp (generated) 047178524.b3lyp_6-31g(d).log.xz 047178524.td-b3lyp_6-31g+(d).inp 047178524.td-b3lyp_6-31g+(d).log.xz

047178524.td-b3lyp_6-31+g(d).qchem.inp (generated)

047178524.td-b3lyp_6-31+g(d).gjf (generated)

047178524.td-b3lyp_6-31+g(d).firefly.inp (generated)

047178524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047178524.mol 047178524.PUBCHEM 047178524.mol (via Jmol)
047178719.b3lyp_6-31g(d).inp

047178719.b3lyp_6-31g(d).qchem.inp (generated)

047178719.b3lyp_6-31g(d).gjf (generated)

047178719.b3lyp_6-31g(d).firefly.inp (generated)

047178719.b3lyp_6-31g(d).smash.inp (generated)

047178719.b3lyp_6-31g(d).nwchem.inp (generated) 047178719.b3lyp_6-31g(d).log.xz 047178719.td-b3lyp_6-31g+(d).inp 047178719.td-b3lyp_6-31g+(d).log.xz

047178719.td-b3lyp_6-31+g(d).qchem.inp (generated)

047178719.td-b3lyp_6-31+g(d).gjf (generated)

047178719.td-b3lyp_6-31+g(d).firefly.inp (generated)

047178719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047178719.mol 047178719.PUBCHEM 047178719.mol (via Jmol)
047178853.b3lyp_6-31g(d).inp

047178853.b3lyp_6-31g(d).qchem.inp (generated)

047178853.b3lyp_6-31g(d).gjf (generated)

047178853.b3lyp_6-31g(d).firefly.inp (generated)

047178853.b3lyp_6-31g(d).smash.inp (generated)

047178853.b3lyp_6-31g(d).nwchem.inp (generated) 047178853.b3lyp_6-31g(d).log.xz 047178853.mol 047178853.PUBCHEM 047178853.mol (via Jmol)
047179216.b3lyp_6-31g(d).inp

047179216.b3lyp_6-31g(d).qchem.inp (generated)

047179216.b3lyp_6-31g(d).gjf (generated)

047179216.b3lyp_6-31g(d).firefly.inp (generated)

047179216.b3lyp_6-31g(d).smash.inp (generated)

047179216.b3lyp_6-31g(d).nwchem.inp (generated) 047179216.b3lyp_6-31g(d).log.xz 047179216.td-b3lyp_6-31g+(d).inp 047179216.td-b3lyp_6-31g+(d).log.xz

047179216.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179216.td-b3lyp_6-31+g(d).gjf (generated)

047179216.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179216.mol 047179216.PUBCHEM 047179216.mol (via Jmol)
047179220.b3lyp_6-31g(d).inp

047179220.b3lyp_6-31g(d).qchem.inp (generated)

047179220.b3lyp_6-31g(d).gjf (generated)

047179220.b3lyp_6-31g(d).firefly.inp (generated)

047179220.b3lyp_6-31g(d).smash.inp (generated)

047179220.b3lyp_6-31g(d).nwchem.inp (generated) 047179220.b3lyp_6-31g(d).log.xz 047179220.td-b3lyp_6-31g+(d).inp 047179220.td-b3lyp_6-31g+(d).log.xz

047179220.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179220.td-b3lyp_6-31+g(d).gjf (generated)

047179220.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179220.mol 047179220.PUBCHEM 047179220.mol (via Jmol)
047179225.b3lyp_6-31g(d).inp

047179225.b3lyp_6-31g(d).qchem.inp (generated)

047179225.b3lyp_6-31g(d).gjf (generated)

047179225.b3lyp_6-31g(d).firefly.inp (generated)

047179225.b3lyp_6-31g(d).smash.inp (generated)

047179225.b3lyp_6-31g(d).nwchem.inp (generated) 047179225.b3lyp_6-31g(d).log.xz 047179225.td-b3lyp_6-31g+(d).inp 047179225.td-b3lyp_6-31g+(d).log.xz

047179225.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179225.td-b3lyp_6-31+g(d).gjf (generated)

047179225.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179225.mol 047179225.PUBCHEM 047179225.mol (via Jmol)
047179382.b3lyp_6-31g(d).inp

047179382.b3lyp_6-31g(d).qchem.inp (generated)

047179382.b3lyp_6-31g(d).gjf (generated)

047179382.b3lyp_6-31g(d).firefly.inp (generated)

047179382.b3lyp_6-31g(d).smash.inp (generated)

047179382.b3lyp_6-31g(d).nwchem.inp (generated) 047179382.b3lyp_6-31g(d).log.xz 047179382.td-b3lyp_6-31g+(d).inp 047179382.td-b3lyp_6-31g+(d).log.xz

047179382.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179382.td-b3lyp_6-31+g(d).gjf (generated)

047179382.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179382.mol 047179382.PUBCHEM 047179382.mol (via Jmol)
047179397.b3lyp_6-31g(d).inp

047179397.b3lyp_6-31g(d).qchem.inp (generated)

047179397.b3lyp_6-31g(d).gjf (generated)

047179397.b3lyp_6-31g(d).firefly.inp (generated)

047179397.b3lyp_6-31g(d).smash.inp (generated)

047179397.b3lyp_6-31g(d).nwchem.inp (generated) 047179397.b3lyp_6-31g(d).log.xz 047179397.mol 047179397.PUBCHEM 047179397.mol (via Jmol)
047179413.b3lyp_6-31g(d).inp

047179413.b3lyp_6-31g(d).qchem.inp (generated)

047179413.b3lyp_6-31g(d).gjf (generated)

047179413.b3lyp_6-31g(d).firefly.inp (generated)

047179413.b3lyp_6-31g(d).smash.inp (generated)

047179413.b3lyp_6-31g(d).nwchem.inp (generated) 047179413.b3lyp_6-31g(d).log.xz 047179413.td-b3lyp_6-31g+(d).inp 047179413.td-b3lyp_6-31g+(d).log.xz

047179413.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179413.td-b3lyp_6-31+g(d).gjf (generated)

047179413.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179413.mol 047179413.PUBCHEM 047179413.mol (via Jmol)
047179426.b3lyp_6-31g(d).inp

047179426.b3lyp_6-31g(d).qchem.inp (generated)

047179426.b3lyp_6-31g(d).gjf (generated)

047179426.b3lyp_6-31g(d).firefly.inp (generated)

047179426.b3lyp_6-31g(d).smash.inp (generated)

047179426.b3lyp_6-31g(d).nwchem.inp (generated) 047179426.b3lyp_6-31g(d).log.xz 047179426.mol 047179426.PUBCHEM 047179426.mol (via Jmol)
047179439.b3lyp_6-31g(d).inp

047179439.b3lyp_6-31g(d).qchem.inp (generated)

047179439.b3lyp_6-31g(d).gjf (generated)

047179439.b3lyp_6-31g(d).firefly.inp (generated)

047179439.b3lyp_6-31g(d).smash.inp (generated)

047179439.b3lyp_6-31g(d).nwchem.inp (generated) 047179439.b3lyp_6-31g(d).log.xz 047179439.mol 047179439.PUBCHEM 047179439.mol (via Jmol)
047179451.b3lyp_6-31g(d).inp

047179451.b3lyp_6-31g(d).qchem.inp (generated)

047179451.b3lyp_6-31g(d).gjf (generated)

047179451.b3lyp_6-31g(d).firefly.inp (generated)

047179451.b3lyp_6-31g(d).smash.inp (generated)

047179451.b3lyp_6-31g(d).nwchem.inp (generated) 047179451.b3lyp_6-31g(d).log.xz 047179451.td-b3lyp_6-31g+(d).inp 047179451.td-b3lyp_6-31g+(d).log.xz

047179451.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179451.td-b3lyp_6-31+g(d).gjf (generated)

047179451.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179451.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179451.mol 047179451.PUBCHEM 047179451.mol (via Jmol)
047179455.b3lyp_6-31g(d).inp

047179455.b3lyp_6-31g(d).qchem.inp (generated)

047179455.b3lyp_6-31g(d).gjf (generated)

047179455.b3lyp_6-31g(d).firefly.inp (generated)

047179455.b3lyp_6-31g(d).smash.inp (generated)

047179455.b3lyp_6-31g(d).nwchem.inp (generated) 047179455.b3lyp_6-31g(d).log.xz 047179455.td-b3lyp_6-31g+(d).inp 047179455.td-b3lyp_6-31g+(d).log.xz

047179455.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179455.td-b3lyp_6-31+g(d).gjf (generated)

047179455.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179455.mol 047179455.PUBCHEM 047179455.mol (via Jmol)
047179511.b3lyp_6-31g(d).inp

047179511.b3lyp_6-31g(d).qchem.inp (generated)

047179511.b3lyp_6-31g(d).gjf (generated)

047179511.b3lyp_6-31g(d).firefly.inp (generated)

047179511.b3lyp_6-31g(d).smash.inp (generated)

047179511.b3lyp_6-31g(d).nwchem.inp (generated) 047179511.b3lyp_6-31g(d).log.xz 047179511.td-b3lyp_6-31g+(d).inp 047179511.td-b3lyp_6-31g+(d).log.xz

047179511.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179511.td-b3lyp_6-31+g(d).gjf (generated)

047179511.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179511.mol 047179511.PUBCHEM 047179511.mol (via Jmol)
047179514.b3lyp_6-31g(d).inp

047179514.b3lyp_6-31g(d).qchem.inp (generated)

047179514.b3lyp_6-31g(d).gjf (generated)

047179514.b3lyp_6-31g(d).firefly.inp (generated)

047179514.b3lyp_6-31g(d).smash.inp (generated)

047179514.b3lyp_6-31g(d).nwchem.inp (generated) 047179514.b3lyp_6-31g(d).log.xz 047179514.mol 047179514.PUBCHEM 047179514.mol (via Jmol)
047179657.b3lyp_6-31g(d).inp

047179657.b3lyp_6-31g(d).qchem.inp (generated)

047179657.b3lyp_6-31g(d).gjf (generated)

047179657.b3lyp_6-31g(d).firefly.inp (generated)

047179657.b3lyp_6-31g(d).smash.inp (generated)

047179657.b3lyp_6-31g(d).nwchem.inp (generated) 047179657.b3lyp_6-31g(d).log.xz 047179657.td-b3lyp_6-31g+(d).inp 047179657.td-b3lyp_6-31g+(d).log.xz

047179657.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179657.td-b3lyp_6-31+g(d).gjf (generated)

047179657.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179657.mol 047179657.PUBCHEM 047179657.mol (via Jmol)
047179700.b3lyp_6-31g(d).inp

047179700.b3lyp_6-31g(d).qchem.inp (generated)

047179700.b3lyp_6-31g(d).gjf (generated)

047179700.b3lyp_6-31g(d).firefly.inp (generated)

047179700.b3lyp_6-31g(d).smash.inp (generated)

047179700.b3lyp_6-31g(d).nwchem.inp (generated) 047179700.b3lyp_6-31g(d).log.xz 047179700.td-b3lyp_6-31g+(d).inp 047179700.td-b3lyp_6-31g+(d).log.xz

047179700.td-b3lyp_6-31+g(d).qchem.inp (generated)

047179700.td-b3lyp_6-31+g(d).gjf (generated)

047179700.td-b3lyp_6-31+g(d).firefly.inp (generated)

047179700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047179700.mol 047179700.PUBCHEM 047179700.mol (via Jmol)
047180328.b3lyp_6-31g(d).inp

047180328.b3lyp_6-31g(d).qchem.inp (generated)

047180328.b3lyp_6-31g(d).gjf (generated)

047180328.b3lyp_6-31g(d).firefly.inp (generated)

047180328.b3lyp_6-31g(d).smash.inp (generated)

047180328.b3lyp_6-31g(d).nwchem.inp (generated) 047180328.b3lyp_6-31g(d).log.xz 047180328.mol 047180328.PUBCHEM 047180328.mol (via Jmol)
047180489.b3lyp_6-31g(d).inp

047180489.b3lyp_6-31g(d).qchem.inp (generated)

047180489.b3lyp_6-31g(d).gjf (generated)

047180489.b3lyp_6-31g(d).firefly.inp (generated)

047180489.b3lyp_6-31g(d).smash.inp (generated)

047180489.b3lyp_6-31g(d).nwchem.inp (generated) 047180489.b3lyp_6-31g(d).log.xz 047180489.td-b3lyp_6-31g+(d).inp 047180489.td-b3lyp_6-31g+(d).log.xz

047180489.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180489.td-b3lyp_6-31+g(d).gjf (generated)

047180489.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180489.mol 047180489.PUBCHEM 047180489.mol (via Jmol)
047180662.b3lyp_6-31g(d).inp

047180662.b3lyp_6-31g(d).qchem.inp (generated)

047180662.b3lyp_6-31g(d).gjf (generated)

047180662.b3lyp_6-31g(d).firefly.inp (generated)

047180662.b3lyp_6-31g(d).smash.inp (generated)

047180662.b3lyp_6-31g(d).nwchem.inp (generated) 047180662.b3lyp_6-31g(d).log.xz 047180662.td-b3lyp_6-31g+(d).inp 047180662.td-b3lyp_6-31g+(d).log.xz

047180662.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180662.td-b3lyp_6-31+g(d).gjf (generated)

047180662.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180662.mol 047180662.PUBCHEM 047180662.mol (via Jmol)
047180759.b3lyp_6-31g(d).inp

047180759.b3lyp_6-31g(d).qchem.inp (generated)

047180759.b3lyp_6-31g(d).gjf (generated)

047180759.b3lyp_6-31g(d).firefly.inp (generated)

047180759.b3lyp_6-31g(d).smash.inp (generated)

047180759.b3lyp_6-31g(d).nwchem.inp (generated) 047180759.b3lyp_6-31g(d).log.xz 047180759.td-b3lyp_6-31g+(d).inp 047180759.td-b3lyp_6-31g+(d).log.xz

047180759.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180759.td-b3lyp_6-31+g(d).gjf (generated)

047180759.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180759.mol 047180759.PUBCHEM 047180759.mol (via Jmol)
047180810.b3lyp_6-31g(d).inp

047180810.b3lyp_6-31g(d).qchem.inp (generated)

047180810.b3lyp_6-31g(d).gjf (generated)

047180810.b3lyp_6-31g(d).firefly.inp (generated)

047180810.b3lyp_6-31g(d).smash.inp (generated)

047180810.b3lyp_6-31g(d).nwchem.inp (generated) 047180810.b3lyp_6-31g(d).log.xz 047180810.td-b3lyp_6-31g+(d).inp 047180810.td-b3lyp_6-31g+(d).log.xz

047180810.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180810.td-b3lyp_6-31+g(d).gjf (generated)

047180810.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180810.mol 047180810.PUBCHEM 047180810.mol (via Jmol)
047180817.b3lyp_6-31g(d).inp

047180817.b3lyp_6-31g(d).qchem.inp (generated)

047180817.b3lyp_6-31g(d).gjf (generated)

047180817.b3lyp_6-31g(d).firefly.inp (generated)

047180817.b3lyp_6-31g(d).smash.inp (generated)

047180817.b3lyp_6-31g(d).nwchem.inp (generated) 047180817.b3lyp_6-31g(d).log.xz 047180817.td-b3lyp_6-31g+(d).inp 047180817.td-b3lyp_6-31g+(d).log.xz

047180817.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180817.td-b3lyp_6-31+g(d).gjf (generated)

047180817.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180817.mol 047180817.PUBCHEM 047180817.mol (via Jmol)
047180862.b3lyp_6-31g(d).inp

047180862.b3lyp_6-31g(d).qchem.inp (generated)

047180862.b3lyp_6-31g(d).gjf (generated)

047180862.b3lyp_6-31g(d).firefly.inp (generated)

047180862.b3lyp_6-31g(d).smash.inp (generated)

047180862.b3lyp_6-31g(d).nwchem.inp (generated) 047180862.b3lyp_6-31g(d).log.xz 047180862.td-b3lyp_6-31g+(d).inp 047180862.td-b3lyp_6-31g+(d).log.xz

047180862.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180862.td-b3lyp_6-31+g(d).gjf (generated)

047180862.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180862.mol 047180862.PUBCHEM 047180862.mol (via Jmol)
047180945.b3lyp_6-31g(d).inp

047180945.b3lyp_6-31g(d).qchem.inp (generated)

047180945.b3lyp_6-31g(d).gjf (generated)

047180945.b3lyp_6-31g(d).firefly.inp (generated)

047180945.b3lyp_6-31g(d).smash.inp (generated)

047180945.b3lyp_6-31g(d).nwchem.inp (generated) 047180945.b3lyp_6-31g(d).log.xz 047180945.td-b3lyp_6-31g+(d).inp 047180945.td-b3lyp_6-31g+(d).log.xz

047180945.td-b3lyp_6-31+g(d).qchem.inp (generated)

047180945.td-b3lyp_6-31+g(d).gjf (generated)

047180945.td-b3lyp_6-31+g(d).firefly.inp (generated)

047180945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047180945.mol 047180945.PUBCHEM 047180945.mol (via Jmol)
047181635.b3lyp_6-31g(d).inp

047181635.b3lyp_6-31g(d).qchem.inp (generated)

047181635.b3lyp_6-31g(d).gjf (generated)

047181635.b3lyp_6-31g(d).firefly.inp (generated)

047181635.b3lyp_6-31g(d).smash.inp (generated)

047181635.b3lyp_6-31g(d).nwchem.inp (generated) 047181635.b3lyp_6-31g(d).log.xz 047181635.td-b3lyp_6-31g+(d).inp 047181635.td-b3lyp_6-31g+(d).log.xz

047181635.td-b3lyp_6-31+g(d).qchem.inp (generated)

047181635.td-b3lyp_6-31+g(d).gjf (generated)

047181635.td-b3lyp_6-31+g(d).firefly.inp (generated)

047181635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047181635.mol 047181635.PUBCHEM 047181635.mol (via Jmol)
047181691.b3lyp_6-31g(d).inp

047181691.b3lyp_6-31g(d).qchem.inp (generated)

047181691.b3lyp_6-31g(d).gjf (generated)

047181691.b3lyp_6-31g(d).firefly.inp (generated)

047181691.b3lyp_6-31g(d).smash.inp (generated)

047181691.b3lyp_6-31g(d).nwchem.inp (generated) 047181691.b3lyp_6-31g(d).log.xz 047181691.mol 047181691.PUBCHEM 047181691.mol (via Jmol)
047181774.b3lyp_6-31g(d).inp

047181774.b3lyp_6-31g(d).qchem.inp (generated)

047181774.b3lyp_6-31g(d).gjf (generated)

047181774.b3lyp_6-31g(d).firefly.inp (generated)

047181774.b3lyp_6-31g(d).smash.inp (generated)

047181774.b3lyp_6-31g(d).nwchem.inp (generated) 047181774.b3lyp_6-31g(d).log.xz 047181774.mol 047181774.PUBCHEM 047181774.mol (via Jmol)
047182196.b3lyp_6-31g(d).inp

047182196.b3lyp_6-31g(d).qchem.inp (generated)

047182196.b3lyp_6-31g(d).gjf (generated)

047182196.b3lyp_6-31g(d).firefly.inp (generated)

047182196.b3lyp_6-31g(d).smash.inp (generated)

047182196.b3lyp_6-31g(d).nwchem.inp (generated) 047182196.b3lyp_6-31g(d).log.xz 047182196.mol 047182196.PUBCHEM 047182196.mol (via Jmol)
047182231.b3lyp_6-31g(d).inp

047182231.b3lyp_6-31g(d).qchem.inp (generated)

047182231.b3lyp_6-31g(d).gjf (generated)

047182231.b3lyp_6-31g(d).firefly.inp (generated)

047182231.b3lyp_6-31g(d).smash.inp (generated)

047182231.b3lyp_6-31g(d).nwchem.inp (generated) 047182231.b3lyp_6-31g(d).log.xz 047182231.mol 047182231.PUBCHEM 047182231.mol (via Jmol)
047182261.b3lyp_6-31g(d).inp

047182261.b3lyp_6-31g(d).qchem.inp (generated)

047182261.b3lyp_6-31g(d).gjf (generated)

047182261.b3lyp_6-31g(d).firefly.inp (generated)

047182261.b3lyp_6-31g(d).smash.inp (generated)

047182261.b3lyp_6-31g(d).nwchem.inp (generated) 047182261.b3lyp_6-31g(d).log.xz 047182261.td-b3lyp_6-31g+(d).inp 047182261.td-b3lyp_6-31g+(d).log.xz

047182261.td-b3lyp_6-31+g(d).qchem.inp (generated)

047182261.td-b3lyp_6-31+g(d).gjf (generated)

047182261.td-b3lyp_6-31+g(d).firefly.inp (generated)

047182261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047182261.mol 047182261.PUBCHEM 047182261.mol (via Jmol)
047182298.b3lyp_6-31g(d).inp

047182298.b3lyp_6-31g(d).qchem.inp (generated)

047182298.b3lyp_6-31g(d).gjf (generated)

047182298.b3lyp_6-31g(d).firefly.inp (generated)

047182298.b3lyp_6-31g(d).smash.inp (generated)

047182298.b3lyp_6-31g(d).nwchem.inp (generated) 047182298.b3lyp_6-31g(d).log.xz 047182298.mol 047182298.PUBCHEM 047182298.mol (via Jmol)
047182320.b3lyp_6-31g(d).inp

047182320.b3lyp_6-31g(d).qchem.inp (generated)

047182320.b3lyp_6-31g(d).gjf (generated)

047182320.b3lyp_6-31g(d).firefly.inp (generated)

047182320.b3lyp_6-31g(d).smash.inp (generated)

047182320.b3lyp_6-31g(d).nwchem.inp (generated) 047182320.b3lyp_6-31g(d).log.xz 047182320.mol 047182320.PUBCHEM 047182320.mol (via Jmol)
047182412.b3lyp_6-31g(d).inp

047182412.b3lyp_6-31g(d).qchem.inp (generated)

047182412.b3lyp_6-31g(d).gjf (generated)

047182412.b3lyp_6-31g(d).firefly.inp (generated)

047182412.b3lyp_6-31g(d).smash.inp (generated)

047182412.b3lyp_6-31g(d).nwchem.inp (generated) 047182412.b3lyp_6-31g(d).log.xz 047182412.td-b3lyp_6-31g+(d).inp 047182412.td-b3lyp_6-31g+(d).log.xz

047182412.td-b3lyp_6-31+g(d).qchem.inp (generated)

047182412.td-b3lyp_6-31+g(d).gjf (generated)

047182412.td-b3lyp_6-31+g(d).firefly.inp (generated)

047182412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047182412.mol 047182412.PUBCHEM 047182412.mol (via Jmol)
047182472.b3lyp_6-31g(d).inp

047182472.b3lyp_6-31g(d).qchem.inp (generated)

047182472.b3lyp_6-31g(d).gjf (generated)

047182472.b3lyp_6-31g(d).firefly.inp (generated)

047182472.b3lyp_6-31g(d).smash.inp (generated)

047182472.b3lyp_6-31g(d).nwchem.inp (generated) 047182472.b3lyp_6-31g(d).log.xz 047182472.td-b3lyp_6-31g+(d).inp 047182472.td-b3lyp_6-31g+(d).log.xz

047182472.td-b3lyp_6-31+g(d).qchem.inp (generated)

047182472.td-b3lyp_6-31+g(d).gjf (generated)

047182472.td-b3lyp_6-31+g(d).firefly.inp (generated)

047182472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047182472.mol 047182472.PUBCHEM 047182472.mol (via Jmol)
047182577.b3lyp_6-31g(d).inp

047182577.b3lyp_6-31g(d).qchem.inp (generated)

047182577.b3lyp_6-31g(d).gjf (generated)

047182577.b3lyp_6-31g(d).firefly.inp (generated)

047182577.b3lyp_6-31g(d).smash.inp (generated)

047182577.b3lyp_6-31g(d).nwchem.inp (generated) 047182577.b3lyp_6-31g(d).log.xz 047182577.td-b3lyp_6-31g+(d).inp 047182577.td-b3lyp_6-31g+(d).log.xz

047182577.td-b3lyp_6-31+g(d).qchem.inp (generated)

047182577.td-b3lyp_6-31+g(d).gjf (generated)

047182577.td-b3lyp_6-31+g(d).firefly.inp (generated)

047182577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047182577.mol 047182577.PUBCHEM 047182577.mol (via Jmol)
047182580.b3lyp_6-31g(d).inp

047182580.b3lyp_6-31g(d).qchem.inp (generated)

047182580.b3lyp_6-31g(d).gjf (generated)

047182580.b3lyp_6-31g(d).firefly.inp (generated)

047182580.b3lyp_6-31g(d).smash.inp (generated)

047182580.b3lyp_6-31g(d).nwchem.inp (generated) 047182580.b3lyp_6-31g(d).log.xz 047182580.td-b3lyp_6-31g+(d).inp 047182580.td-b3lyp_6-31g+(d).log.xz

047182580.td-b3lyp_6-31+g(d).qchem.inp (generated)

047182580.td-b3lyp_6-31+g(d).gjf (generated)

047182580.td-b3lyp_6-31+g(d).firefly.inp (generated)

047182580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047182580.mol 047182580.PUBCHEM 047182580.mol (via Jmol)
047182697.b3lyp_6-31g(d).inp

047182697.b3lyp_6-31g(d).qchem.inp (generated)

047182697.b3lyp_6-31g(d).gjf (generated)

047182697.b3lyp_6-31g(d).firefly.inp (generated)

047182697.b3lyp_6-31g(d).smash.inp (generated)

047182697.b3lyp_6-31g(d).nwchem.inp (generated) 047182697.b3lyp_6-31g(d).log.xz 047182697.mol 047182697.PUBCHEM 047182697.mol (via Jmol)
047182818.b3lyp_6-31g(d).inp

047182818.b3lyp_6-31g(d).qchem.inp (generated)

047182818.b3lyp_6-31g(d).gjf (generated)

047182818.b3lyp_6-31g(d).firefly.inp (generated)

047182818.b3lyp_6-31g(d).smash.inp (generated)

047182818.b3lyp_6-31g(d).nwchem.inp (generated) 047182818.b3lyp_6-31g(d).log.xz 047182818.mol 047182818.PUBCHEM 047182818.mol (via Jmol)
047182882.b3lyp_6-31g(d).inp

047182882.b3lyp_6-31g(d).qchem.inp (generated)

047182882.b3lyp_6-31g(d).gjf (generated)

047182882.b3lyp_6-31g(d).firefly.inp (generated)

047182882.b3lyp_6-31g(d).smash.inp (generated)

047182882.b3lyp_6-31g(d).nwchem.inp (generated) 047182882.b3lyp_6-31g(d).log.xz 047182882.mol 047182882.PUBCHEM 047182882.mol (via Jmol)
047183327.b3lyp_6-31g(d).inp

047183327.b3lyp_6-31g(d).qchem.inp (generated)

047183327.b3lyp_6-31g(d).gjf (generated)

047183327.b3lyp_6-31g(d).firefly.inp (generated)

047183327.b3lyp_6-31g(d).smash.inp (generated)

047183327.b3lyp_6-31g(d).nwchem.inp (generated) 047183327.b3lyp_6-31g(d).log.xz 047183327.mol 047183327.PUBCHEM 047183327.mol (via Jmol)
047183789.b3lyp_6-31g(d).inp

047183789.b3lyp_6-31g(d).qchem.inp (generated)

047183789.b3lyp_6-31g(d).gjf (generated)

047183789.b3lyp_6-31g(d).firefly.inp (generated)

047183789.b3lyp_6-31g(d).smash.inp (generated)

047183789.b3lyp_6-31g(d).nwchem.inp (generated) 047183789.b3lyp_6-31g(d).log.xz 047183789.mol 047183789.PUBCHEM 047183789.mol (via Jmol)
047183791.b3lyp_6-31g(d).inp

047183791.b3lyp_6-31g(d).qchem.inp (generated)

047183791.b3lyp_6-31g(d).gjf (generated)

047183791.b3lyp_6-31g(d).firefly.inp (generated)

047183791.b3lyp_6-31g(d).smash.inp (generated)

047183791.b3lyp_6-31g(d).nwchem.inp (generated) 047183791.b3lyp_6-31g(d).log.xz 047183791.mol 047183791.PUBCHEM 047183791.mol (via Jmol)
047183804.b3lyp_6-31g(d).inp

047183804.b3lyp_6-31g(d).qchem.inp (generated)

047183804.b3lyp_6-31g(d).gjf (generated)

047183804.b3lyp_6-31g(d).firefly.inp (generated)

047183804.b3lyp_6-31g(d).smash.inp (generated)

047183804.b3lyp_6-31g(d).nwchem.inp (generated) 047183804.b3lyp_6-31g(d).log.xz 047183804.mol 047183804.PUBCHEM 047183804.mol (via Jmol)
047183814.b3lyp_6-31g(d).inp

047183814.b3lyp_6-31g(d).qchem.inp (generated)

047183814.b3lyp_6-31g(d).gjf (generated)

047183814.b3lyp_6-31g(d).firefly.inp (generated)

047183814.b3lyp_6-31g(d).smash.inp (generated)

047183814.b3lyp_6-31g(d).nwchem.inp (generated) 047183814.b3lyp_6-31g(d).log.xz 047183814.td-b3lyp_6-31g+(d).inp 047183814.td-b3lyp_6-31g+(d).log.xz

047183814.td-b3lyp_6-31+g(d).qchem.inp (generated)

047183814.td-b3lyp_6-31+g(d).gjf (generated)

047183814.td-b3lyp_6-31+g(d).firefly.inp (generated)

047183814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047183814.mol 047183814.PUBCHEM 047183814.mol (via Jmol)
047184016.b3lyp_6-31g(d).inp

047184016.b3lyp_6-31g(d).qchem.inp (generated)

047184016.b3lyp_6-31g(d).gjf (generated)

047184016.b3lyp_6-31g(d).firefly.inp (generated)

047184016.b3lyp_6-31g(d).smash.inp (generated)

047184016.b3lyp_6-31g(d).nwchem.inp (generated) 047184016.b3lyp_6-31g(d).log.xz 047184016.td-b3lyp_6-31g+(d).inp 047184016.td-b3lyp_6-31g+(d).log.xz

047184016.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184016.td-b3lyp_6-31+g(d).gjf (generated)

047184016.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184016.mol 047184016.PUBCHEM 047184016.mol (via Jmol)
047184039.b3lyp_6-31g(d).inp

047184039.b3lyp_6-31g(d).qchem.inp (generated)

047184039.b3lyp_6-31g(d).gjf (generated)

047184039.b3lyp_6-31g(d).firefly.inp (generated)

047184039.b3lyp_6-31g(d).smash.inp (generated)

047184039.b3lyp_6-31g(d).nwchem.inp (generated) 047184039.b3lyp_6-31g(d).log.xz 047184039.td-b3lyp_6-31g+(d).inp 047184039.td-b3lyp_6-31g+(d).log.xz

047184039.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184039.td-b3lyp_6-31+g(d).gjf (generated)

047184039.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184039.mol 047184039.PUBCHEM 047184039.mol (via Jmol)
047184223.b3lyp_6-31g(d).inp

047184223.b3lyp_6-31g(d).qchem.inp (generated)

047184223.b3lyp_6-31g(d).gjf (generated)

047184223.b3lyp_6-31g(d).firefly.inp (generated)

047184223.b3lyp_6-31g(d).smash.inp (generated)

047184223.b3lyp_6-31g(d).nwchem.inp (generated) 047184223.b3lyp_6-31g(d).log.xz 047184223.td-b3lyp_6-31g+(d).inp 047184223.td-b3lyp_6-31g+(d).log.xz

047184223.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184223.td-b3lyp_6-31+g(d).gjf (generated)

047184223.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184223.mol 047184223.PUBCHEM 047184223.mol (via Jmol)
047184502.b3lyp_6-31g(d).inp

047184502.b3lyp_6-31g(d).qchem.inp (generated)

047184502.b3lyp_6-31g(d).gjf (generated)

047184502.b3lyp_6-31g(d).firefly.inp (generated)

047184502.b3lyp_6-31g(d).smash.inp (generated)

047184502.b3lyp_6-31g(d).nwchem.inp (generated) 047184502.b3lyp_6-31g(d).log.xz 047184502.td-b3lyp_6-31g+(d).inp 047184502.td-b3lyp_6-31g+(d).log.xz

047184502.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184502.td-b3lyp_6-31+g(d).gjf (generated)

047184502.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184502.mol 047184502.PUBCHEM 047184502.mol (via Jmol)
047184558.b3lyp_6-31g(d).inp

047184558.b3lyp_6-31g(d).qchem.inp (generated)

047184558.b3lyp_6-31g(d).gjf (generated)

047184558.b3lyp_6-31g(d).firefly.inp (generated)

047184558.b3lyp_6-31g(d).smash.inp (generated)

047184558.b3lyp_6-31g(d).nwchem.inp (generated) 047184558.b3lyp_6-31g(d).log.xz 047184558.mol 047184558.PUBCHEM 047184558.mol (via Jmol)
047184605.b3lyp_6-31g(d).inp

047184605.b3lyp_6-31g(d).qchem.inp (generated)

047184605.b3lyp_6-31g(d).gjf (generated)

047184605.b3lyp_6-31g(d).firefly.inp (generated)

047184605.b3lyp_6-31g(d).smash.inp (generated)

047184605.b3lyp_6-31g(d).nwchem.inp (generated) 047184605.b3lyp_6-31g(d).log.xz 047184605.td-b3lyp_6-31g+(d).inp 047184605.td-b3lyp_6-31g+(d).log.xz

047184605.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184605.td-b3lyp_6-31+g(d).gjf (generated)

047184605.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184605.mol 047184605.PUBCHEM 047184605.mol (via Jmol)
047184667.b3lyp_6-31g(d).inp

047184667.b3lyp_6-31g(d).qchem.inp (generated)

047184667.b3lyp_6-31g(d).gjf (generated)

047184667.b3lyp_6-31g(d).firefly.inp (generated)

047184667.b3lyp_6-31g(d).smash.inp (generated)

047184667.b3lyp_6-31g(d).nwchem.inp (generated) 047184667.b3lyp_6-31g(d).log.xz 047184667.td-b3lyp_6-31g+(d).inp 047184667.td-b3lyp_6-31g+(d).log.xz

047184667.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184667.td-b3lyp_6-31+g(d).gjf (generated)

047184667.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184667.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184667.mol 047184667.PUBCHEM 047184667.mol (via Jmol)
047184699.b3lyp_6-31g(d).inp

047184699.b3lyp_6-31g(d).qchem.inp (generated)

047184699.b3lyp_6-31g(d).gjf (generated)

047184699.b3lyp_6-31g(d).firefly.inp (generated)

047184699.b3lyp_6-31g(d).smash.inp (generated)

047184699.b3lyp_6-31g(d).nwchem.inp (generated) 047184699.b3lyp_6-31g(d).log.xz 047184699.td-b3lyp_6-31g+(d).inp 047184699.td-b3lyp_6-31g+(d).log.xz

047184699.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184699.td-b3lyp_6-31+g(d).gjf (generated)

047184699.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184699.mol 047184699.PUBCHEM 047184699.mol (via Jmol)
047184751.b3lyp_6-31g(d).inp

047184751.b3lyp_6-31g(d).qchem.inp (generated)

047184751.b3lyp_6-31g(d).gjf (generated)

047184751.b3lyp_6-31g(d).firefly.inp (generated)

047184751.b3lyp_6-31g(d).smash.inp (generated)

047184751.b3lyp_6-31g(d).nwchem.inp (generated) 047184751.b3lyp_6-31g(d).log.xz 047184751.td-b3lyp_6-31g+(d).inp 047184751.td-b3lyp_6-31g+(d).log.xz

047184751.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184751.td-b3lyp_6-31+g(d).gjf (generated)

047184751.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184751.mol 047184751.PUBCHEM 047184751.mol (via Jmol)
047184806.b3lyp_6-31g(d).inp

047184806.b3lyp_6-31g(d).qchem.inp (generated)

047184806.b3lyp_6-31g(d).gjf (generated)

047184806.b3lyp_6-31g(d).firefly.inp (generated)

047184806.b3lyp_6-31g(d).smash.inp (generated)

047184806.b3lyp_6-31g(d).nwchem.inp (generated) 047184806.b3lyp_6-31g(d).log.xz 047184806.td-b3lyp_6-31g+(d).inp 047184806.td-b3lyp_6-31g+(d).log.xz

047184806.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184806.td-b3lyp_6-31+g(d).gjf (generated)

047184806.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184806.mol 047184806.PUBCHEM 047184806.mol (via Jmol)
047184815.b3lyp_6-31g(d).inp

047184815.b3lyp_6-31g(d).qchem.inp (generated)

047184815.b3lyp_6-31g(d).gjf (generated)

047184815.b3lyp_6-31g(d).firefly.inp (generated)

047184815.b3lyp_6-31g(d).smash.inp (generated)

047184815.b3lyp_6-31g(d).nwchem.inp (generated) 047184815.b3lyp_6-31g(d).log.xz 047184815.td-b3lyp_6-31g+(d).inp 047184815.td-b3lyp_6-31g+(d).log.xz

047184815.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184815.td-b3lyp_6-31+g(d).gjf (generated)

047184815.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184815.mol 047184815.PUBCHEM 047184815.mol (via Jmol)
047184816.b3lyp_6-31g(d).inp

047184816.b3lyp_6-31g(d).qchem.inp (generated)

047184816.b3lyp_6-31g(d).gjf (generated)

047184816.b3lyp_6-31g(d).firefly.inp (generated)

047184816.b3lyp_6-31g(d).smash.inp (generated)

047184816.b3lyp_6-31g(d).nwchem.inp (generated) 047184816.b3lyp_6-31g(d).log.xz 047184816.td-b3lyp_6-31g+(d).inp 047184816.td-b3lyp_6-31g+(d).log.xz

047184816.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184816.td-b3lyp_6-31+g(d).gjf (generated)

047184816.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184816.mol 047184816.PUBCHEM 047184816.mol (via Jmol)
047184836.b3lyp_6-31g(d).inp

047184836.b3lyp_6-31g(d).qchem.inp (generated)

047184836.b3lyp_6-31g(d).gjf (generated)

047184836.b3lyp_6-31g(d).firefly.inp (generated)

047184836.b3lyp_6-31g(d).smash.inp (generated)

047184836.b3lyp_6-31g(d).nwchem.inp (generated) 047184836.b3lyp_6-31g(d).log.xz 047184836.td-b3lyp_6-31g+(d).inp 047184836.td-b3lyp_6-31g+(d).log.xz

047184836.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184836.td-b3lyp_6-31+g(d).gjf (generated)

047184836.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184836.mol 047184836.PUBCHEM 047184836.mol (via Jmol)
047184862.b3lyp_6-31g(d).inp

047184862.b3lyp_6-31g(d).qchem.inp (generated)

047184862.b3lyp_6-31g(d).gjf (generated)

047184862.b3lyp_6-31g(d).firefly.inp (generated)

047184862.b3lyp_6-31g(d).smash.inp (generated)

047184862.b3lyp_6-31g(d).nwchem.inp (generated) 047184862.b3lyp_6-31g(d).log.xz 047184862.td-b3lyp_6-31g+(d).inp 047184862.td-b3lyp_6-31g+(d).log.xz

047184862.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184862.td-b3lyp_6-31+g(d).gjf (generated)

047184862.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184862.mol 047184862.PUBCHEM 047184862.mol (via Jmol)
047184864.b3lyp_6-31g(d).inp

047184864.b3lyp_6-31g(d).qchem.inp (generated)

047184864.b3lyp_6-31g(d).gjf (generated)

047184864.b3lyp_6-31g(d).firefly.inp (generated)

047184864.b3lyp_6-31g(d).smash.inp (generated)

047184864.b3lyp_6-31g(d).nwchem.inp (generated) 047184864.b3lyp_6-31g(d).log.xz 047184864.td-b3lyp_6-31g+(d).inp 047184864.td-b3lyp_6-31g+(d).log.xz

047184864.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184864.td-b3lyp_6-31+g(d).gjf (generated)

047184864.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184864.mol 047184864.PUBCHEM 047184864.mol (via Jmol)
047184883.b3lyp_6-31g(d).inp

047184883.b3lyp_6-31g(d).qchem.inp (generated)

047184883.b3lyp_6-31g(d).gjf (generated)

047184883.b3lyp_6-31g(d).firefly.inp (generated)

047184883.b3lyp_6-31g(d).smash.inp (generated)

047184883.b3lyp_6-31g(d).nwchem.inp (generated) 047184883.b3lyp_6-31g(d).log.xz 047184883.td-b3lyp_6-31g+(d).inp 047184883.td-b3lyp_6-31g+(d).log.xz

047184883.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184883.td-b3lyp_6-31+g(d).gjf (generated)

047184883.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184883.mol 047184883.PUBCHEM 047184883.mol (via Jmol)
047184890.b3lyp_6-31g(d).inp

047184890.b3lyp_6-31g(d).qchem.inp (generated)

047184890.b3lyp_6-31g(d).gjf (generated)

047184890.b3lyp_6-31g(d).firefly.inp (generated)

047184890.b3lyp_6-31g(d).smash.inp (generated)

047184890.b3lyp_6-31g(d).nwchem.inp (generated) 047184890.b3lyp_6-31g(d).log.xz 047184890.td-b3lyp_6-31g+(d).inp 047184890.td-b3lyp_6-31g+(d).log.xz

047184890.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184890.td-b3lyp_6-31+g(d).gjf (generated)

047184890.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184890.mol 047184890.PUBCHEM 047184890.mol (via Jmol)
047184936.b3lyp_6-31g(d).inp

047184936.b3lyp_6-31g(d).qchem.inp (generated)

047184936.b3lyp_6-31g(d).gjf (generated)

047184936.b3lyp_6-31g(d).firefly.inp (generated)

047184936.b3lyp_6-31g(d).smash.inp (generated)

047184936.b3lyp_6-31g(d).nwchem.inp (generated) 047184936.b3lyp_6-31g(d).log.xz 047184936.mol 047184936.PUBCHEM 047184936.mol (via Jmol)
047184944.b3lyp_6-31g(d).inp

047184944.b3lyp_6-31g(d).qchem.inp (generated)

047184944.b3lyp_6-31g(d).gjf (generated)

047184944.b3lyp_6-31g(d).firefly.inp (generated)

047184944.b3lyp_6-31g(d).smash.inp (generated)

047184944.b3lyp_6-31g(d).nwchem.inp (generated) 047184944.b3lyp_6-31g(d).log.xz 047184944.mol 047184944.PUBCHEM 047184944.mol (via Jmol)
047184951.b3lyp_6-31g(d).inp

047184951.b3lyp_6-31g(d).qchem.inp (generated)

047184951.b3lyp_6-31g(d).gjf (generated)

047184951.b3lyp_6-31g(d).firefly.inp (generated)

047184951.b3lyp_6-31g(d).smash.inp (generated)

047184951.b3lyp_6-31g(d).nwchem.inp (generated) 047184951.b3lyp_6-31g(d).log.xz 047184951.td-b3lyp_6-31g+(d).inp 047184951.td-b3lyp_6-31g+(d).log.xz

047184951.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184951.td-b3lyp_6-31+g(d).gjf (generated)

047184951.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184951.mol 047184951.PUBCHEM 047184951.mol (via Jmol)
047184953.b3lyp_6-31g(d).inp

047184953.b3lyp_6-31g(d).qchem.inp (generated)

047184953.b3lyp_6-31g(d).gjf (generated)

047184953.b3lyp_6-31g(d).firefly.inp (generated)

047184953.b3lyp_6-31g(d).smash.inp (generated)

047184953.b3lyp_6-31g(d).nwchem.inp (generated) 047184953.b3lyp_6-31g(d).log.xz 047184953.td-b3lyp_6-31g+(d).inp 047184953.td-b3lyp_6-31g+(d).log.xz

047184953.td-b3lyp_6-31+g(d).qchem.inp (generated)

047184953.td-b3lyp_6-31+g(d).gjf (generated)

047184953.td-b3lyp_6-31+g(d).firefly.inp (generated)

047184953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047184953.mol 047184953.PUBCHEM 047184953.mol (via Jmol)
047185094.b3lyp_6-31g(d).inp

047185094.b3lyp_6-31g(d).qchem.inp (generated)

047185094.b3lyp_6-31g(d).gjf (generated)

047185094.b3lyp_6-31g(d).firefly.inp (generated)

047185094.b3lyp_6-31g(d).smash.inp (generated)

047185094.b3lyp_6-31g(d).nwchem.inp (generated) 047185094.b3lyp_6-31g(d).log.xz 047185094.mol 047185094.PUBCHEM 047185094.mol (via Jmol)
047185122.b3lyp_6-31g(d).inp

047185122.b3lyp_6-31g(d).qchem.inp (generated)

047185122.b3lyp_6-31g(d).gjf (generated)

047185122.b3lyp_6-31g(d).firefly.inp (generated)

047185122.b3lyp_6-31g(d).smash.inp (generated)

047185122.b3lyp_6-31g(d).nwchem.inp (generated) 047185122.b3lyp_6-31g(d).log.xz 047185122.td-b3lyp_6-31g+(d).inp 047185122.td-b3lyp_6-31g+(d).log.xz

047185122.td-b3lyp_6-31+g(d).qchem.inp (generated)

047185122.td-b3lyp_6-31+g(d).gjf (generated)

047185122.td-b3lyp_6-31+g(d).firefly.inp (generated)

047185122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047185122.mol 047185122.PUBCHEM 047185122.mol (via Jmol)
047185356.b3lyp_6-31g(d).inp

047185356.b3lyp_6-31g(d).qchem.inp (generated)

047185356.b3lyp_6-31g(d).gjf (generated)

047185356.b3lyp_6-31g(d).firefly.inp (generated)

047185356.b3lyp_6-31g(d).smash.inp (generated)

047185356.b3lyp_6-31g(d).nwchem.inp (generated) 047185356.b3lyp_6-31g(d).log.xz 047185356.td-b3lyp_6-31g+(d).inp 047185356.td-b3lyp_6-31g+(d).log.xz

047185356.td-b3lyp_6-31+g(d).qchem.inp (generated)

047185356.td-b3lyp_6-31+g(d).gjf (generated)

047185356.td-b3lyp_6-31+g(d).firefly.inp (generated)

047185356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047185356.mol 047185356.PUBCHEM 047185356.mol (via Jmol)
047185373.b3lyp_6-31g(d).inp

047185373.b3lyp_6-31g(d).qchem.inp (generated)

047185373.b3lyp_6-31g(d).gjf (generated)

047185373.b3lyp_6-31g(d).firefly.inp (generated)

047185373.b3lyp_6-31g(d).smash.inp (generated)

047185373.b3lyp_6-31g(d).nwchem.inp (generated) 047185373.b3lyp_6-31g(d).log.xz 047185373.td-b3lyp_6-31g+(d).inp 047185373.td-b3lyp_6-31g+(d).log.xz

047185373.td-b3lyp_6-31+g(d).qchem.inp (generated)

047185373.td-b3lyp_6-31+g(d).gjf (generated)

047185373.td-b3lyp_6-31+g(d).firefly.inp (generated)

047185373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047185373.mol 047185373.PUBCHEM 047185373.mol (via Jmol)
047186159.b3lyp_6-31g(d).inp

047186159.b3lyp_6-31g(d).qchem.inp (generated)

047186159.b3lyp_6-31g(d).gjf (generated)

047186159.b3lyp_6-31g(d).firefly.inp (generated)

047186159.b3lyp_6-31g(d).smash.inp (generated)

047186159.b3lyp_6-31g(d).nwchem.inp (generated) 047186159.b3lyp_6-31g(d).log.xz 047186159.td-b3lyp_6-31g+(d).inp 047186159.td-b3lyp_6-31g+(d).log.xz

047186159.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186159.td-b3lyp_6-31+g(d).gjf (generated)

047186159.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186159.mol 047186159.PUBCHEM 047186159.mol (via Jmol)
047186183.b3lyp_6-31g(d).inp

047186183.b3lyp_6-31g(d).qchem.inp (generated)

047186183.b3lyp_6-31g(d).gjf (generated)

047186183.b3lyp_6-31g(d).firefly.inp (generated)

047186183.b3lyp_6-31g(d).smash.inp (generated)

047186183.b3lyp_6-31g(d).nwchem.inp (generated) 047186183.b3lyp_6-31g(d).log.xz 047186183.td-b3lyp_6-31g+(d).inp 047186183.td-b3lyp_6-31g+(d).log.xz

047186183.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186183.td-b3lyp_6-31+g(d).gjf (generated)

047186183.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186183.mol 047186183.PUBCHEM 047186183.mol (via Jmol)
047186211.b3lyp_6-31g(d).inp

047186211.b3lyp_6-31g(d).qchem.inp (generated)

047186211.b3lyp_6-31g(d).gjf (generated)

047186211.b3lyp_6-31g(d).firefly.inp (generated)

047186211.b3lyp_6-31g(d).smash.inp (generated)

047186211.b3lyp_6-31g(d).nwchem.inp (generated) 047186211.b3lyp_6-31g(d).log.xz 047186211.td-b3lyp_6-31g+(d).inp 047186211.td-b3lyp_6-31g+(d).log.xz

047186211.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186211.td-b3lyp_6-31+g(d).gjf (generated)

047186211.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186211.mol 047186211.PUBCHEM 047186211.mol (via Jmol)
047186327.b3lyp_6-31g(d).inp

047186327.b3lyp_6-31g(d).qchem.inp (generated)

047186327.b3lyp_6-31g(d).gjf (generated)

047186327.b3lyp_6-31g(d).firefly.inp (generated)

047186327.b3lyp_6-31g(d).smash.inp (generated)

047186327.b3lyp_6-31g(d).nwchem.inp (generated) 047186327.b3lyp_6-31g(d).log.xz 047186327.mol 047186327.PUBCHEM 047186327.mol (via Jmol)
047186373.b3lyp_6-31g(d).inp

047186373.b3lyp_6-31g(d).qchem.inp (generated)

047186373.b3lyp_6-31g(d).gjf (generated)

047186373.b3lyp_6-31g(d).firefly.inp (generated)

047186373.b3lyp_6-31g(d).smash.inp (generated)

047186373.b3lyp_6-31g(d).nwchem.inp (generated) 047186373.b3lyp_6-31g(d).log.xz 047186373.td-b3lyp_6-31g+(d).inp 047186373.td-b3lyp_6-31g+(d).log.xz

047186373.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186373.td-b3lyp_6-31+g(d).gjf (generated)

047186373.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186373.mol 047186373.PUBCHEM 047186373.mol (via Jmol)
047186387.b3lyp_6-31g(d).inp

047186387.b3lyp_6-31g(d).qchem.inp (generated)

047186387.b3lyp_6-31g(d).gjf (generated)

047186387.b3lyp_6-31g(d).firefly.inp (generated)

047186387.b3lyp_6-31g(d).smash.inp (generated)

047186387.b3lyp_6-31g(d).nwchem.inp (generated) 047186387.b3lyp_6-31g(d).log.xz 047186387.mol 047186387.PUBCHEM 047186387.mol (via Jmol)
047186393.b3lyp_6-31g(d).inp

047186393.b3lyp_6-31g(d).qchem.inp (generated)

047186393.b3lyp_6-31g(d).gjf (generated)

047186393.b3lyp_6-31g(d).firefly.inp (generated)

047186393.b3lyp_6-31g(d).smash.inp (generated)

047186393.b3lyp_6-31g(d).nwchem.inp (generated) 047186393.b3lyp_6-31g(d).log.xz 047186393.td-b3lyp_6-31g+(d).inp 047186393.td-b3lyp_6-31g+(d).log.xz

047186393.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186393.td-b3lyp_6-31+g(d).gjf (generated)

047186393.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186393.mol 047186393.PUBCHEM 047186393.mol (via Jmol)
047186508.b3lyp_6-31g(d).inp

047186508.b3lyp_6-31g(d).qchem.inp (generated)

047186508.b3lyp_6-31g(d).gjf (generated)

047186508.b3lyp_6-31g(d).firefly.inp (generated)

047186508.b3lyp_6-31g(d).smash.inp (generated)

047186508.b3lyp_6-31g(d).nwchem.inp (generated) 047186508.b3lyp_6-31g(d).log.xz 047186508.mol 047186508.PUBCHEM 047186508.mol (via Jmol)
047186590.b3lyp_6-31g(d).inp

047186590.b3lyp_6-31g(d).qchem.inp (generated)

047186590.b3lyp_6-31g(d).gjf (generated)

047186590.b3lyp_6-31g(d).firefly.inp (generated)

047186590.b3lyp_6-31g(d).smash.inp (generated)

047186590.b3lyp_6-31g(d).nwchem.inp (generated) 047186590.b3lyp_6-31g(d).log.xz 047186590.td-b3lyp_6-31g+(d).inp 047186590.td-b3lyp_6-31g+(d).log.xz

047186590.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186590.td-b3lyp_6-31+g(d).gjf (generated)

047186590.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186590.mol 047186590.PUBCHEM 047186590.mol (via Jmol)
047186736.b3lyp_6-31g(d).inp

047186736.b3lyp_6-31g(d).qchem.inp (generated)

047186736.b3lyp_6-31g(d).gjf (generated)

047186736.b3lyp_6-31g(d).firefly.inp (generated)

047186736.b3lyp_6-31g(d).smash.inp (generated)

047186736.b3lyp_6-31g(d).nwchem.inp (generated) 047186736.b3lyp_6-31g(d).log.xz 047186736.mol 047186736.PUBCHEM 047186736.mol (via Jmol)
047186867.b3lyp_6-31g(d).inp

047186867.b3lyp_6-31g(d).qchem.inp (generated)

047186867.b3lyp_6-31g(d).gjf (generated)

047186867.b3lyp_6-31g(d).firefly.inp (generated)

047186867.b3lyp_6-31g(d).smash.inp (generated)

047186867.b3lyp_6-31g(d).nwchem.inp (generated) 047186867.b3lyp_6-31g(d).log.xz 047186867.td-b3lyp_6-31g+(d).inp 047186867.td-b3lyp_6-31g+(d).log.xz

047186867.td-b3lyp_6-31+g(d).qchem.inp (generated)

047186867.td-b3lyp_6-31+g(d).gjf (generated)

047186867.td-b3lyp_6-31+g(d).firefly.inp (generated)

047186867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047186867.mol 047186867.PUBCHEM 047186867.mol (via Jmol)
047187062.b3lyp_6-31g(d).inp

047187062.b3lyp_6-31g(d).qchem.inp (generated)

047187062.b3lyp_6-31g(d).gjf (generated)

047187062.b3lyp_6-31g(d).firefly.inp (generated)

047187062.b3lyp_6-31g(d).smash.inp (generated)

047187062.b3lyp_6-31g(d).nwchem.inp (generated) 047187062.b3lyp_6-31g(d).log.xz 047187062.td-b3lyp_6-31g+(d).inp 047187062.td-b3lyp_6-31g+(d).log.xz

047187062.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187062.td-b3lyp_6-31+g(d).gjf (generated)

047187062.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187062.mol 047187062.PUBCHEM 047187062.mol (via Jmol)
047187131.b3lyp_6-31g(d).inp

047187131.b3lyp_6-31g(d).qchem.inp (generated)

047187131.b3lyp_6-31g(d).gjf (generated)

047187131.b3lyp_6-31g(d).firefly.inp (generated)

047187131.b3lyp_6-31g(d).smash.inp (generated)

047187131.b3lyp_6-31g(d).nwchem.inp (generated) 047187131.b3lyp_6-31g(d).log.xz 047187131.td-b3lyp_6-31g+(d).inp 047187131.td-b3lyp_6-31g+(d).log.xz

047187131.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187131.td-b3lyp_6-31+g(d).gjf (generated)

047187131.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187131.mol 047187131.PUBCHEM 047187131.mol (via Jmol)
047187509.b3lyp_6-31g(d).inp

047187509.b3lyp_6-31g(d).qchem.inp (generated)

047187509.b3lyp_6-31g(d).gjf (generated)

047187509.b3lyp_6-31g(d).firefly.inp (generated)

047187509.b3lyp_6-31g(d).smash.inp (generated)

047187509.b3lyp_6-31g(d).nwchem.inp (generated) 047187509.b3lyp_6-31g(d).log.xz 047187509.mol 047187509.PUBCHEM 047187509.mol (via Jmol)
047187513.b3lyp_6-31g(d).inp

047187513.b3lyp_6-31g(d).qchem.inp (generated)

047187513.b3lyp_6-31g(d).gjf (generated)

047187513.b3lyp_6-31g(d).firefly.inp (generated)

047187513.b3lyp_6-31g(d).smash.inp (generated)

047187513.b3lyp_6-31g(d).nwchem.inp (generated) 047187513.b3lyp_6-31g(d).log.xz 047187513.td-b3lyp_6-31g+(d).inp 047187513.td-b3lyp_6-31g+(d).log.xz

047187513.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187513.td-b3lyp_6-31+g(d).gjf (generated)

047187513.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187513.mol 047187513.PUBCHEM 047187513.mol (via Jmol)
047187559.b3lyp_6-31g(d).inp

047187559.b3lyp_6-31g(d).qchem.inp (generated)

047187559.b3lyp_6-31g(d).gjf (generated)

047187559.b3lyp_6-31g(d).firefly.inp (generated)

047187559.b3lyp_6-31g(d).smash.inp (generated)

047187559.b3lyp_6-31g(d).nwchem.inp (generated) 047187559.b3lyp_6-31g(d).log.xz 047187559.td-b3lyp_6-31g+(d).inp 047187559.td-b3lyp_6-31g+(d).log.xz

047187559.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187559.td-b3lyp_6-31+g(d).gjf (generated)

047187559.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187559.mol 047187559.PUBCHEM 047187559.mol (via Jmol)
047187629.b3lyp_6-31g(d).inp

047187629.b3lyp_6-31g(d).qchem.inp (generated)

047187629.b3lyp_6-31g(d).gjf (generated)

047187629.b3lyp_6-31g(d).firefly.inp (generated)

047187629.b3lyp_6-31g(d).smash.inp (generated)

047187629.b3lyp_6-31g(d).nwchem.inp (generated) 047187629.b3lyp_6-31g(d).log.xz 047187629.td-b3lyp_6-31g+(d).inp 047187629.td-b3lyp_6-31g+(d).log.xz

047187629.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187629.td-b3lyp_6-31+g(d).gjf (generated)

047187629.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187629.mol 047187629.PUBCHEM 047187629.mol (via Jmol)
047187632.b3lyp_6-31g(d).inp

047187632.b3lyp_6-31g(d).qchem.inp (generated)

047187632.b3lyp_6-31g(d).gjf (generated)

047187632.b3lyp_6-31g(d).firefly.inp (generated)

047187632.b3lyp_6-31g(d).smash.inp (generated)

047187632.b3lyp_6-31g(d).nwchem.inp (generated) 047187632.b3lyp_6-31g(d).log.xz 047187632.td-b3lyp_6-31g+(d).inp 047187632.td-b3lyp_6-31g+(d).log.xz

047187632.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187632.td-b3lyp_6-31+g(d).gjf (generated)

047187632.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187632.mol 047187632.PUBCHEM 047187632.mol (via Jmol)
047187646.b3lyp_6-31g(d).inp

047187646.b3lyp_6-31g(d).qchem.inp (generated)

047187646.b3lyp_6-31g(d).gjf (generated)

047187646.b3lyp_6-31g(d).firefly.inp (generated)

047187646.b3lyp_6-31g(d).smash.inp (generated)

047187646.b3lyp_6-31g(d).nwchem.inp (generated) 047187646.b3lyp_6-31g(d).log.xz 047187646.mol 047187646.PUBCHEM 047187646.mol (via Jmol)
047187700.b3lyp_6-31g(d).inp

047187700.b3lyp_6-31g(d).qchem.inp (generated)

047187700.b3lyp_6-31g(d).gjf (generated)

047187700.b3lyp_6-31g(d).firefly.inp (generated)

047187700.b3lyp_6-31g(d).smash.inp (generated)

047187700.b3lyp_6-31g(d).nwchem.inp (generated) 047187700.b3lyp_6-31g(d).log.xz 047187700.mol 047187700.PUBCHEM 047187700.mol (via Jmol)
047187966.b3lyp_6-31g(d).inp

047187966.b3lyp_6-31g(d).qchem.inp (generated)

047187966.b3lyp_6-31g(d).gjf (generated)

047187966.b3lyp_6-31g(d).firefly.inp (generated)

047187966.b3lyp_6-31g(d).smash.inp (generated)

047187966.b3lyp_6-31g(d).nwchem.inp (generated) 047187966.b3lyp_6-31g(d).log.xz 047187966.td-b3lyp_6-31g+(d).inp 047187966.td-b3lyp_6-31g+(d).log.xz

047187966.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187966.td-b3lyp_6-31+g(d).gjf (generated)

047187966.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187966.mol 047187966.PUBCHEM 047187966.mol (via Jmol)
047187974.b3lyp_6-31g(d).inp

047187974.b3lyp_6-31g(d).qchem.inp (generated)

047187974.b3lyp_6-31g(d).gjf (generated)

047187974.b3lyp_6-31g(d).firefly.inp (generated)

047187974.b3lyp_6-31g(d).smash.inp (generated)

047187974.b3lyp_6-31g(d).nwchem.inp (generated) 047187974.b3lyp_6-31g(d).log.xz 047187974.td-b3lyp_6-31g+(d).inp 047187974.td-b3lyp_6-31g+(d).log.xz

047187974.td-b3lyp_6-31+g(d).qchem.inp (generated)

047187974.td-b3lyp_6-31+g(d).gjf (generated)

047187974.td-b3lyp_6-31+g(d).firefly.inp (generated)

047187974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047187974.mol 047187974.PUBCHEM 047187974.mol (via Jmol)
047188025.b3lyp_6-31g(d).inp

047188025.b3lyp_6-31g(d).qchem.inp (generated)

047188025.b3lyp_6-31g(d).gjf (generated)

047188025.b3lyp_6-31g(d).firefly.inp (generated)

047188025.b3lyp_6-31g(d).smash.inp (generated)

047188025.b3lyp_6-31g(d).nwchem.inp (generated) 047188025.b3lyp_6-31g(d).log.xz 047188025.td-b3lyp_6-31g+(d).inp 047188025.td-b3lyp_6-31g+(d).log.xz

047188025.td-b3lyp_6-31+g(d).qchem.inp (generated)

047188025.td-b3lyp_6-31+g(d).gjf (generated)

047188025.td-b3lyp_6-31+g(d).firefly.inp (generated)

047188025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047188025.mol 047188025.PUBCHEM 047188025.mol (via Jmol)
047188058.b3lyp_6-31g(d).inp

047188058.b3lyp_6-31g(d).qchem.inp (generated)

047188058.b3lyp_6-31g(d).gjf (generated)

047188058.b3lyp_6-31g(d).firefly.inp (generated)

047188058.b3lyp_6-31g(d).smash.inp (generated)

047188058.b3lyp_6-31g(d).nwchem.inp (generated) 047188058.b3lyp_6-31g(d).log.xz 047188058.td-b3lyp_6-31g+(d).inp 047188058.td-b3lyp_6-31g+(d).log.xz

047188058.td-b3lyp_6-31+g(d).qchem.inp (generated)

047188058.td-b3lyp_6-31+g(d).gjf (generated)

047188058.td-b3lyp_6-31+g(d).firefly.inp (generated)

047188058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047188058.mol 047188058.PUBCHEM 047188058.mol (via Jmol)
047188065.b3lyp_6-31g(d).inp

047188065.b3lyp_6-31g(d).qchem.inp (generated)

047188065.b3lyp_6-31g(d).gjf (generated)

047188065.b3lyp_6-31g(d).firefly.inp (generated)

047188065.b3lyp_6-31g(d).smash.inp (generated)

047188065.b3lyp_6-31g(d).nwchem.inp (generated) 047188065.b3lyp_6-31g(d).log.xz 047188065.mol 047188065.PUBCHEM 047188065.mol (via Jmol)
047188131.b3lyp_6-31g(d).inp

047188131.b3lyp_6-31g(d).qchem.inp (generated)

047188131.b3lyp_6-31g(d).gjf (generated)

047188131.b3lyp_6-31g(d).firefly.inp (generated)

047188131.b3lyp_6-31g(d).smash.inp (generated)

047188131.b3lyp_6-31g(d).nwchem.inp (generated) 047188131.b3lyp_6-31g(d).log.xz 047188131.td-b3lyp_6-31g+(d).inp 047188131.td-b3lyp_6-31g+(d).log.xz

047188131.td-b3lyp_6-31+g(d).qchem.inp (generated)

047188131.td-b3lyp_6-31+g(d).gjf (generated)

047188131.td-b3lyp_6-31+g(d).firefly.inp (generated)

047188131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047188131.mol 047188131.PUBCHEM 047188131.mol (via Jmol)
047188158.b3lyp_6-31g(d).inp

047188158.b3lyp_6-31g(d).qchem.inp (generated)

047188158.b3lyp_6-31g(d).gjf (generated)

047188158.b3lyp_6-31g(d).firefly.inp (generated)

047188158.b3lyp_6-31g(d).smash.inp (generated)

047188158.b3lyp_6-31g(d).nwchem.inp (generated) 047188158.b3lyp_6-31g(d).log.xz 047188158.td-b3lyp_6-31g+(d).inp 047188158.td-b3lyp_6-31g+(d).log.xz

047188158.td-b3lyp_6-31+g(d).qchem.inp (generated)

047188158.td-b3lyp_6-31+g(d).gjf (generated)

047188158.td-b3lyp_6-31+g(d).firefly.inp (generated)

047188158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047188158.mol 047188158.PUBCHEM 047188158.mol (via Jmol)
047188177.b3lyp_6-31g(d).inp

047188177.b3lyp_6-31g(d).qchem.inp (generated)

047188177.b3lyp_6-31g(d).gjf (generated)

047188177.b3lyp_6-31g(d).firefly.inp (generated)

047188177.b3lyp_6-31g(d).smash.inp (generated)

047188177.b3lyp_6-31g(d).nwchem.inp (generated) 047188177.b3lyp_6-31g(d).log.xz 047188177.mol 047188177.PUBCHEM 047188177.mol (via Jmol)
047188191.b3lyp_6-31g(d).inp

047188191.b3lyp_6-31g(d).qchem.inp (generated)

047188191.b3lyp_6-31g(d).gjf (generated)

047188191.b3lyp_6-31g(d).firefly.inp (generated)

047188191.b3lyp_6-31g(d).smash.inp (generated)

047188191.b3lyp_6-31g(d).nwchem.inp (generated) 047188191.b3lyp_6-31g(d).log.xz 047188191.td-b3lyp_6-31g+(d).inp 047188191.td-b3lyp_6-31g+(d).log.xz

047188191.td-b3lyp_6-31+g(d).qchem.inp (generated)

047188191.td-b3lyp_6-31+g(d).gjf (generated)

047188191.td-b3lyp_6-31+g(d).firefly.inp (generated)

047188191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047188191.mol 047188191.PUBCHEM 047188191.mol (via Jmol)
047188380.b3lyp_6-31g(d).inp

047188380.b3lyp_6-31g(d).qchem.inp (generated)

047188380.b3lyp_6-31g(d).gjf (generated)

047188380.b3lyp_6-31g(d).firefly.inp (generated)

047188380.b3lyp_6-31g(d).smash.inp (generated)

047188380.b3lyp_6-31g(d).nwchem.inp (generated) 047188380.b3lyp_6-31g(d).log.xz 047188380.td-b3lyp_6-31g+(d).inp 047188380.td-b3lyp_6-31g+(d).log.xz

047188380.td-b3lyp_6-31+g(d).qchem.inp (generated)

047188380.td-b3lyp_6-31+g(d).gjf (generated)

047188380.td-b3lyp_6-31+g(d).firefly.inp (generated)

047188380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047188380.mol 047188380.PUBCHEM 047188380.mol (via Jmol)
047189044.b3lyp_6-31g(d).inp

047189044.b3lyp_6-31g(d).qchem.inp (generated)

047189044.b3lyp_6-31g(d).gjf (generated)

047189044.b3lyp_6-31g(d).firefly.inp (generated)

047189044.b3lyp_6-31g(d).smash.inp (generated)

047189044.b3lyp_6-31g(d).nwchem.inp (generated) 047189044.b3lyp_6-31g(d).log.xz 047189044.td-b3lyp_6-31g+(d).inp 047189044.td-b3lyp_6-31g+(d).log.xz

047189044.td-b3lyp_6-31+g(d).qchem.inp (generated)

047189044.td-b3lyp_6-31+g(d).gjf (generated)

047189044.td-b3lyp_6-31+g(d).firefly.inp (generated)

047189044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047189044.mol 047189044.PUBCHEM 047189044.mol (via Jmol)
047189111.b3lyp_6-31g(d).inp

047189111.b3lyp_6-31g(d).qchem.inp (generated)

047189111.b3lyp_6-31g(d).gjf (generated)

047189111.b3lyp_6-31g(d).firefly.inp (generated)

047189111.b3lyp_6-31g(d).smash.inp (generated)

047189111.b3lyp_6-31g(d).nwchem.inp (generated) 047189111.b3lyp_6-31g(d).log.xz 047189111.td-b3lyp_6-31g+(d).inp 047189111.td-b3lyp_6-31g+(d).log.xz

047189111.td-b3lyp_6-31+g(d).qchem.inp (generated)

047189111.td-b3lyp_6-31+g(d).gjf (generated)

047189111.td-b3lyp_6-31+g(d).firefly.inp (generated)

047189111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047189111.mol 047189111.PUBCHEM 047189111.mol (via Jmol)
047189124.b3lyp_6-31g(d).inp

047189124.b3lyp_6-31g(d).qchem.inp (generated)

047189124.b3lyp_6-31g(d).gjf (generated)

047189124.b3lyp_6-31g(d).firefly.inp (generated)

047189124.b3lyp_6-31g(d).smash.inp (generated)

047189124.b3lyp_6-31g(d).nwchem.inp (generated) 047189124.b3lyp_6-31g(d).log.xz 047189124.td-b3lyp_6-31g+(d).inp 047189124.td-b3lyp_6-31g+(d).log.xz

047189124.td-b3lyp_6-31+g(d).qchem.inp (generated)

047189124.td-b3lyp_6-31+g(d).gjf (generated)

047189124.td-b3lyp_6-31+g(d).firefly.inp (generated)

047189124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047189124.mol 047189124.PUBCHEM 047189124.mol (via Jmol)
047189186.b3lyp_6-31g(d).inp

047189186.b3lyp_6-31g(d).qchem.inp (generated)

047189186.b3lyp_6-31g(d).gjf (generated)

047189186.b3lyp_6-31g(d).firefly.inp (generated)

047189186.b3lyp_6-31g(d).smash.inp (generated)

047189186.b3lyp_6-31g(d).nwchem.inp (generated) 047189186.b3lyp_6-31g(d).log.xz 047189186.mol 047189186.PUBCHEM 047189186.mol (via Jmol)
047189192.b3lyp_6-31g(d).inp

047189192.b3lyp_6-31g(d).qchem.inp (generated)

047189192.b3lyp_6-31g(d).gjf (generated)

047189192.b3lyp_6-31g(d).firefly.inp (generated)

047189192.b3lyp_6-31g(d).smash.inp (generated)

047189192.b3lyp_6-31g(d).nwchem.inp (generated) 047189192.b3lyp_6-31g(d).log.xz 047189192.mol 047189192.PUBCHEM 047189192.mol (via Jmol)
047189215.b3lyp_6-31g(d).inp

047189215.b3lyp_6-31g(d).qchem.inp (generated)

047189215.b3lyp_6-31g(d).gjf (generated)

047189215.b3lyp_6-31g(d).firefly.inp (generated)

047189215.b3lyp_6-31g(d).smash.inp (generated)

047189215.b3lyp_6-31g(d).nwchem.inp (generated) 047189215.b3lyp_6-31g(d).log.xz 047189215.td-b3lyp_6-31g+(d).inp 047189215.td-b3lyp_6-31g+(d).log.xz

047189215.td-b3lyp_6-31+g(d).qchem.inp (generated)

047189215.td-b3lyp_6-31+g(d).gjf (generated)

047189215.td-b3lyp_6-31+g(d).firefly.inp (generated)

047189215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047189215.mol 047189215.PUBCHEM 047189215.mol (via Jmol)
047189218.b3lyp_6-31g(d).inp

047189218.b3lyp_6-31g(d).qchem.inp (generated)

047189218.b3lyp_6-31g(d).gjf (generated)

047189218.b3lyp_6-31g(d).firefly.inp (generated)

047189218.b3lyp_6-31g(d).smash.inp (generated)

047189218.b3lyp_6-31g(d).nwchem.inp (generated) 047189218.b3lyp_6-31g(d).log.xz 047189218.mol 047189218.PUBCHEM 047189218.mol (via Jmol)
047189262.b3lyp_6-31g(d).inp

047189262.b3lyp_6-31g(d).qchem.inp (generated)

047189262.b3lyp_6-31g(d).gjf (generated)

047189262.b3lyp_6-31g(d).firefly.inp (generated)

047189262.b3lyp_6-31g(d).smash.inp (generated)

047189262.b3lyp_6-31g(d).nwchem.inp (generated) 047189262.b3lyp_6-31g(d).log.xz 047189262.mol 047189262.PUBCHEM 047189262.mol (via Jmol)
047189267.b3lyp_6-31g(d).inp

047189267.b3lyp_6-31g(d).qchem.inp (generated)

047189267.b3lyp_6-31g(d).gjf (generated)

047189267.b3lyp_6-31g(d).firefly.inp (generated)

047189267.b3lyp_6-31g(d).smash.inp (generated)

047189267.b3lyp_6-31g(d).nwchem.inp (generated) 047189267.b3lyp_6-31g(d).log.xz 047189267.td-b3lyp_6-31g+(d).inp 047189267.td-b3lyp_6-31g+(d).log.xz

047189267.td-b3lyp_6-31+g(d).qchem.inp (generated)

047189267.td-b3lyp_6-31+g(d).gjf (generated)

047189267.td-b3lyp_6-31+g(d).firefly.inp (generated)

047189267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047189267.mol 047189267.PUBCHEM 047189267.mol (via Jmol)
047189349.b3lyp_6-31g(d).inp

047189349.b3lyp_6-31g(d).qchem.inp (generated)

047189349.b3lyp_6-31g(d).gjf (generated)

047189349.b3lyp_6-31g(d).firefly.inp (generated)

047189349.b3lyp_6-31g(d).smash.inp (generated)

047189349.b3lyp_6-31g(d).nwchem.inp (generated) 047189349.b3lyp_6-31g(d).log.xz 047189349.td-b3lyp_6-31g+(d).inp 047189349.td-b3lyp_6-31g+(d).log.xz

047189349.td-b3lyp_6-31+g(d).qchem.inp (generated)

047189349.td-b3lyp_6-31+g(d).gjf (generated)

047189349.td-b3lyp_6-31+g(d).firefly.inp (generated)

047189349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047189349.mol 047189349.PUBCHEM 047189349.mol (via Jmol)
047190379.b3lyp_6-31g(d).inp

047190379.b3lyp_6-31g(d).qchem.inp (generated)

047190379.b3lyp_6-31g(d).gjf (generated)

047190379.b3lyp_6-31g(d).firefly.inp (generated)

047190379.b3lyp_6-31g(d).smash.inp (generated)

047190379.b3lyp_6-31g(d).nwchem.inp (generated) 047190379.b3lyp_6-31g(d).log.xz 047190379.td-b3lyp_6-31g+(d).inp 047190379.td-b3lyp_6-31g+(d).log.xz

047190379.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190379.td-b3lyp_6-31+g(d).gjf (generated)

047190379.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190379.mol 047190379.PUBCHEM 047190379.mol (via Jmol)
047190381.b3lyp_6-31g(d).inp

047190381.b3lyp_6-31g(d).qchem.inp (generated)

047190381.b3lyp_6-31g(d).gjf (generated)

047190381.b3lyp_6-31g(d).firefly.inp (generated)

047190381.b3lyp_6-31g(d).smash.inp (generated)

047190381.b3lyp_6-31g(d).nwchem.inp (generated) 047190381.b3lyp_6-31g(d).log.xz 047190381.td-b3lyp_6-31g+(d).inp 047190381.td-b3lyp_6-31g+(d).log.xz

047190381.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190381.td-b3lyp_6-31+g(d).gjf (generated)

047190381.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190381.mol 047190381.PUBCHEM 047190381.mol (via Jmol)
047190388.b3lyp_6-31g(d).inp

047190388.b3lyp_6-31g(d).qchem.inp (generated)

047190388.b3lyp_6-31g(d).gjf (generated)

047190388.b3lyp_6-31g(d).firefly.inp (generated)

047190388.b3lyp_6-31g(d).smash.inp (generated)

047190388.b3lyp_6-31g(d).nwchem.inp (generated) 047190388.b3lyp_6-31g(d).log.xz 047190388.td-b3lyp_6-31g+(d).inp 047190388.td-b3lyp_6-31g+(d).log.xz

047190388.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190388.td-b3lyp_6-31+g(d).gjf (generated)

047190388.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190388.mol 047190388.PUBCHEM 047190388.mol (via Jmol)
047190402.b3lyp_6-31g(d).inp

047190402.b3lyp_6-31g(d).qchem.inp (generated)

047190402.b3lyp_6-31g(d).gjf (generated)

047190402.b3lyp_6-31g(d).firefly.inp (generated)

047190402.b3lyp_6-31g(d).smash.inp (generated)

047190402.b3lyp_6-31g(d).nwchem.inp (generated) 047190402.b3lyp_6-31g(d).log.xz 047190402.mol 047190402.PUBCHEM 047190402.mol (via Jmol)
047190406.b3lyp_6-31g(d).inp

047190406.b3lyp_6-31g(d).qchem.inp (generated)

047190406.b3lyp_6-31g(d).gjf (generated)

047190406.b3lyp_6-31g(d).firefly.inp (generated)

047190406.b3lyp_6-31g(d).smash.inp (generated)

047190406.b3lyp_6-31g(d).nwchem.inp (generated) 047190406.b3lyp_6-31g(d).log.xz 047190406.td-b3lyp_6-31g+(d).inp 047190406.td-b3lyp_6-31g+(d).log.xz

047190406.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190406.td-b3lyp_6-31+g(d).gjf (generated)

047190406.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190406.mol 047190406.PUBCHEM 047190406.mol (via Jmol)
047190418.b3lyp_6-31g(d).inp

047190418.b3lyp_6-31g(d).qchem.inp (generated)

047190418.b3lyp_6-31g(d).gjf (generated)

047190418.b3lyp_6-31g(d).firefly.inp (generated)

047190418.b3lyp_6-31g(d).smash.inp (generated)

047190418.b3lyp_6-31g(d).nwchem.inp (generated) 047190418.b3lyp_6-31g(d).log.xz 047190418.td-b3lyp_6-31g+(d).inp 047190418.td-b3lyp_6-31g+(d).log.xz

047190418.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190418.td-b3lyp_6-31+g(d).gjf (generated)

047190418.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190418.mol 047190418.PUBCHEM 047190418.mol (via Jmol)
047190421.b3lyp_6-31g(d).inp

047190421.b3lyp_6-31g(d).qchem.inp (generated)

047190421.b3lyp_6-31g(d).gjf (generated)

047190421.b3lyp_6-31g(d).firefly.inp (generated)

047190421.b3lyp_6-31g(d).smash.inp (generated)

047190421.b3lyp_6-31g(d).nwchem.inp (generated) 047190421.b3lyp_6-31g(d).log.xz 047190421.td-b3lyp_6-31g+(d).inp 047190421.td-b3lyp_6-31g+(d).log.xz

047190421.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190421.td-b3lyp_6-31+g(d).gjf (generated)

047190421.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190421.mol 047190421.PUBCHEM 047190421.mol (via Jmol)
047190489.b3lyp_6-31g(d).inp

047190489.b3lyp_6-31g(d).qchem.inp (generated)

047190489.b3lyp_6-31g(d).gjf (generated)

047190489.b3lyp_6-31g(d).firefly.inp (generated)

047190489.b3lyp_6-31g(d).smash.inp (generated)

047190489.b3lyp_6-31g(d).nwchem.inp (generated) 047190489.b3lyp_6-31g(d).log.xz 047190489.td-b3lyp_6-31g+(d).inp 047190489.td-b3lyp_6-31g+(d).log.xz

047190489.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190489.td-b3lyp_6-31+g(d).gjf (generated)

047190489.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190489.mol 047190489.PUBCHEM 047190489.mol (via Jmol)
047190554.b3lyp_6-31g(d).inp

047190554.b3lyp_6-31g(d).qchem.inp (generated)

047190554.b3lyp_6-31g(d).gjf (generated)

047190554.b3lyp_6-31g(d).firefly.inp (generated)

047190554.b3lyp_6-31g(d).smash.inp (generated)

047190554.b3lyp_6-31g(d).nwchem.inp (generated) 047190554.b3lyp_6-31g(d).log.xz 047190554.td-b3lyp_6-31g+(d).inp 047190554.td-b3lyp_6-31g+(d).log.xz

047190554.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190554.td-b3lyp_6-31+g(d).gjf (generated)

047190554.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190554.mol 047190554.PUBCHEM 047190554.mol (via Jmol)
047190558.b3lyp_6-31g(d).inp

047190558.b3lyp_6-31g(d).qchem.inp (generated)

047190558.b3lyp_6-31g(d).gjf (generated)

047190558.b3lyp_6-31g(d).firefly.inp (generated)

047190558.b3lyp_6-31g(d).smash.inp (generated)

047190558.b3lyp_6-31g(d).nwchem.inp (generated) 047190558.b3lyp_6-31g(d).log.xz 047190558.td-b3lyp_6-31g+(d).inp 047190558.td-b3lyp_6-31g+(d).log.xz

047190558.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190558.td-b3lyp_6-31+g(d).gjf (generated)

047190558.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190558.mol 047190558.PUBCHEM 047190558.mol (via Jmol)
047190574.b3lyp_6-31g(d).inp

047190574.b3lyp_6-31g(d).qchem.inp (generated)

047190574.b3lyp_6-31g(d).gjf (generated)

047190574.b3lyp_6-31g(d).firefly.inp (generated)

047190574.b3lyp_6-31g(d).smash.inp (generated)

047190574.b3lyp_6-31g(d).nwchem.inp (generated) 047190574.b3lyp_6-31g(d).log.xz 047190574.td-b3lyp_6-31g+(d).inp 047190574.td-b3lyp_6-31g+(d).log.xz

047190574.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190574.td-b3lyp_6-31+g(d).gjf (generated)

047190574.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190574.mol 047190574.PUBCHEM 047190574.mol (via Jmol)
047190744.b3lyp_6-31g(d).inp

047190744.b3lyp_6-31g(d).qchem.inp (generated)

047190744.b3lyp_6-31g(d).gjf (generated)

047190744.b3lyp_6-31g(d).firefly.inp (generated)

047190744.b3lyp_6-31g(d).smash.inp (generated)

047190744.b3lyp_6-31g(d).nwchem.inp (generated) 047190744.b3lyp_6-31g(d).log.xz 047190744.td-b3lyp_6-31g+(d).inp 047190744.td-b3lyp_6-31g+(d).log.xz

047190744.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190744.td-b3lyp_6-31+g(d).gjf (generated)

047190744.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190744.mol 047190744.PUBCHEM 047190744.mol (via Jmol)
047190760.b3lyp_6-31g(d).inp

047190760.b3lyp_6-31g(d).qchem.inp (generated)

047190760.b3lyp_6-31g(d).gjf (generated)

047190760.b3lyp_6-31g(d).firefly.inp (generated)

047190760.b3lyp_6-31g(d).smash.inp (generated)

047190760.b3lyp_6-31g(d).nwchem.inp (generated) 047190760.b3lyp_6-31g(d).log.xz 047190760.td-b3lyp_6-31g+(d).inp 047190760.td-b3lyp_6-31g+(d).log.xz

047190760.td-b3lyp_6-31+g(d).qchem.inp (generated)

047190760.td-b3lyp_6-31+g(d).gjf (generated)

047190760.td-b3lyp_6-31+g(d).firefly.inp (generated)

047190760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047190760.mol 047190760.PUBCHEM 047190760.mol (via Jmol)
047191011.b3lyp_6-31g(d).inp

047191011.b3lyp_6-31g(d).qchem.inp (generated)

047191011.b3lyp_6-31g(d).gjf (generated)

047191011.b3lyp_6-31g(d).firefly.inp (generated)

047191011.b3lyp_6-31g(d).smash.inp (generated)

047191011.b3lyp_6-31g(d).nwchem.inp (generated) 047191011.b3lyp_6-31g(d).log.xz 047191011.td-b3lyp_6-31g+(d).inp 047191011.td-b3lyp_6-31g+(d).log.xz

047191011.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191011.td-b3lyp_6-31+g(d).gjf (generated)

047191011.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191011.mol 047191011.PUBCHEM 047191011.mol (via Jmol)
047191284.b3lyp_6-31g(d).inp

047191284.b3lyp_6-31g(d).qchem.inp (generated)

047191284.b3lyp_6-31g(d).gjf (generated)

047191284.b3lyp_6-31g(d).firefly.inp (generated)

047191284.b3lyp_6-31g(d).smash.inp (generated)

047191284.b3lyp_6-31g(d).nwchem.inp (generated) 047191284.b3lyp_6-31g(d).log.xz 047191284.td-b3lyp_6-31g+(d).inp 047191284.td-b3lyp_6-31g+(d).log.xz

047191284.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191284.td-b3lyp_6-31+g(d).gjf (generated)

047191284.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191284.mol 047191284.PUBCHEM 047191284.mol (via Jmol)
047191332.b3lyp_6-31g(d).inp

047191332.b3lyp_6-31g(d).qchem.inp (generated)

047191332.b3lyp_6-31g(d).gjf (generated)

047191332.b3lyp_6-31g(d).firefly.inp (generated)

047191332.b3lyp_6-31g(d).smash.inp (generated)

047191332.b3lyp_6-31g(d).nwchem.inp (generated) 047191332.b3lyp_6-31g(d).log.xz 047191332.td-b3lyp_6-31g+(d).inp 047191332.td-b3lyp_6-31g+(d).log.xz

047191332.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191332.td-b3lyp_6-31+g(d).gjf (generated)

047191332.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191332.mol 047191332.PUBCHEM 047191332.mol (via Jmol)
047191336.b3lyp_6-31g(d).inp

047191336.b3lyp_6-31g(d).qchem.inp (generated)

047191336.b3lyp_6-31g(d).gjf (generated)

047191336.b3lyp_6-31g(d).firefly.inp (generated)

047191336.b3lyp_6-31g(d).smash.inp (generated)

047191336.b3lyp_6-31g(d).nwchem.inp (generated) 047191336.b3lyp_6-31g(d).log.xz 047191336.mol 047191336.PUBCHEM 047191336.mol (via Jmol)
047191351.b3lyp_6-31g(d).inp

047191351.b3lyp_6-31g(d).qchem.inp (generated)

047191351.b3lyp_6-31g(d).gjf (generated)

047191351.b3lyp_6-31g(d).firefly.inp (generated)

047191351.b3lyp_6-31g(d).smash.inp (generated)

047191351.b3lyp_6-31g(d).nwchem.inp (generated) 047191351.b3lyp_6-31g(d).log.xz 047191351.td-b3lyp_6-31g+(d).inp 047191351.td-b3lyp_6-31g+(d).log.xz

047191351.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191351.td-b3lyp_6-31+g(d).gjf (generated)

047191351.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191351.mol 047191351.PUBCHEM 047191351.mol (via Jmol)
047191357.b3lyp_6-31g(d).inp

047191357.b3lyp_6-31g(d).qchem.inp (generated)

047191357.b3lyp_6-31g(d).gjf (generated)

047191357.b3lyp_6-31g(d).firefly.inp (generated)

047191357.b3lyp_6-31g(d).smash.inp (generated)

047191357.b3lyp_6-31g(d).nwchem.inp (generated) 047191357.b3lyp_6-31g(d).log.xz 047191357.td-b3lyp_6-31g+(d).inp 047191357.td-b3lyp_6-31g+(d).log.xz

047191357.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191357.td-b3lyp_6-31+g(d).gjf (generated)

047191357.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191357.mol 047191357.PUBCHEM 047191357.mol (via Jmol)
047191360.b3lyp_6-31g(d).inp

047191360.b3lyp_6-31g(d).qchem.inp (generated)

047191360.b3lyp_6-31g(d).gjf (generated)

047191360.b3lyp_6-31g(d).firefly.inp (generated)

047191360.b3lyp_6-31g(d).smash.inp (generated)

047191360.b3lyp_6-31g(d).nwchem.inp (generated) 047191360.b3lyp_6-31g(d).log.xz 047191360.td-b3lyp_6-31g+(d).inp 047191360.td-b3lyp_6-31g+(d).log.xz

047191360.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191360.td-b3lyp_6-31+g(d).gjf (generated)

047191360.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191360.mol 047191360.PUBCHEM 047191360.mol (via Jmol)
047191512.b3lyp_6-31g(d).inp

047191512.b3lyp_6-31g(d).qchem.inp (generated)

047191512.b3lyp_6-31g(d).gjf (generated)

047191512.b3lyp_6-31g(d).firefly.inp (generated)

047191512.b3lyp_6-31g(d).smash.inp (generated)

047191512.b3lyp_6-31g(d).nwchem.inp (generated) 047191512.b3lyp_6-31g(d).log.xz 047191512.td-b3lyp_6-31g+(d).inp 047191512.td-b3lyp_6-31g+(d).log.xz

047191512.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191512.td-b3lyp_6-31+g(d).gjf (generated)

047191512.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191512.mol 047191512.PUBCHEM 047191512.mol (via Jmol)
047191642.b3lyp_6-31g(d).inp

047191642.b3lyp_6-31g(d).qchem.inp (generated)

047191642.b3lyp_6-31g(d).gjf (generated)

047191642.b3lyp_6-31g(d).firefly.inp (generated)

047191642.b3lyp_6-31g(d).smash.inp (generated)

047191642.b3lyp_6-31g(d).nwchem.inp (generated) 047191642.b3lyp_6-31g(d).log.xz 047191642.td-b3lyp_6-31g+(d).inp 047191642.td-b3lyp_6-31g+(d).log.xz

047191642.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191642.td-b3lyp_6-31+g(d).gjf (generated)

047191642.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191642.mol 047191642.PUBCHEM 047191642.mol (via Jmol)
047191718.b3lyp_6-31g(d).inp

047191718.b3lyp_6-31g(d).qchem.inp (generated)

047191718.b3lyp_6-31g(d).gjf (generated)

047191718.b3lyp_6-31g(d).firefly.inp (generated)

047191718.b3lyp_6-31g(d).smash.inp (generated)

047191718.b3lyp_6-31g(d).nwchem.inp (generated) 047191718.b3lyp_6-31g(d).log.xz 047191718.td-b3lyp_6-31g+(d).inp 047191718.td-b3lyp_6-31g+(d).log.xz

047191718.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191718.td-b3lyp_6-31+g(d).gjf (generated)

047191718.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191718.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191718.mol 047191718.PUBCHEM 047191718.mol (via Jmol)
047191775.b3lyp_6-31g(d).inp

047191775.b3lyp_6-31g(d).qchem.inp (generated)

047191775.b3lyp_6-31g(d).gjf (generated)

047191775.b3lyp_6-31g(d).firefly.inp (generated)

047191775.b3lyp_6-31g(d).smash.inp (generated)

047191775.b3lyp_6-31g(d).nwchem.inp (generated) 047191775.b3lyp_6-31g(d).log.xz 047191775.td-b3lyp_6-31g+(d).inp 047191775.td-b3lyp_6-31g+(d).log.xz

047191775.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191775.td-b3lyp_6-31+g(d).gjf (generated)

047191775.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191775.mol 047191775.PUBCHEM 047191775.mol (via Jmol)
047191788.b3lyp_6-31g(d).inp

047191788.b3lyp_6-31g(d).qchem.inp (generated)

047191788.b3lyp_6-31g(d).gjf (generated)

047191788.b3lyp_6-31g(d).firefly.inp (generated)

047191788.b3lyp_6-31g(d).smash.inp (generated)

047191788.b3lyp_6-31g(d).nwchem.inp (generated) 047191788.b3lyp_6-31g(d).log.xz 047191788.td-b3lyp_6-31g+(d).inp 047191788.td-b3lyp_6-31g+(d).log.xz

047191788.td-b3lyp_6-31+g(d).qchem.inp (generated)

047191788.td-b3lyp_6-31+g(d).gjf (generated)

047191788.td-b3lyp_6-31+g(d).firefly.inp (generated)

047191788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047191788.mol 047191788.PUBCHEM 047191788.mol (via Jmol)
047192170.b3lyp_6-31g(d).inp

047192170.b3lyp_6-31g(d).qchem.inp (generated)

047192170.b3lyp_6-31g(d).gjf (generated)

047192170.b3lyp_6-31g(d).firefly.inp (generated)

047192170.b3lyp_6-31g(d).smash.inp (generated)

047192170.b3lyp_6-31g(d).nwchem.inp (generated) 047192170.b3lyp_6-31g(d).log.xz 047192170.td-b3lyp_6-31g+(d).inp 047192170.td-b3lyp_6-31g+(d).log.xz

047192170.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192170.td-b3lyp_6-31+g(d).gjf (generated)

047192170.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192170.mol 047192170.PUBCHEM 047192170.mol (via Jmol)
047192173.b3lyp_6-31g(d).inp

047192173.b3lyp_6-31g(d).qchem.inp (generated)

047192173.b3lyp_6-31g(d).gjf (generated)

047192173.b3lyp_6-31g(d).firefly.inp (generated)

047192173.b3lyp_6-31g(d).smash.inp (generated)

047192173.b3lyp_6-31g(d).nwchem.inp (generated) 047192173.b3lyp_6-31g(d).log.xz 047192173.mol 047192173.PUBCHEM 047192173.mol (via Jmol)
047192192.b3lyp_6-31g(d).inp

047192192.b3lyp_6-31g(d).qchem.inp (generated)

047192192.b3lyp_6-31g(d).gjf (generated)

047192192.b3lyp_6-31g(d).firefly.inp (generated)

047192192.b3lyp_6-31g(d).smash.inp (generated)

047192192.b3lyp_6-31g(d).nwchem.inp (generated) 047192192.b3lyp_6-31g(d).log.xz 047192192.td-b3lyp_6-31g+(d).inp 047192192.td-b3lyp_6-31g+(d).log.xz

047192192.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192192.td-b3lyp_6-31+g(d).gjf (generated)

047192192.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192192.mol 047192192.PUBCHEM 047192192.mol (via Jmol)
047192203.b3lyp_6-31g(d).inp

047192203.b3lyp_6-31g(d).qchem.inp (generated)

047192203.b3lyp_6-31g(d).gjf (generated)

047192203.b3lyp_6-31g(d).firefly.inp (generated)

047192203.b3lyp_6-31g(d).smash.inp (generated)

047192203.b3lyp_6-31g(d).nwchem.inp (generated) 047192203.b3lyp_6-31g(d).log.xz 047192203.td-b3lyp_6-31g+(d).inp 047192203.td-b3lyp_6-31g+(d).log.xz

047192203.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192203.td-b3lyp_6-31+g(d).gjf (generated)

047192203.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192203.mol 047192203.PUBCHEM 047192203.mol (via Jmol)
047192494.b3lyp_6-31g(d).inp

047192494.b3lyp_6-31g(d).qchem.inp (generated)

047192494.b3lyp_6-31g(d).gjf (generated)

047192494.b3lyp_6-31g(d).firefly.inp (generated)

047192494.b3lyp_6-31g(d).smash.inp (generated)

047192494.b3lyp_6-31g(d).nwchem.inp (generated) 047192494.b3lyp_6-31g(d).log.xz 047192494.td-b3lyp_6-31g+(d).inp 047192494.td-b3lyp_6-31g+(d).log.xz

047192494.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192494.td-b3lyp_6-31+g(d).gjf (generated)

047192494.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192494.mol 047192494.PUBCHEM 047192494.mol (via Jmol)
047192506.b3lyp_6-31g(d).inp

047192506.b3lyp_6-31g(d).qchem.inp (generated)

047192506.b3lyp_6-31g(d).gjf (generated)

047192506.b3lyp_6-31g(d).firefly.inp (generated)

047192506.b3lyp_6-31g(d).smash.inp (generated)

047192506.b3lyp_6-31g(d).nwchem.inp (generated) 047192506.b3lyp_6-31g(d).log.xz 047192506.td-b3lyp_6-31g+(d).inp 047192506.td-b3lyp_6-31g+(d).log.xz

047192506.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192506.td-b3lyp_6-31+g(d).gjf (generated)

047192506.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192506.mol 047192506.PUBCHEM 047192506.mol (via Jmol)
047192507.b3lyp_6-31g(d).inp

047192507.b3lyp_6-31g(d).qchem.inp (generated)

047192507.b3lyp_6-31g(d).gjf (generated)

047192507.b3lyp_6-31g(d).firefly.inp (generated)

047192507.b3lyp_6-31g(d).smash.inp (generated)

047192507.b3lyp_6-31g(d).nwchem.inp (generated) 047192507.b3lyp_6-31g(d).log.xz 047192507.td-b3lyp_6-31g+(d).inp 047192507.td-b3lyp_6-31g+(d).log.xz

047192507.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192507.td-b3lyp_6-31+g(d).gjf (generated)

047192507.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192507.mol 047192507.PUBCHEM 047192507.mol (via Jmol)
047192527.b3lyp_6-31g(d).inp

047192527.b3lyp_6-31g(d).qchem.inp (generated)

047192527.b3lyp_6-31g(d).gjf (generated)

047192527.b3lyp_6-31g(d).firefly.inp (generated)

047192527.b3lyp_6-31g(d).smash.inp (generated)

047192527.b3lyp_6-31g(d).nwchem.inp (generated) 047192527.b3lyp_6-31g(d).log.xz 047192527.mol 047192527.PUBCHEM 047192527.mol (via Jmol)
047192552.b3lyp_6-31g(d).inp

047192552.b3lyp_6-31g(d).qchem.inp (generated)

047192552.b3lyp_6-31g(d).gjf (generated)

047192552.b3lyp_6-31g(d).firefly.inp (generated)

047192552.b3lyp_6-31g(d).smash.inp (generated)

047192552.b3lyp_6-31g(d).nwchem.inp (generated) 047192552.b3lyp_6-31g(d).log.xz 047192552.td-b3lyp_6-31g+(d).inp 047192552.td-b3lyp_6-31g+(d).log.xz

047192552.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192552.td-b3lyp_6-31+g(d).gjf (generated)

047192552.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192552.mol 047192552.PUBCHEM 047192552.mol (via Jmol)
047192594.b3lyp_6-31g(d).inp

047192594.b3lyp_6-31g(d).qchem.inp (generated)

047192594.b3lyp_6-31g(d).gjf (generated)

047192594.b3lyp_6-31g(d).firefly.inp (generated)

047192594.b3lyp_6-31g(d).smash.inp (generated)

047192594.b3lyp_6-31g(d).nwchem.inp (generated) 047192594.b3lyp_6-31g(d).log.xz 047192594.td-b3lyp_6-31g+(d).inp 047192594.td-b3lyp_6-31g+(d).log.xz

047192594.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192594.td-b3lyp_6-31+g(d).gjf (generated)

047192594.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192594.mol 047192594.PUBCHEM 047192594.mol (via Jmol)
047192636.b3lyp_6-31g(d).inp

047192636.b3lyp_6-31g(d).qchem.inp (generated)

047192636.b3lyp_6-31g(d).gjf (generated)

047192636.b3lyp_6-31g(d).firefly.inp (generated)

047192636.b3lyp_6-31g(d).smash.inp (generated)

047192636.b3lyp_6-31g(d).nwchem.inp (generated) 047192636.b3lyp_6-31g(d).log.xz 047192636.mol 047192636.PUBCHEM 047192636.mol (via Jmol)
047192659.b3lyp_6-31g(d).inp

047192659.b3lyp_6-31g(d).qchem.inp (generated)

047192659.b3lyp_6-31g(d).gjf (generated)

047192659.b3lyp_6-31g(d).firefly.inp (generated)

047192659.b3lyp_6-31g(d).smash.inp (generated)

047192659.b3lyp_6-31g(d).nwchem.inp (generated) 047192659.b3lyp_6-31g(d).log.xz 047192659.td-b3lyp_6-31g+(d).inp 047192659.td-b3lyp_6-31g+(d).log.xz

047192659.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192659.td-b3lyp_6-31+g(d).gjf (generated)

047192659.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192659.mol 047192659.PUBCHEM 047192659.mol (via Jmol)
047192737.b3lyp_6-31g(d).inp

047192737.b3lyp_6-31g(d).qchem.inp (generated)

047192737.b3lyp_6-31g(d).gjf (generated)

047192737.b3lyp_6-31g(d).firefly.inp (generated)

047192737.b3lyp_6-31g(d).smash.inp (generated)

047192737.b3lyp_6-31g(d).nwchem.inp (generated) 047192737.b3lyp_6-31g(d).log.xz 047192737.td-b3lyp_6-31g+(d).inp 047192737.td-b3lyp_6-31g+(d).log.xz

047192737.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192737.td-b3lyp_6-31+g(d).gjf (generated)

047192737.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192737.mol 047192737.PUBCHEM 047192737.mol (via Jmol)
047192744.b3lyp_6-31g(d).inp

047192744.b3lyp_6-31g(d).qchem.inp (generated)

047192744.b3lyp_6-31g(d).gjf (generated)

047192744.b3lyp_6-31g(d).firefly.inp (generated)

047192744.b3lyp_6-31g(d).smash.inp (generated)

047192744.b3lyp_6-31g(d).nwchem.inp (generated) 047192744.b3lyp_6-31g(d).log.xz 047192744.mol 047192744.PUBCHEM 047192744.mol (via Jmol)
047192748.b3lyp_6-31g(d).inp

047192748.b3lyp_6-31g(d).qchem.inp (generated)

047192748.b3lyp_6-31g(d).gjf (generated)

047192748.b3lyp_6-31g(d).firefly.inp (generated)

047192748.b3lyp_6-31g(d).smash.inp (generated)

047192748.b3lyp_6-31g(d).nwchem.inp (generated) 047192748.b3lyp_6-31g(d).log.xz 047192748.td-b3lyp_6-31g+(d).inp 047192748.td-b3lyp_6-31g+(d).log.xz

047192748.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192748.td-b3lyp_6-31+g(d).gjf (generated)

047192748.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192748.mol 047192748.PUBCHEM 047192748.mol (via Jmol)
047192801.b3lyp_6-31g(d).inp

047192801.b3lyp_6-31g(d).qchem.inp (generated)

047192801.b3lyp_6-31g(d).gjf (generated)

047192801.b3lyp_6-31g(d).firefly.inp (generated)

047192801.b3lyp_6-31g(d).smash.inp (generated)

047192801.b3lyp_6-31g(d).nwchem.inp (generated) 047192801.b3lyp_6-31g(d).log.xz 047192801.td-b3lyp_6-31g+(d).inp 047192801.td-b3lyp_6-31g+(d).log.xz

047192801.td-b3lyp_6-31+g(d).qchem.inp (generated)

047192801.td-b3lyp_6-31+g(d).gjf (generated)

047192801.td-b3lyp_6-31+g(d).firefly.inp (generated)

047192801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047192801.mol 047192801.PUBCHEM 047192801.mol (via Jmol)
047193021.b3lyp_6-31g(d).inp

047193021.b3lyp_6-31g(d).qchem.inp (generated)

047193021.b3lyp_6-31g(d).gjf (generated)

047193021.b3lyp_6-31g(d).firefly.inp (generated)

047193021.b3lyp_6-31g(d).smash.inp (generated)

047193021.b3lyp_6-31g(d).nwchem.inp (generated) 047193021.b3lyp_6-31g(d).log.xz 047193021.td-b3lyp_6-31g+(d).inp 047193021.td-b3lyp_6-31g+(d).log.xz

047193021.td-b3lyp_6-31+g(d).qchem.inp (generated)

047193021.td-b3lyp_6-31+g(d).gjf (generated)

047193021.td-b3lyp_6-31+g(d).firefly.inp (generated)

047193021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047193021.mol 047193021.PUBCHEM 047193021.mol (via Jmol)
047193103.b3lyp_6-31g(d).inp

047193103.b3lyp_6-31g(d).qchem.inp (generated)

047193103.b3lyp_6-31g(d).gjf (generated)

047193103.b3lyp_6-31g(d).firefly.inp (generated)

047193103.b3lyp_6-31g(d).smash.inp (generated)

047193103.b3lyp_6-31g(d).nwchem.inp (generated) 047193103.b3lyp_6-31g(d).log.xz 047193103.mol 047193103.PUBCHEM 047193103.mol (via Jmol)
047193141.b3lyp_6-31g(d).inp

047193141.b3lyp_6-31g(d).qchem.inp (generated)

047193141.b3lyp_6-31g(d).gjf (generated)

047193141.b3lyp_6-31g(d).firefly.inp (generated)

047193141.b3lyp_6-31g(d).smash.inp (generated)

047193141.b3lyp_6-31g(d).nwchem.inp (generated) 047193141.b3lyp_6-31g(d).log.xz 047193141.td-b3lyp_6-31g+(d).inp 047193141.td-b3lyp_6-31g+(d).log.xz

047193141.td-b3lyp_6-31+g(d).qchem.inp (generated)

047193141.td-b3lyp_6-31+g(d).gjf (generated)

047193141.td-b3lyp_6-31+g(d).firefly.inp (generated)

047193141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047193141.mol 047193141.PUBCHEM 047193141.mol (via Jmol)
047193244.b3lyp_6-31g(d).inp

047193244.b3lyp_6-31g(d).qchem.inp (generated)

047193244.b3lyp_6-31g(d).gjf (generated)

047193244.b3lyp_6-31g(d).firefly.inp (generated)

047193244.b3lyp_6-31g(d).smash.inp (generated)

047193244.b3lyp_6-31g(d).nwchem.inp (generated) 047193244.b3lyp_6-31g(d).log.xz 047193244.td-b3lyp_6-31g+(d).inp 047193244.td-b3lyp_6-31g+(d).log.xz

047193244.td-b3lyp_6-31+g(d).qchem.inp (generated)

047193244.td-b3lyp_6-31+g(d).gjf (generated)

047193244.td-b3lyp_6-31+g(d).firefly.inp (generated)

047193244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047193244.mol 047193244.PUBCHEM 047193244.mol (via Jmol)
047193575.b3lyp_6-31g(d).inp

047193575.b3lyp_6-31g(d).qchem.inp (generated)

047193575.b3lyp_6-31g(d).gjf (generated)

047193575.b3lyp_6-31g(d).firefly.inp (generated)

047193575.b3lyp_6-31g(d).smash.inp (generated)

047193575.b3lyp_6-31g(d).nwchem.inp (generated) 047193575.b3lyp_6-31g(d).log.xz 047193575.td-b3lyp_6-31g+(d).inp 047193575.td-b3lyp_6-31g+(d).log.xz

047193575.td-b3lyp_6-31+g(d).qchem.inp (generated)

047193575.td-b3lyp_6-31+g(d).gjf (generated)

047193575.td-b3lyp_6-31+g(d).firefly.inp (generated)

047193575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047193575.mol 047193575.PUBCHEM 047193575.mol (via Jmol)
047193672.b3lyp_6-31g(d).inp

047193672.b3lyp_6-31g(d).qchem.inp (generated)

047193672.b3lyp_6-31g(d).gjf (generated)

047193672.b3lyp_6-31g(d).firefly.inp (generated)

047193672.b3lyp_6-31g(d).smash.inp (generated)

047193672.b3lyp_6-31g(d).nwchem.inp (generated) 047193672.b3lyp_6-31g(d).log.xz 047193672.mol 047193672.PUBCHEM 047193672.mol (via Jmol)
047193830.b3lyp_6-31g(d).inp

047193830.b3lyp_6-31g(d).qchem.inp (generated)

047193830.b3lyp_6-31g(d).gjf (generated)

047193830.b3lyp_6-31g(d).firefly.inp (generated)

047193830.b3lyp_6-31g(d).smash.inp (generated)

047193830.b3lyp_6-31g(d).nwchem.inp (generated) 047193830.b3lyp_6-31g(d).log.xz 047193830.td-b3lyp_6-31g+(d).inp 047193830.td-b3lyp_6-31g+(d).log.xz

047193830.td-b3lyp_6-31+g(d).qchem.inp (generated)

047193830.td-b3lyp_6-31+g(d).gjf (generated)

047193830.td-b3lyp_6-31+g(d).firefly.inp (generated)

047193830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047193830.mol 047193830.PUBCHEM 047193830.mol (via Jmol)
047193832.b3lyp_6-31g(d).inp

047193832.b3lyp_6-31g(d).qchem.inp (generated)

047193832.b3lyp_6-31g(d).gjf (generated)

047193832.b3lyp_6-31g(d).firefly.inp (generated)

047193832.b3lyp_6-31g(d).smash.inp (generated)

047193832.b3lyp_6-31g(d).nwchem.inp (generated) 047193832.b3lyp_6-31g(d).log.xz 047193832.mol 047193832.PUBCHEM 047193832.mol (via Jmol)
047193865.b3lyp_6-31g(d).inp

047193865.b3lyp_6-31g(d).qchem.inp (generated)

047193865.b3lyp_6-31g(d).gjf (generated)

047193865.b3lyp_6-31g(d).firefly.inp (generated)

047193865.b3lyp_6-31g(d).smash.inp (generated)

047193865.b3lyp_6-31g(d).nwchem.inp (generated) 047193865.b3lyp_6-31g(d).log.xz 047193865.td-b3lyp_6-31g+(d).inp 047193865.td-b3lyp_6-31g+(d).log.xz

047193865.td-b3lyp_6-31+g(d).qchem.inp (generated)

047193865.td-b3lyp_6-31+g(d).gjf (generated)

047193865.td-b3lyp_6-31+g(d).firefly.inp (generated)

047193865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047193865.mol 047193865.PUBCHEM 047193865.mol (via Jmol)
047194548.b3lyp_6-31g(d).inp

047194548.b3lyp_6-31g(d).qchem.inp (generated)

047194548.b3lyp_6-31g(d).gjf (generated)

047194548.b3lyp_6-31g(d).firefly.inp (generated)

047194548.b3lyp_6-31g(d).smash.inp (generated)

047194548.b3lyp_6-31g(d).nwchem.inp (generated) 047194548.b3lyp_6-31g(d).log.xz 047194548.td-b3lyp_6-31g+(d).inp 047194548.td-b3lyp_6-31g+(d).log.xz

047194548.td-b3lyp_6-31+g(d).qchem.inp (generated)

047194548.td-b3lyp_6-31+g(d).gjf (generated)

047194548.td-b3lyp_6-31+g(d).firefly.inp (generated)

047194548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047194548.mol 047194548.PUBCHEM 047194548.mol (via Jmol)
047194550.b3lyp_6-31g(d).inp

047194550.b3lyp_6-31g(d).qchem.inp (generated)

047194550.b3lyp_6-31g(d).gjf (generated)

047194550.b3lyp_6-31g(d).firefly.inp (generated)

047194550.b3lyp_6-31g(d).smash.inp (generated)

047194550.b3lyp_6-31g(d).nwchem.inp (generated) 047194550.b3lyp_6-31g(d).log.xz 047194550.td-b3lyp_6-31g+(d).inp 047194550.td-b3lyp_6-31g+(d).log.xz

047194550.td-b3lyp_6-31+g(d).qchem.inp (generated)

047194550.td-b3lyp_6-31+g(d).gjf (generated)

047194550.td-b3lyp_6-31+g(d).firefly.inp (generated)

047194550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047194550.mol 047194550.PUBCHEM 047194550.mol (via Jmol)
047194752.b3lyp_6-31g(d).inp

047194752.b3lyp_6-31g(d).qchem.inp (generated)

047194752.b3lyp_6-31g(d).gjf (generated)

047194752.b3lyp_6-31g(d).firefly.inp (generated)

047194752.b3lyp_6-31g(d).smash.inp (generated)

047194752.b3lyp_6-31g(d).nwchem.inp (generated) 047194752.b3lyp_6-31g(d).log.xz 047194752.td-b3lyp_6-31g+(d).inp 047194752.td-b3lyp_6-31g+(d).log.xz

047194752.td-b3lyp_6-31+g(d).qchem.inp (generated)

047194752.td-b3lyp_6-31+g(d).gjf (generated)

047194752.td-b3lyp_6-31+g(d).firefly.inp (generated)

047194752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047194752.mol 047194752.PUBCHEM 047194752.mol (via Jmol)
047194755.b3lyp_6-31g(d).inp

047194755.b3lyp_6-31g(d).qchem.inp (generated)

047194755.b3lyp_6-31g(d).gjf (generated)

047194755.b3lyp_6-31g(d).firefly.inp (generated)

047194755.b3lyp_6-31g(d).smash.inp (generated)

047194755.b3lyp_6-31g(d).nwchem.inp (generated) 047194755.b3lyp_6-31g(d).log.xz 047194755.mol 047194755.PUBCHEM 047194755.mol (via Jmol)
047194955.b3lyp_6-31g(d).inp

047194955.b3lyp_6-31g(d).qchem.inp (generated)

047194955.b3lyp_6-31g(d).gjf (generated)

047194955.b3lyp_6-31g(d).firefly.inp (generated)

047194955.b3lyp_6-31g(d).smash.inp (generated)

047194955.b3lyp_6-31g(d).nwchem.inp (generated) 047194955.b3lyp_6-31g(d).log.xz 047194955.td-b3lyp_6-31g+(d).inp 047194955.td-b3lyp_6-31g+(d).log.xz

047194955.td-b3lyp_6-31+g(d).qchem.inp (generated)

047194955.td-b3lyp_6-31+g(d).gjf (generated)

047194955.td-b3lyp_6-31+g(d).firefly.inp (generated)

047194955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047194955.mol 047194955.PUBCHEM 047194955.mol (via Jmol)
047194981.b3lyp_6-31g(d).inp

047194981.b3lyp_6-31g(d).qchem.inp (generated)

047194981.b3lyp_6-31g(d).gjf (generated)

047194981.b3lyp_6-31g(d).firefly.inp (generated)

047194981.b3lyp_6-31g(d).smash.inp (generated)

047194981.b3lyp_6-31g(d).nwchem.inp (generated) 047194981.b3lyp_6-31g(d).log.xz 047194981.mol 047194981.PUBCHEM 047194981.mol (via Jmol)
047195129.b3lyp_6-31g(d).inp

047195129.b3lyp_6-31g(d).qchem.inp (generated)

047195129.b3lyp_6-31g(d).gjf (generated)

047195129.b3lyp_6-31g(d).firefly.inp (generated)

047195129.b3lyp_6-31g(d).smash.inp (generated)

047195129.b3lyp_6-31g(d).nwchem.inp (generated) 047195129.b3lyp_6-31g(d).log.xz 047195129.td-b3lyp_6-31g+(d).inp 047195129.td-b3lyp_6-31g+(d).log.xz

047195129.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195129.td-b3lyp_6-31+g(d).gjf (generated)

047195129.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195129.mol 047195129.PUBCHEM 047195129.mol (via Jmol)
047195285.b3lyp_6-31g(d).inp

047195285.b3lyp_6-31g(d).qchem.inp (generated)

047195285.b3lyp_6-31g(d).gjf (generated)

047195285.b3lyp_6-31g(d).firefly.inp (generated)

047195285.b3lyp_6-31g(d).smash.inp (generated)

047195285.b3lyp_6-31g(d).nwchem.inp (generated) 047195285.b3lyp_6-31g(d).log.xz 047195285.td-b3lyp_6-31g+(d).inp 047195285.td-b3lyp_6-31g+(d).log.xz

047195285.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195285.td-b3lyp_6-31+g(d).gjf (generated)

047195285.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195285.mol 047195285.PUBCHEM 047195285.mol (via Jmol)
047195504.b3lyp_6-31g(d).inp

047195504.b3lyp_6-31g(d).qchem.inp (generated)

047195504.b3lyp_6-31g(d).gjf (generated)

047195504.b3lyp_6-31g(d).firefly.inp (generated)

047195504.b3lyp_6-31g(d).smash.inp (generated)

047195504.b3lyp_6-31g(d).nwchem.inp (generated) 047195504.b3lyp_6-31g(d).log.xz 047195504.td-b3lyp_6-31g+(d).inp 047195504.td-b3lyp_6-31g+(d).log.xz

047195504.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195504.td-b3lyp_6-31+g(d).gjf (generated)

047195504.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195504.mol 047195504.PUBCHEM 047195504.mol (via Jmol)
047195624.b3lyp_6-31g(d).inp

047195624.b3lyp_6-31g(d).qchem.inp (generated)

047195624.b3lyp_6-31g(d).gjf (generated)

047195624.b3lyp_6-31g(d).firefly.inp (generated)

047195624.b3lyp_6-31g(d).smash.inp (generated)

047195624.b3lyp_6-31g(d).nwchem.inp (generated) 047195624.b3lyp_6-31g(d).log.xz 047195624.td-b3lyp_6-31g+(d).inp 047195624.td-b3lyp_6-31g+(d).log.xz

047195624.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195624.td-b3lyp_6-31+g(d).gjf (generated)

047195624.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195624.mol 047195624.PUBCHEM 047195624.mol (via Jmol)
047195690.b3lyp_6-31g(d).inp

047195690.b3lyp_6-31g(d).qchem.inp (generated)

047195690.b3lyp_6-31g(d).gjf (generated)

047195690.b3lyp_6-31g(d).firefly.inp (generated)

047195690.b3lyp_6-31g(d).smash.inp (generated)

047195690.b3lyp_6-31g(d).nwchem.inp (generated) 047195690.b3lyp_6-31g(d).log.xz 047195690.td-b3lyp_6-31g+(d).inp 047195690.td-b3lyp_6-31g+(d).log.xz

047195690.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195690.td-b3lyp_6-31+g(d).gjf (generated)

047195690.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195690.mol 047195690.PUBCHEM 047195690.mol (via Jmol)
047195691.b3lyp_6-31g(d).inp

047195691.b3lyp_6-31g(d).qchem.inp (generated)

047195691.b3lyp_6-31g(d).gjf (generated)

047195691.b3lyp_6-31g(d).firefly.inp (generated)

047195691.b3lyp_6-31g(d).smash.inp (generated)

047195691.b3lyp_6-31g(d).nwchem.inp (generated) 047195691.b3lyp_6-31g(d).log.xz 047195691.td-b3lyp_6-31g+(d).inp 047195691.td-b3lyp_6-31g+(d).log.xz

047195691.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195691.td-b3lyp_6-31+g(d).gjf (generated)

047195691.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195691.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195691.mol 047195691.PUBCHEM 047195691.mol (via Jmol)
047195696.b3lyp_6-31g(d).inp

047195696.b3lyp_6-31g(d).qchem.inp (generated)

047195696.b3lyp_6-31g(d).gjf (generated)

047195696.b3lyp_6-31g(d).firefly.inp (generated)

047195696.b3lyp_6-31g(d).smash.inp (generated)

047195696.b3lyp_6-31g(d).nwchem.inp (generated) 047195696.b3lyp_6-31g(d).log.xz 047195696.td-b3lyp_6-31g+(d).inp 047195696.td-b3lyp_6-31g+(d).log.xz

047195696.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195696.td-b3lyp_6-31+g(d).gjf (generated)

047195696.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195696.mol 047195696.PUBCHEM 047195696.mol (via Jmol)
047195802.b3lyp_6-31g(d).inp

047195802.b3lyp_6-31g(d).qchem.inp (generated)

047195802.b3lyp_6-31g(d).gjf (generated)

047195802.b3lyp_6-31g(d).firefly.inp (generated)

047195802.b3lyp_6-31g(d).smash.inp (generated)

047195802.b3lyp_6-31g(d).nwchem.inp (generated) 047195802.b3lyp_6-31g(d).log.xz 047195802.td-b3lyp_6-31g+(d).inp 047195802.td-b3lyp_6-31g+(d).log.xz

047195802.td-b3lyp_6-31+g(d).qchem.inp (generated)

047195802.td-b3lyp_6-31+g(d).gjf (generated)

047195802.td-b3lyp_6-31+g(d).firefly.inp (generated)

047195802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047195802.mol 047195802.PUBCHEM 047195802.mol (via Jmol)
047196290.b3lyp_6-31g(d).inp

047196290.b3lyp_6-31g(d).qchem.inp (generated)

047196290.b3lyp_6-31g(d).gjf (generated)

047196290.b3lyp_6-31g(d).firefly.inp (generated)

047196290.b3lyp_6-31g(d).smash.inp (generated)

047196290.b3lyp_6-31g(d).nwchem.inp (generated) 047196290.b3lyp_6-31g(d).log.xz 047196290.td-b3lyp_6-31g+(d).inp 047196290.td-b3lyp_6-31g+(d).log.xz

047196290.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196290.td-b3lyp_6-31+g(d).gjf (generated)

047196290.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196290.mol 047196290.PUBCHEM 047196290.mol (via Jmol)
047196291.b3lyp_6-31g(d).inp

047196291.b3lyp_6-31g(d).qchem.inp (generated)

047196291.b3lyp_6-31g(d).gjf (generated)

047196291.b3lyp_6-31g(d).firefly.inp (generated)

047196291.b3lyp_6-31g(d).smash.inp (generated)

047196291.b3lyp_6-31g(d).nwchem.inp (generated) 047196291.b3lyp_6-31g(d).log.xz 047196291.td-b3lyp_6-31g+(d).inp 047196291.td-b3lyp_6-31g+(d).log.xz

047196291.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196291.td-b3lyp_6-31+g(d).gjf (generated)

047196291.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196291.mol 047196291.PUBCHEM 047196291.mol (via Jmol)
047196366.b3lyp_6-31g(d).inp

047196366.b3lyp_6-31g(d).qchem.inp (generated)

047196366.b3lyp_6-31g(d).gjf (generated)

047196366.b3lyp_6-31g(d).firefly.inp (generated)

047196366.b3lyp_6-31g(d).smash.inp (generated)

047196366.b3lyp_6-31g(d).nwchem.inp (generated) 047196366.b3lyp_6-31g(d).log.xz 047196366.td-b3lyp_6-31g+(d).inp 047196366.td-b3lyp_6-31g+(d).log.xz

047196366.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196366.td-b3lyp_6-31+g(d).gjf (generated)

047196366.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196366.mol 047196366.PUBCHEM 047196366.mol (via Jmol)
047196369.b3lyp_6-31g(d).inp

047196369.b3lyp_6-31g(d).qchem.inp (generated)

047196369.b3lyp_6-31g(d).gjf (generated)

047196369.b3lyp_6-31g(d).firefly.inp (generated)

047196369.b3lyp_6-31g(d).smash.inp (generated)

047196369.b3lyp_6-31g(d).nwchem.inp (generated) 047196369.b3lyp_6-31g(d).log.xz 047196369.td-b3lyp_6-31g+(d).inp 047196369.td-b3lyp_6-31g+(d).log.xz

047196369.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196369.td-b3lyp_6-31+g(d).gjf (generated)

047196369.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196369.mol 047196369.PUBCHEM 047196369.mol (via Jmol)
047196434.b3lyp_6-31g(d).inp

047196434.b3lyp_6-31g(d).qchem.inp (generated)

047196434.b3lyp_6-31g(d).gjf (generated)

047196434.b3lyp_6-31g(d).firefly.inp (generated)

047196434.b3lyp_6-31g(d).smash.inp (generated)

047196434.b3lyp_6-31g(d).nwchem.inp (generated) 047196434.b3lyp_6-31g(d).log.xz 047196434.td-b3lyp_6-31g+(d).inp 047196434.td-b3lyp_6-31g+(d).log.xz

047196434.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196434.td-b3lyp_6-31+g(d).gjf (generated)

047196434.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196434.mol 047196434.PUBCHEM 047196434.mol (via Jmol)
047196474.b3lyp_6-31g(d).inp

047196474.b3lyp_6-31g(d).qchem.inp (generated)

047196474.b3lyp_6-31g(d).gjf (generated)

047196474.b3lyp_6-31g(d).firefly.inp (generated)

047196474.b3lyp_6-31g(d).smash.inp (generated)

047196474.b3lyp_6-31g(d).nwchem.inp (generated) 047196474.b3lyp_6-31g(d).log.xz 047196474.td-b3lyp_6-31g+(d).inp 047196474.td-b3lyp_6-31g+(d).log.xz

047196474.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196474.td-b3lyp_6-31+g(d).gjf (generated)

047196474.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196474.mol 047196474.PUBCHEM 047196474.mol (via Jmol)
047196476.b3lyp_6-31g(d).inp

047196476.b3lyp_6-31g(d).qchem.inp (generated)

047196476.b3lyp_6-31g(d).gjf (generated)

047196476.b3lyp_6-31g(d).firefly.inp (generated)

047196476.b3lyp_6-31g(d).smash.inp (generated)

047196476.b3lyp_6-31g(d).nwchem.inp (generated) 047196476.b3lyp_6-31g(d).log.xz 047196476.mol 047196476.PUBCHEM 047196476.mol (via Jmol)
047196589.b3lyp_6-31g(d).inp

047196589.b3lyp_6-31g(d).qchem.inp (generated)

047196589.b3lyp_6-31g(d).gjf (generated)

047196589.b3lyp_6-31g(d).firefly.inp (generated)

047196589.b3lyp_6-31g(d).smash.inp (generated)

047196589.b3lyp_6-31g(d).nwchem.inp (generated) 047196589.b3lyp_6-31g(d).log.xz 047196589.td-b3lyp_6-31g+(d).inp 047196589.td-b3lyp_6-31g+(d).log.xz

047196589.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196589.td-b3lyp_6-31+g(d).gjf (generated)

047196589.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196589.mol 047196589.PUBCHEM 047196589.mol (via Jmol)
047196903.b3lyp_6-31g(d).inp

047196903.b3lyp_6-31g(d).qchem.inp (generated)

047196903.b3lyp_6-31g(d).gjf (generated)

047196903.b3lyp_6-31g(d).firefly.inp (generated)

047196903.b3lyp_6-31g(d).smash.inp (generated)

047196903.b3lyp_6-31g(d).nwchem.inp (generated) 047196903.b3lyp_6-31g(d).log.xz 047196903.td-b3lyp_6-31g+(d).inp 047196903.td-b3lyp_6-31g+(d).log.xz

047196903.td-b3lyp_6-31+g(d).qchem.inp (generated)

047196903.td-b3lyp_6-31+g(d).gjf (generated)

047196903.td-b3lyp_6-31+g(d).firefly.inp (generated)

047196903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047196903.mol 047196903.PUBCHEM 047196903.mol (via Jmol)
047197219.b3lyp_6-31g(d).inp

047197219.b3lyp_6-31g(d).qchem.inp (generated)

047197219.b3lyp_6-31g(d).gjf (generated)

047197219.b3lyp_6-31g(d).firefly.inp (generated)

047197219.b3lyp_6-31g(d).smash.inp (generated)

047197219.b3lyp_6-31g(d).nwchem.inp (generated) 047197219.b3lyp_6-31g(d).log.xz 047197219.td-b3lyp_6-31g+(d).inp 047197219.td-b3lyp_6-31g+(d).log.xz

047197219.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197219.td-b3lyp_6-31+g(d).gjf (generated)

047197219.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197219.mol 047197219.PUBCHEM 047197219.mol (via Jmol)
047197229.b3lyp_6-31g(d).inp

047197229.b3lyp_6-31g(d).qchem.inp (generated)

047197229.b3lyp_6-31g(d).gjf (generated)

047197229.b3lyp_6-31g(d).firefly.inp (generated)

047197229.b3lyp_6-31g(d).smash.inp (generated)

047197229.b3lyp_6-31g(d).nwchem.inp (generated) 047197229.b3lyp_6-31g(d).log.xz 047197229.td-b3lyp_6-31g+(d).inp 047197229.td-b3lyp_6-31g+(d).log.xz

047197229.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197229.td-b3lyp_6-31+g(d).gjf (generated)

047197229.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197229.mol 047197229.PUBCHEM 047197229.mol (via Jmol)
047197237.b3lyp_6-31g(d).inp

047197237.b3lyp_6-31g(d).qchem.inp (generated)

047197237.b3lyp_6-31g(d).gjf (generated)

047197237.b3lyp_6-31g(d).firefly.inp (generated)

047197237.b3lyp_6-31g(d).smash.inp (generated)

047197237.b3lyp_6-31g(d).nwchem.inp (generated) 047197237.b3lyp_6-31g(d).log.xz 047197237.td-b3lyp_6-31g+(d).inp 047197237.td-b3lyp_6-31g+(d).log.xz

047197237.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197237.td-b3lyp_6-31+g(d).gjf (generated)

047197237.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197237.mol 047197237.PUBCHEM 047197237.mol (via Jmol)
047197238.b3lyp_6-31g(d).inp

047197238.b3lyp_6-31g(d).qchem.inp (generated)

047197238.b3lyp_6-31g(d).gjf (generated)

047197238.b3lyp_6-31g(d).firefly.inp (generated)

047197238.b3lyp_6-31g(d).smash.inp (generated)

047197238.b3lyp_6-31g(d).nwchem.inp (generated) 047197238.b3lyp_6-31g(d).log.xz 047197238.td-b3lyp_6-31g+(d).inp 047197238.td-b3lyp_6-31g+(d).log.xz

047197238.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197238.td-b3lyp_6-31+g(d).gjf (generated)

047197238.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197238.mol 047197238.PUBCHEM 047197238.mol (via Jmol)
047197239.b3lyp_6-31g(d).inp

047197239.b3lyp_6-31g(d).qchem.inp (generated)

047197239.b3lyp_6-31g(d).gjf (generated)

047197239.b3lyp_6-31g(d).firefly.inp (generated)

047197239.b3lyp_6-31g(d).smash.inp (generated)

047197239.b3lyp_6-31g(d).nwchem.inp (generated) 047197239.b3lyp_6-31g(d).log.xz 047197239.td-b3lyp_6-31g+(d).inp 047197239.td-b3lyp_6-31g+(d).log.xz

047197239.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197239.td-b3lyp_6-31+g(d).gjf (generated)

047197239.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197239.mol 047197239.PUBCHEM 047197239.mol (via Jmol)
047197240.b3lyp_6-31g(d).inp

047197240.b3lyp_6-31g(d).qchem.inp (generated)

047197240.b3lyp_6-31g(d).gjf (generated)

047197240.b3lyp_6-31g(d).firefly.inp (generated)

047197240.b3lyp_6-31g(d).smash.inp (generated)

047197240.b3lyp_6-31g(d).nwchem.inp (generated) 047197240.b3lyp_6-31g(d).log.xz 047197240.td-b3lyp_6-31g+(d).inp 047197240.td-b3lyp_6-31g+(d).log.xz

047197240.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197240.td-b3lyp_6-31+g(d).gjf (generated)

047197240.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197240.mol 047197240.PUBCHEM 047197240.mol (via Jmol)
047197473.b3lyp_6-31g(d).inp

047197473.b3lyp_6-31g(d).qchem.inp (generated)

047197473.b3lyp_6-31g(d).gjf (generated)

047197473.b3lyp_6-31g(d).firefly.inp (generated)

047197473.b3lyp_6-31g(d).smash.inp (generated)

047197473.b3lyp_6-31g(d).nwchem.inp (generated) 047197473.b3lyp_6-31g(d).log.xz 047197473.td-b3lyp_6-31g+(d).inp 047197473.td-b3lyp_6-31g+(d).log.xz

047197473.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197473.td-b3lyp_6-31+g(d).gjf (generated)

047197473.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197473.mol 047197473.PUBCHEM 047197473.mol (via Jmol)
047197474.b3lyp_6-31g(d).inp

047197474.b3lyp_6-31g(d).qchem.inp (generated)

047197474.b3lyp_6-31g(d).gjf (generated)

047197474.b3lyp_6-31g(d).firefly.inp (generated)

047197474.b3lyp_6-31g(d).smash.inp (generated)

047197474.b3lyp_6-31g(d).nwchem.inp (generated) 047197474.b3lyp_6-31g(d).log.xz 047197474.td-b3lyp_6-31g+(d).inp 047197474.td-b3lyp_6-31g+(d).log.xz

047197474.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197474.td-b3lyp_6-31+g(d).gjf (generated)

047197474.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197474.mol 047197474.PUBCHEM 047197474.mol (via Jmol)
047197759.b3lyp_6-31g(d).inp

047197759.b3lyp_6-31g(d).qchem.inp (generated)

047197759.b3lyp_6-31g(d).gjf (generated)

047197759.b3lyp_6-31g(d).firefly.inp (generated)

047197759.b3lyp_6-31g(d).smash.inp (generated)

047197759.b3lyp_6-31g(d).nwchem.inp (generated) 047197759.b3lyp_6-31g(d).log.xz 047197759.td-b3lyp_6-31g+(d).inp 047197759.td-b3lyp_6-31g+(d).log.xz

047197759.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197759.td-b3lyp_6-31+g(d).gjf (generated)

047197759.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197759.mol 047197759.PUBCHEM 047197759.mol (via Jmol)
047197778.b3lyp_6-31g(d).inp

047197778.b3lyp_6-31g(d).qchem.inp (generated)

047197778.b3lyp_6-31g(d).gjf (generated)

047197778.b3lyp_6-31g(d).firefly.inp (generated)

047197778.b3lyp_6-31g(d).smash.inp (generated)

047197778.b3lyp_6-31g(d).nwchem.inp (generated) 047197778.b3lyp_6-31g(d).log.xz 047197778.td-b3lyp_6-31g+(d).inp 047197778.td-b3lyp_6-31g+(d).log.xz

047197778.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197778.td-b3lyp_6-31+g(d).gjf (generated)

047197778.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197778.mol 047197778.PUBCHEM 047197778.mol (via Jmol)
047197780.b3lyp_6-31g(d).inp

047197780.b3lyp_6-31g(d).qchem.inp (generated)

047197780.b3lyp_6-31g(d).gjf (generated)

047197780.b3lyp_6-31g(d).firefly.inp (generated)

047197780.b3lyp_6-31g(d).smash.inp (generated)

047197780.b3lyp_6-31g(d).nwchem.inp (generated) 047197780.b3lyp_6-31g(d).log.xz 047197780.td-b3lyp_6-31g+(d).inp 047197780.td-b3lyp_6-31g+(d).log.xz

047197780.td-b3lyp_6-31+g(d).qchem.inp (generated)

047197780.td-b3lyp_6-31+g(d).gjf (generated)

047197780.td-b3lyp_6-31+g(d).firefly.inp (generated)

047197780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047197780.mol 047197780.PUBCHEM 047197780.mol (via Jmol)
047198102.b3lyp_6-31g(d).inp

047198102.b3lyp_6-31g(d).qchem.inp (generated)

047198102.b3lyp_6-31g(d).gjf (generated)

047198102.b3lyp_6-31g(d).firefly.inp (generated)

047198102.b3lyp_6-31g(d).smash.inp (generated)

047198102.b3lyp_6-31g(d).nwchem.inp (generated) 047198102.b3lyp_6-31g(d).log.xz 047198102.td-b3lyp_6-31g+(d).inp 047198102.td-b3lyp_6-31g+(d).log.xz

047198102.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198102.td-b3lyp_6-31+g(d).gjf (generated)

047198102.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198102.mol 047198102.PUBCHEM 047198102.mol (via Jmol)
047198130.b3lyp_6-31g(d).inp

047198130.b3lyp_6-31g(d).qchem.inp (generated)

047198130.b3lyp_6-31g(d).gjf (generated)

047198130.b3lyp_6-31g(d).firefly.inp (generated)

047198130.b3lyp_6-31g(d).smash.inp (generated)

047198130.b3lyp_6-31g(d).nwchem.inp (generated) 047198130.b3lyp_6-31g(d).log.xz 047198130.td-b3lyp_6-31g+(d).inp 047198130.td-b3lyp_6-31g+(d).log.xz

047198130.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198130.td-b3lyp_6-31+g(d).gjf (generated)

047198130.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198130.mol 047198130.PUBCHEM 047198130.mol (via Jmol)
047198139.b3lyp_6-31g(d).inp

047198139.b3lyp_6-31g(d).qchem.inp (generated)

047198139.b3lyp_6-31g(d).gjf (generated)

047198139.b3lyp_6-31g(d).firefly.inp (generated)

047198139.b3lyp_6-31g(d).smash.inp (generated)

047198139.b3lyp_6-31g(d).nwchem.inp (generated) 047198139.b3lyp_6-31g(d).log.xz 047198139.td-b3lyp_6-31g+(d).inp 047198139.td-b3lyp_6-31g+(d).log.xz

047198139.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198139.td-b3lyp_6-31+g(d).gjf (generated)

047198139.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198139.mol 047198139.PUBCHEM 047198139.mol (via Jmol)
047198263.b3lyp_6-31g(d).inp

047198263.b3lyp_6-31g(d).qchem.inp (generated)

047198263.b3lyp_6-31g(d).gjf (generated)

047198263.b3lyp_6-31g(d).firefly.inp (generated)

047198263.b3lyp_6-31g(d).smash.inp (generated)

047198263.b3lyp_6-31g(d).nwchem.inp (generated) 047198263.b3lyp_6-31g(d).log.xz 047198263.td-b3lyp_6-31g+(d).inp 047198263.td-b3lyp_6-31g+(d).log.xz

047198263.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198263.td-b3lyp_6-31+g(d).gjf (generated)

047198263.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198263.mol 047198263.PUBCHEM 047198263.mol (via Jmol)
047198265.b3lyp_6-31g(d).inp

047198265.b3lyp_6-31g(d).qchem.inp (generated)

047198265.b3lyp_6-31g(d).gjf (generated)

047198265.b3lyp_6-31g(d).firefly.inp (generated)

047198265.b3lyp_6-31g(d).smash.inp (generated)

047198265.b3lyp_6-31g(d).nwchem.inp (generated) 047198265.b3lyp_6-31g(d).log.xz 047198265.td-b3lyp_6-31g+(d).inp 047198265.td-b3lyp_6-31g+(d).log.xz

047198265.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198265.td-b3lyp_6-31+g(d).gjf (generated)

047198265.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198265.mol 047198265.PUBCHEM 047198265.mol (via Jmol)
047198275.b3lyp_6-31g(d).inp

047198275.b3lyp_6-31g(d).qchem.inp (generated)

047198275.b3lyp_6-31g(d).gjf (generated)

047198275.b3lyp_6-31g(d).firefly.inp (generated)

047198275.b3lyp_6-31g(d).smash.inp (generated)

047198275.b3lyp_6-31g(d).nwchem.inp (generated) 047198275.b3lyp_6-31g(d).log.xz 047198275.mol 047198275.PUBCHEM 047198275.mol (via Jmol)
047198284.b3lyp_6-31g(d).inp

047198284.b3lyp_6-31g(d).qchem.inp (generated)

047198284.b3lyp_6-31g(d).gjf (generated)

047198284.b3lyp_6-31g(d).firefly.inp (generated)

047198284.b3lyp_6-31g(d).smash.inp (generated)

047198284.b3lyp_6-31g(d).nwchem.inp (generated) 047198284.b3lyp_6-31g(d).log.xz 047198284.td-b3lyp_6-31g+(d).inp 047198284.td-b3lyp_6-31g+(d).log.xz

047198284.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198284.td-b3lyp_6-31+g(d).gjf (generated)

047198284.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198284.mol 047198284.PUBCHEM 047198284.mol (via Jmol)
047198287.b3lyp_6-31g(d).inp

047198287.b3lyp_6-31g(d).qchem.inp (generated)

047198287.b3lyp_6-31g(d).gjf (generated)

047198287.b3lyp_6-31g(d).firefly.inp (generated)

047198287.b3lyp_6-31g(d).smash.inp (generated)

047198287.b3lyp_6-31g(d).nwchem.inp (generated) 047198287.b3lyp_6-31g(d).log.xz 047198287.td-b3lyp_6-31g+(d).inp 047198287.td-b3lyp_6-31g+(d).log.xz

047198287.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198287.td-b3lyp_6-31+g(d).gjf (generated)

047198287.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198287.mol 047198287.PUBCHEM 047198287.mol (via Jmol)
047198288.b3lyp_6-31g(d).inp

047198288.b3lyp_6-31g(d).qchem.inp (generated)

047198288.b3lyp_6-31g(d).gjf (generated)

047198288.b3lyp_6-31g(d).firefly.inp (generated)

047198288.b3lyp_6-31g(d).smash.inp (generated)

047198288.b3lyp_6-31g(d).nwchem.inp (generated) 047198288.b3lyp_6-31g(d).log.xz 047198288.mol 047198288.PUBCHEM 047198288.mol (via Jmol)
047198298.b3lyp_6-31g(d).inp

047198298.b3lyp_6-31g(d).qchem.inp (generated)

047198298.b3lyp_6-31g(d).gjf (generated)

047198298.b3lyp_6-31g(d).firefly.inp (generated)

047198298.b3lyp_6-31g(d).smash.inp (generated)

047198298.b3lyp_6-31g(d).nwchem.inp (generated) 047198298.b3lyp_6-31g(d).log.xz 047198298.mol 047198298.PUBCHEM 047198298.mol (via Jmol)
047198307.b3lyp_6-31g(d).inp

047198307.b3lyp_6-31g(d).qchem.inp (generated)

047198307.b3lyp_6-31g(d).gjf (generated)

047198307.b3lyp_6-31g(d).firefly.inp (generated)

047198307.b3lyp_6-31g(d).smash.inp (generated)

047198307.b3lyp_6-31g(d).nwchem.inp (generated) 047198307.b3lyp_6-31g(d).log.xz 047198307.mol 047198307.PUBCHEM 047198307.mol (via Jmol)
047198316.b3lyp_6-31g(d).inp

047198316.b3lyp_6-31g(d).qchem.inp (generated)

047198316.b3lyp_6-31g(d).gjf (generated)

047198316.b3lyp_6-31g(d).firefly.inp (generated)

047198316.b3lyp_6-31g(d).smash.inp (generated)

047198316.b3lyp_6-31g(d).nwchem.inp (generated) 047198316.b3lyp_6-31g(d).log.xz 047198316.td-b3lyp_6-31g+(d).inp 047198316.td-b3lyp_6-31g+(d).log.xz

047198316.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198316.td-b3lyp_6-31+g(d).gjf (generated)

047198316.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198316.mol 047198316.PUBCHEM 047198316.mol (via Jmol)
047198495.b3lyp_6-31g(d).inp

047198495.b3lyp_6-31g(d).qchem.inp (generated)

047198495.b3lyp_6-31g(d).gjf (generated)

047198495.b3lyp_6-31g(d).firefly.inp (generated)

047198495.b3lyp_6-31g(d).smash.inp (generated)

047198495.b3lyp_6-31g(d).nwchem.inp (generated) 047198495.b3lyp_6-31g(d).log.xz 047198495.td-b3lyp_6-31g+(d).inp 047198495.td-b3lyp_6-31g+(d).log.xz

047198495.td-b3lyp_6-31+g(d).qchem.inp (generated)

047198495.td-b3lyp_6-31+g(d).gjf (generated)

047198495.td-b3lyp_6-31+g(d).firefly.inp (generated)

047198495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047198495.mol 047198495.PUBCHEM 047198495.mol (via Jmol)
047198660.b3lyp_6-31g(d).inp

047198660.b3lyp_6-31g(d).qchem.inp (generated)

047198660.b3lyp_6-31g(d).gjf (generated)

047198660.b3lyp_6-31g(d).firefly.inp (generated)

047198660.b3lyp_6-31g(d).smash.inp (generated)

047198660.b3lyp_6-31g(d).nwchem.inp (generated) 047198660.b3lyp_6-31g(d).log.xz 047198660.mol 047198660.PUBCHEM 047198660.mol (via Jmol)
047199602.b3lyp_6-31g(d).inp

047199602.b3lyp_6-31g(d).qchem.inp (generated)

047199602.b3lyp_6-31g(d).gjf (generated)

047199602.b3lyp_6-31g(d).firefly.inp (generated)

047199602.b3lyp_6-31g(d).smash.inp (generated)

047199602.b3lyp_6-31g(d).nwchem.inp (generated) 047199602.b3lyp_6-31g(d).log.xz 047199602.td-b3lyp_6-31g+(d).inp 047199602.td-b3lyp_6-31g+(d).log.xz

047199602.td-b3lyp_6-31+g(d).qchem.inp (generated)

047199602.td-b3lyp_6-31+g(d).gjf (generated)

047199602.td-b3lyp_6-31+g(d).firefly.inp (generated)

047199602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047199602.mol 047199602.PUBCHEM 047199602.mol (via Jmol)


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