Index of

Last updated : Thu May 25 01:35:26 JST 2017
Total : 59 (50) in this page
037950415.b3lyp_6-31g(d).inp

037950415.b3lyp_6-31g(d).qchem.inp (generated)

037950415.b3lyp_6-31g(d).gjf (generated)

037950415.b3lyp_6-31g(d).firefly.inp (generated)

037950415.b3lyp_6-31g(d).smash.inp (generated)

037950415.b3lyp_6-31g(d).nwchem.inp (generated) 037950415.b3lyp_6-31g(d).log.xz 037950415.mol 037950415.PUBCHEM 037950415.mol (via Jmol)
037950592.b3lyp_6-31g(d).inp

037950592.b3lyp_6-31g(d).qchem.inp (generated)

037950592.b3lyp_6-31g(d).gjf (generated)

037950592.b3lyp_6-31g(d).firefly.inp (generated)

037950592.b3lyp_6-31g(d).smash.inp (generated)

037950592.b3lyp_6-31g(d).nwchem.inp (generated) 037950592.b3lyp_6-31g(d).log.xz 037950592.mol 037950592.PUBCHEM 037950592.mol (via Jmol)
037951157.b3lyp_6-31g(d).inp

037951157.b3lyp_6-31g(d).qchem.inp (generated)

037951157.b3lyp_6-31g(d).gjf (generated)

037951157.b3lyp_6-31g(d).firefly.inp (generated)

037951157.b3lyp_6-31g(d).smash.inp (generated)

037951157.b3lyp_6-31g(d).nwchem.inp (generated) 037951157.b3lyp_6-31g(d).log.xz 037951157.td-b3lyp_6-31g+(d).inp 037951157.td-b3lyp_6-31g+(d).log.xz

037951157.td-b3lyp_6-31+g(d).qchem.inp (generated)

037951157.td-b3lyp_6-31+g(d).gjf (generated)

037951157.td-b3lyp_6-31+g(d).firefly.inp (generated)

037951157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037951157.mol 037951157.PUBCHEM 037951157.mol (via Jmol)
037952220.b3lyp_6-31g(d).inp

037952220.b3lyp_6-31g(d).qchem.inp (generated)

037952220.b3lyp_6-31g(d).gjf (generated)

037952220.b3lyp_6-31g(d).firefly.inp (generated)

037952220.b3lyp_6-31g(d).smash.inp (generated)

037952220.b3lyp_6-31g(d).nwchem.inp (generated) 037952220.b3lyp_6-31g(d).log.xz 037952220.td-b3lyp_6-31g+(d).inp 037952220.td-b3lyp_6-31g+(d).log.xz

037952220.td-b3lyp_6-31+g(d).qchem.inp (generated)

037952220.td-b3lyp_6-31+g(d).gjf (generated)

037952220.td-b3lyp_6-31+g(d).firefly.inp (generated)

037952220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037952220.mol 037952220.PUBCHEM 037952220.mol (via Jmol)
037952232.b3lyp_6-31g(d).inp

037952232.b3lyp_6-31g(d).qchem.inp (generated)

037952232.b3lyp_6-31g(d).gjf (generated)

037952232.b3lyp_6-31g(d).firefly.inp (generated)

037952232.b3lyp_6-31g(d).smash.inp (generated)

037952232.b3lyp_6-31g(d).nwchem.inp (generated) 037952232.b3lyp_6-31g(d).log.xz 037952232.td-b3lyp_6-31g+(d).inp 037952232.td-b3lyp_6-31g+(d).log.xz

037952232.td-b3lyp_6-31+g(d).qchem.inp (generated)

037952232.td-b3lyp_6-31+g(d).gjf (generated)

037952232.td-b3lyp_6-31+g(d).firefly.inp (generated)

037952232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037952232.mol 037952232.PUBCHEM 037952232.mol (via Jmol)
037954449.b3lyp_6-31g(d).inp

037954449.b3lyp_6-31g(d).qchem.inp (generated)

037954449.b3lyp_6-31g(d).gjf (generated)

037954449.b3lyp_6-31g(d).firefly.inp (generated)

037954449.b3lyp_6-31g(d).smash.inp (generated)

037954449.b3lyp_6-31g(d).nwchem.inp (generated) 037954449.b3lyp_6-31g(d).log.xz 037954449.td-b3lyp_6-31g+(d).inp 037954449.td-b3lyp_6-31g+(d).log.xz

037954449.td-b3lyp_6-31+g(d).qchem.inp (generated)

037954449.td-b3lyp_6-31+g(d).gjf (generated)

037954449.td-b3lyp_6-31+g(d).firefly.inp (generated)

037954449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037954449.mol 037954449.PUBCHEM 037954449.mol (via Jmol)
037956229.b3lyp_6-31g(d).inp

037956229.b3lyp_6-31g(d).qchem.inp (generated)

037956229.b3lyp_6-31g(d).gjf (generated)

037956229.b3lyp_6-31g(d).firefly.inp (generated)

037956229.b3lyp_6-31g(d).smash.inp (generated)

037956229.b3lyp_6-31g(d).nwchem.inp (generated) 037956229.b3lyp_6-31g(d).log.xz 037956229.td-b3lyp_6-31g+(d).inp 037956229.td-b3lyp_6-31g+(d).log.xz

037956229.td-b3lyp_6-31+g(d).qchem.inp (generated)

037956229.td-b3lyp_6-31+g(d).gjf (generated)

037956229.td-b3lyp_6-31+g(d).firefly.inp (generated)

037956229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037956229.mol 037956229.PUBCHEM 037956229.mol (via Jmol)
037958327.b3lyp_6-31g(d).inp

037958327.b3lyp_6-31g(d).qchem.inp (generated)

037958327.b3lyp_6-31g(d).gjf (generated)

037958327.b3lyp_6-31g(d).firefly.inp (generated)

037958327.b3lyp_6-31g(d).smash.inp (generated)

037958327.b3lyp_6-31g(d).nwchem.inp (generated) 037958327.b3lyp_6-31g(d).log.xz 037958327.td-b3lyp_6-31g+(d).inp 037958327.td-b3lyp_6-31g+(d).log.xz

037958327.td-b3lyp_6-31+g(d).qchem.inp (generated)

037958327.td-b3lyp_6-31+g(d).gjf (generated)

037958327.td-b3lyp_6-31+g(d).firefly.inp (generated)

037958327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037958327.mol 037958327.PUBCHEM 037958327.mol (via Jmol)
037958330.b3lyp_6-31g(d).inp

037958330.b3lyp_6-31g(d).qchem.inp (generated)

037958330.b3lyp_6-31g(d).gjf (generated)

037958330.b3lyp_6-31g(d).firefly.inp (generated)

037958330.b3lyp_6-31g(d).smash.inp (generated)

037958330.b3lyp_6-31g(d).nwchem.inp (generated) 037958330.b3lyp_6-31g(d).log.xz 037958330.td-b3lyp_6-31g+(d).inp 037958330.td-b3lyp_6-31g+(d).log.xz

037958330.td-b3lyp_6-31+g(d).qchem.inp (generated)

037958330.td-b3lyp_6-31+g(d).gjf (generated)

037958330.td-b3lyp_6-31+g(d).firefly.inp (generated)

037958330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037958330.mol 037958330.PUBCHEM 037958330.mol (via Jmol)
037963803.b3lyp_6-31g(d).inp

037963803.b3lyp_6-31g(d).qchem.inp (generated)

037963803.b3lyp_6-31g(d).gjf (generated)

037963803.b3lyp_6-31g(d).firefly.inp (generated)

037963803.b3lyp_6-31g(d).smash.inp (generated)

037963803.b3lyp_6-31g(d).nwchem.inp (generated) 037963803.b3lyp_6-31g(d).log.xz 037963803.td-b3lyp_6-31g+(d).inp 037963803.td-b3lyp_6-31g+(d).log.xz

037963803.td-b3lyp_6-31+g(d).qchem.inp (generated)

037963803.td-b3lyp_6-31+g(d).gjf (generated)

037963803.td-b3lyp_6-31+g(d).firefly.inp (generated)

037963803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037963803.mol 037963803.PUBCHEM 037963803.mol (via Jmol)
037966977.b3lyp_6-31g(d).inp

037966977.b3lyp_6-31g(d).qchem.inp (generated)

037966977.b3lyp_6-31g(d).gjf (generated)

037966977.b3lyp_6-31g(d).firefly.inp (generated)

037966977.b3lyp_6-31g(d).smash.inp (generated)

037966977.b3lyp_6-31g(d).nwchem.inp (generated) 037966977.b3lyp_6-31g(d).log.xz 037966977.td-b3lyp_6-31g+(d).inp 037966977.td-b3lyp_6-31g+(d).log.xz

037966977.td-b3lyp_6-31+g(d).qchem.inp (generated)

037966977.td-b3lyp_6-31+g(d).gjf (generated)

037966977.td-b3lyp_6-31+g(d).firefly.inp (generated)

037966977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037966977.mol 037966977.PUBCHEM 037966977.mol (via Jmol)
037966978.b3lyp_6-31g(d).inp

037966978.b3lyp_6-31g(d).qchem.inp (generated)

037966978.b3lyp_6-31g(d).gjf (generated)

037966978.b3lyp_6-31g(d).firefly.inp (generated)

037966978.b3lyp_6-31g(d).smash.inp (generated)

037966978.b3lyp_6-31g(d).nwchem.inp (generated) 037966978.b3lyp_6-31g(d).log.xz 037966978.td-b3lyp_6-31g+(d).inp 037966978.td-b3lyp_6-31g+(d).log.xz

037966978.td-b3lyp_6-31+g(d).qchem.inp (generated)

037966978.td-b3lyp_6-31+g(d).gjf (generated)

037966978.td-b3lyp_6-31+g(d).firefly.inp (generated)

037966978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037966978.mol 037966978.PUBCHEM 037966978.mol (via Jmol)
037966979.b3lyp_6-31g(d).inp

037966979.b3lyp_6-31g(d).qchem.inp (generated)

037966979.b3lyp_6-31g(d).gjf (generated)

037966979.b3lyp_6-31g(d).firefly.inp (generated)

037966979.b3lyp_6-31g(d).smash.inp (generated)

037966979.b3lyp_6-31g(d).nwchem.inp (generated) 037966979.b3lyp_6-31g(d).log.xz 037966979.td-b3lyp_6-31g+(d).inp 037966979.td-b3lyp_6-31g+(d).log.xz

037966979.td-b3lyp_6-31+g(d).qchem.inp (generated)

037966979.td-b3lyp_6-31+g(d).gjf (generated)

037966979.td-b3lyp_6-31+g(d).firefly.inp (generated)

037966979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037966979.mol 037966979.PUBCHEM 037966979.mol (via Jmol)
037966989.b3lyp_6-31g(d).inp

037966989.b3lyp_6-31g(d).qchem.inp (generated)

037966989.b3lyp_6-31g(d).gjf (generated)

037966989.b3lyp_6-31g(d).firefly.inp (generated)

037966989.b3lyp_6-31g(d).smash.inp (generated)

037966989.b3lyp_6-31g(d).nwchem.inp (generated) 037966989.b3lyp_6-31g(d).log.xz 037966989.td-b3lyp_6-31g+(d).inp 037966989.td-b3lyp_6-31g+(d).log.xz

037966989.td-b3lyp_6-31+g(d).qchem.inp (generated)

037966989.td-b3lyp_6-31+g(d).gjf (generated)

037966989.td-b3lyp_6-31+g(d).firefly.inp (generated)

037966989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037966989.mol 037966989.PUBCHEM 037966989.mol (via Jmol)
037966990.b3lyp_6-31g(d).inp

037966990.b3lyp_6-31g(d).qchem.inp (generated)

037966990.b3lyp_6-31g(d).gjf (generated)

037966990.b3lyp_6-31g(d).firefly.inp (generated)

037966990.b3lyp_6-31g(d).smash.inp (generated)

037966990.b3lyp_6-31g(d).nwchem.inp (generated) 037966990.b3lyp_6-31g(d).log.xz 037966990.td-b3lyp_6-31g+(d).inp 037966990.td-b3lyp_6-31g+(d).log.xz

037966990.td-b3lyp_6-31+g(d).qchem.inp (generated)

037966990.td-b3lyp_6-31+g(d).gjf (generated)

037966990.td-b3lyp_6-31+g(d).firefly.inp (generated)

037966990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037966990.mol 037966990.PUBCHEM 037966990.mol (via Jmol)
037967023.b3lyp_6-31g(d).inp

037967023.b3lyp_6-31g(d).qchem.inp (generated)

037967023.b3lyp_6-31g(d).gjf (generated)

037967023.b3lyp_6-31g(d).firefly.inp (generated)

037967023.b3lyp_6-31g(d).smash.inp (generated)

037967023.b3lyp_6-31g(d).nwchem.inp (generated) 037967023.b3lyp_6-31g(d).log.xz 037967023.td-b3lyp_6-31g+(d).inp 037967023.td-b3lyp_6-31g+(d).log.xz

037967023.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967023.td-b3lyp_6-31+g(d).gjf (generated)

037967023.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967023.mol 037967023.PUBCHEM 037967023.mol (via Jmol)
037967025.b3lyp_6-31g(d).inp

037967025.b3lyp_6-31g(d).qchem.inp (generated)

037967025.b3lyp_6-31g(d).gjf (generated)

037967025.b3lyp_6-31g(d).firefly.inp (generated)

037967025.b3lyp_6-31g(d).smash.inp (generated)

037967025.b3lyp_6-31g(d).nwchem.inp (generated) 037967025.b3lyp_6-31g(d).log.xz 037967025.mol 037967025.PUBCHEM 037967025.mol (via Jmol)
037967034.b3lyp_6-31g(d).inp

037967034.b3lyp_6-31g(d).qchem.inp (generated)

037967034.b3lyp_6-31g(d).gjf (generated)

037967034.b3lyp_6-31g(d).firefly.inp (generated)

037967034.b3lyp_6-31g(d).smash.inp (generated)

037967034.b3lyp_6-31g(d).nwchem.inp (generated) 037967034.b3lyp_6-31g(d).log.xz 037967034.td-b3lyp_6-31g+(d).inp 037967034.td-b3lyp_6-31g+(d).log.xz

037967034.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967034.td-b3lyp_6-31+g(d).gjf (generated)

037967034.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967034.mol 037967034.PUBCHEM 037967034.mol (via Jmol)
037967141.b3lyp_6-31g(d).inp

037967141.b3lyp_6-31g(d).qchem.inp (generated)

037967141.b3lyp_6-31g(d).gjf (generated)

037967141.b3lyp_6-31g(d).firefly.inp (generated)

037967141.b3lyp_6-31g(d).smash.inp (generated)

037967141.b3lyp_6-31g(d).nwchem.inp (generated) 037967141.b3lyp_6-31g(d).log.xz 037967141.td-b3lyp_6-31g+(d).inp 037967141.td-b3lyp_6-31g+(d).log.xz

037967141.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967141.td-b3lyp_6-31+g(d).gjf (generated)

037967141.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967141.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967141.mol 037967141.PUBCHEM 037967141.mol (via Jmol)
037967145.b3lyp_6-31g(d).inp

037967145.b3lyp_6-31g(d).qchem.inp (generated)

037967145.b3lyp_6-31g(d).gjf (generated)

037967145.b3lyp_6-31g(d).firefly.inp (generated)

037967145.b3lyp_6-31g(d).smash.inp (generated)

037967145.b3lyp_6-31g(d).nwchem.inp (generated) 037967145.b3lyp_6-31g(d).log.xz 037967145.td-b3lyp_6-31g+(d).inp 037967145.td-b3lyp_6-31g+(d).log.xz

037967145.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967145.td-b3lyp_6-31+g(d).gjf (generated)

037967145.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967145.mol 037967145.PUBCHEM 037967145.mol (via Jmol)
037967146.b3lyp_6-31g(d).inp

037967146.b3lyp_6-31g(d).qchem.inp (generated)

037967146.b3lyp_6-31g(d).gjf (generated)

037967146.b3lyp_6-31g(d).firefly.inp (generated)

037967146.b3lyp_6-31g(d).smash.inp (generated)

037967146.b3lyp_6-31g(d).nwchem.inp (generated) 037967146.b3lyp_6-31g(d).log.xz 037967146.td-b3lyp_6-31g+(d).inp 037967146.td-b3lyp_6-31g+(d).log.xz

037967146.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967146.td-b3lyp_6-31+g(d).gjf (generated)

037967146.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967146.mol 037967146.PUBCHEM 037967146.mol (via Jmol)
037967201.b3lyp_6-31g(d).inp

037967201.b3lyp_6-31g(d).qchem.inp (generated)

037967201.b3lyp_6-31g(d).gjf (generated)

037967201.b3lyp_6-31g(d).firefly.inp (generated)

037967201.b3lyp_6-31g(d).smash.inp (generated)

037967201.b3lyp_6-31g(d).nwchem.inp (generated) 037967201.b3lyp_6-31g(d).log.xz 037967201.td-b3lyp_6-31g+(d).inp 037967201.td-b3lyp_6-31g+(d).log.xz

037967201.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967201.td-b3lyp_6-31+g(d).gjf (generated)

037967201.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967201.mol 037967201.PUBCHEM 037967201.mol (via Jmol)
037967250.b3lyp_6-31g(d).inp

037967250.b3lyp_6-31g(d).qchem.inp (generated)

037967250.b3lyp_6-31g(d).gjf (generated)

037967250.b3lyp_6-31g(d).firefly.inp (generated)

037967250.b3lyp_6-31g(d).smash.inp (generated)

037967250.b3lyp_6-31g(d).nwchem.inp (generated) 037967250.b3lyp_6-31g(d).log.xz 037967250.td-b3lyp_6-31g+(d).inp 037967250.td-b3lyp_6-31g+(d).log.xz

037967250.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967250.td-b3lyp_6-31+g(d).gjf (generated)

037967250.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967250.mol 037967250.PUBCHEM 037967250.mol (via Jmol)
037967253.b3lyp_6-31g(d).inp

037967253.b3lyp_6-31g(d).qchem.inp (generated)

037967253.b3lyp_6-31g(d).gjf (generated)

037967253.b3lyp_6-31g(d).firefly.inp (generated)

037967253.b3lyp_6-31g(d).smash.inp (generated)

037967253.b3lyp_6-31g(d).nwchem.inp (generated) 037967253.b3lyp_6-31g(d).log.xz 037967253.td-b3lyp_6-31g+(d).inp 037967253.td-b3lyp_6-31g+(d).log.xz

037967253.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967253.td-b3lyp_6-31+g(d).gjf (generated)

037967253.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967253.mol 037967253.PUBCHEM 037967253.mol (via Jmol)
037967294.b3lyp_6-31g(d).inp

037967294.b3lyp_6-31g(d).qchem.inp (generated)

037967294.b3lyp_6-31g(d).gjf (generated)

037967294.b3lyp_6-31g(d).firefly.inp (generated)

037967294.b3lyp_6-31g(d).smash.inp (generated)

037967294.b3lyp_6-31g(d).nwchem.inp (generated) 037967294.b3lyp_6-31g(d).log.xz 037967294.td-b3lyp_6-31g+(d).inp 037967294.td-b3lyp_6-31g+(d).log.xz

037967294.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967294.td-b3lyp_6-31+g(d).gjf (generated)

037967294.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967294.mol 037967294.PUBCHEM 037967294.mol (via Jmol)
037967295.b3lyp_6-31g(d).inp

037967295.b3lyp_6-31g(d).qchem.inp (generated)

037967295.b3lyp_6-31g(d).gjf (generated)

037967295.b3lyp_6-31g(d).firefly.inp (generated)

037967295.b3lyp_6-31g(d).smash.inp (generated)

037967295.b3lyp_6-31g(d).nwchem.inp (generated) 037967295.b3lyp_6-31g(d).log.xz 037967295.mol 037967295.PUBCHEM 037967295.mol (via Jmol)
037967299.b3lyp_6-31g(d).inp

037967299.b3lyp_6-31g(d).qchem.inp (generated)

037967299.b3lyp_6-31g(d).gjf (generated)

037967299.b3lyp_6-31g(d).firefly.inp (generated)

037967299.b3lyp_6-31g(d).smash.inp (generated)

037967299.b3lyp_6-31g(d).nwchem.inp (generated) 037967299.b3lyp_6-31g(d).log.xz 037967299.mol 037967299.PUBCHEM 037967299.mol (via Jmol)
037967375.b3lyp_6-31g(d).inp

037967375.b3lyp_6-31g(d).qchem.inp (generated)

037967375.b3lyp_6-31g(d).gjf (generated)

037967375.b3lyp_6-31g(d).firefly.inp (generated)

037967375.b3lyp_6-31g(d).smash.inp (generated)

037967375.b3lyp_6-31g(d).nwchem.inp (generated) 037967375.b3lyp_6-31g(d).log.xz 037967375.td-b3lyp_6-31g+(d).inp 037967375.td-b3lyp_6-31g+(d).log.xz

037967375.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967375.td-b3lyp_6-31+g(d).gjf (generated)

037967375.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967375.mol 037967375.PUBCHEM 037967375.mol (via Jmol)
037967384.b3lyp_6-31g(d).inp

037967384.b3lyp_6-31g(d).qchem.inp (generated)

037967384.b3lyp_6-31g(d).gjf (generated)

037967384.b3lyp_6-31g(d).firefly.inp (generated)

037967384.b3lyp_6-31g(d).smash.inp (generated)

037967384.b3lyp_6-31g(d).nwchem.inp (generated) 037967384.b3lyp_6-31g(d).log.xz 037967384.td-b3lyp_6-31g+(d).inp 037967384.td-b3lyp_6-31g+(d).log.xz

037967384.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967384.td-b3lyp_6-31+g(d).gjf (generated)

037967384.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967384.mol 037967384.PUBCHEM 037967384.mol (via Jmol)
037967467.b3lyp_6-31g(d).inp

037967467.b3lyp_6-31g(d).qchem.inp (generated)

037967467.b3lyp_6-31g(d).gjf (generated)

037967467.b3lyp_6-31g(d).firefly.inp (generated)

037967467.b3lyp_6-31g(d).smash.inp (generated)

037967467.b3lyp_6-31g(d).nwchem.inp (generated) 037967467.b3lyp_6-31g(d).log.xz 037967467.td-b3lyp_6-31g+(d).inp 037967467.td-b3lyp_6-31g+(d).log.xz

037967467.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967467.td-b3lyp_6-31+g(d).gjf (generated)

037967467.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967467.mol 037967467.PUBCHEM 037967467.mol (via Jmol)
037967469.b3lyp_6-31g(d).inp

037967469.b3lyp_6-31g(d).qchem.inp (generated)

037967469.b3lyp_6-31g(d).gjf (generated)

037967469.b3lyp_6-31g(d).firefly.inp (generated)

037967469.b3lyp_6-31g(d).smash.inp (generated)

037967469.b3lyp_6-31g(d).nwchem.inp (generated) 037967469.b3lyp_6-31g(d).log.xz 037967469.td-b3lyp_6-31g+(d).inp 037967469.td-b3lyp_6-31g+(d).log.xz

037967469.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967469.td-b3lyp_6-31+g(d).gjf (generated)

037967469.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967469.mol 037967469.PUBCHEM 037967469.mol (via Jmol)
037967477.b3lyp_6-31g(d).inp

037967477.b3lyp_6-31g(d).qchem.inp (generated)

037967477.b3lyp_6-31g(d).gjf (generated)

037967477.b3lyp_6-31g(d).firefly.inp (generated)

037967477.b3lyp_6-31g(d).smash.inp (generated)

037967477.b3lyp_6-31g(d).nwchem.inp (generated) 037967477.b3lyp_6-31g(d).log.xz 037967477.td-b3lyp_6-31g+(d).inp 037967477.td-b3lyp_6-31g+(d).log.xz

037967477.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967477.td-b3lyp_6-31+g(d).gjf (generated)

037967477.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967477.mol 037967477.PUBCHEM 037967477.mol (via Jmol)
037967545.b3lyp_6-31g(d).inp

037967545.b3lyp_6-31g(d).qchem.inp (generated)

037967545.b3lyp_6-31g(d).gjf (generated)

037967545.b3lyp_6-31g(d).firefly.inp (generated)

037967545.b3lyp_6-31g(d).smash.inp (generated)

037967545.b3lyp_6-31g(d).nwchem.inp (generated) 037967545.b3lyp_6-31g(d).log.xz 037967545.td-b3lyp_6-31g+(d).inp 037967545.td-b3lyp_6-31g+(d).log.xz

037967545.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967545.td-b3lyp_6-31+g(d).gjf (generated)

037967545.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967545.mol 037967545.PUBCHEM 037967545.mol (via Jmol)
037967551.b3lyp_6-31g(d).inp

037967551.b3lyp_6-31g(d).qchem.inp (generated)

037967551.b3lyp_6-31g(d).gjf (generated)

037967551.b3lyp_6-31g(d).firefly.inp (generated)

037967551.b3lyp_6-31g(d).smash.inp (generated)

037967551.b3lyp_6-31g(d).nwchem.inp (generated) 037967551.b3lyp_6-31g(d).log.xz 037967551.td-b3lyp_6-31g+(d).inp 037967551.td-b3lyp_6-31g+(d).log.xz

037967551.td-b3lyp_6-31+g(d).qchem.inp (generated)

037967551.td-b3lyp_6-31+g(d).gjf (generated)

037967551.td-b3lyp_6-31+g(d).firefly.inp (generated)

037967551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037967551.mol 037967551.PUBCHEM 037967551.mol (via Jmol)
037968440.b3lyp_6-31g(d).inp

037968440.b3lyp_6-31g(d).qchem.inp (generated)

037968440.b3lyp_6-31g(d).gjf (generated)

037968440.b3lyp_6-31g(d).firefly.inp (generated)

037968440.b3lyp_6-31g(d).smash.inp (generated)

037968440.b3lyp_6-31g(d).nwchem.inp (generated) 037968440.b3lyp_6-31g(d).log.xz 037968440.td-b3lyp_6-31g+(d).inp 037968440.td-b3lyp_6-31g+(d).log.xz

037968440.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968440.td-b3lyp_6-31+g(d).gjf (generated)

037968440.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968440.mol 037968440.PUBCHEM 037968440.mol (via Jmol)
037968441.b3lyp_6-31g(d).inp

037968441.b3lyp_6-31g(d).qchem.inp (generated)

037968441.b3lyp_6-31g(d).gjf (generated)

037968441.b3lyp_6-31g(d).firefly.inp (generated)

037968441.b3lyp_6-31g(d).smash.inp (generated)

037968441.b3lyp_6-31g(d).nwchem.inp (generated) 037968441.b3lyp_6-31g(d).log.xz 037968441.td-b3lyp_6-31g+(d).inp 037968441.td-b3lyp_6-31g+(d).log.xz

037968441.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968441.td-b3lyp_6-31+g(d).gjf (generated)

037968441.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968441.mol 037968441.PUBCHEM 037968441.mol (via Jmol)
037968540.b3lyp_6-31g(d).inp

037968540.b3lyp_6-31g(d).qchem.inp (generated)

037968540.b3lyp_6-31g(d).gjf (generated)

037968540.b3lyp_6-31g(d).firefly.inp (generated)

037968540.b3lyp_6-31g(d).smash.inp (generated)

037968540.b3lyp_6-31g(d).nwchem.inp (generated) 037968540.b3lyp_6-31g(d).log.xz 037968540.td-b3lyp_6-31g+(d).inp 037968540.td-b3lyp_6-31g+(d).log.xz

037968540.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968540.td-b3lyp_6-31+g(d).gjf (generated)

037968540.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968540.mol 037968540.PUBCHEM 037968540.mol (via Jmol)
037968542.b3lyp_6-31g(d).inp

037968542.b3lyp_6-31g(d).qchem.inp (generated)

037968542.b3lyp_6-31g(d).gjf (generated)

037968542.b3lyp_6-31g(d).firefly.inp (generated)

037968542.b3lyp_6-31g(d).smash.inp (generated)

037968542.b3lyp_6-31g(d).nwchem.inp (generated) 037968542.b3lyp_6-31g(d).log.xz 037968542.mol 037968542.PUBCHEM 037968542.mol (via Jmol)
037968550.b3lyp_6-31g(d).inp

037968550.b3lyp_6-31g(d).qchem.inp (generated)

037968550.b3lyp_6-31g(d).gjf (generated)

037968550.b3lyp_6-31g(d).firefly.inp (generated)

037968550.b3lyp_6-31g(d).smash.inp (generated)

037968550.b3lyp_6-31g(d).nwchem.inp (generated) 037968550.b3lyp_6-31g(d).log.xz 037968550.td-b3lyp_6-31g+(d).inp 037968550.td-b3lyp_6-31g+(d).log.xz

037968550.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968550.td-b3lyp_6-31+g(d).gjf (generated)

037968550.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968550.mol 037968550.PUBCHEM 037968550.mol (via Jmol)
037968567.b3lyp_6-31g(d).inp

037968567.b3lyp_6-31g(d).qchem.inp (generated)

037968567.b3lyp_6-31g(d).gjf (generated)

037968567.b3lyp_6-31g(d).firefly.inp (generated)

037968567.b3lyp_6-31g(d).smash.inp (generated)

037968567.b3lyp_6-31g(d).nwchem.inp (generated) 037968567.b3lyp_6-31g(d).log.xz 037968567.td-b3lyp_6-31g+(d).inp 037968567.td-b3lyp_6-31g+(d).log.xz

037968567.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968567.td-b3lyp_6-31+g(d).gjf (generated)

037968567.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968567.mol 037968567.PUBCHEM 037968567.mol (via Jmol)
037968573.b3lyp_6-31g(d).inp

037968573.b3lyp_6-31g(d).qchem.inp (generated)

037968573.b3lyp_6-31g(d).gjf (generated)

037968573.b3lyp_6-31g(d).firefly.inp (generated)

037968573.b3lyp_6-31g(d).smash.inp (generated)

037968573.b3lyp_6-31g(d).nwchem.inp (generated) 037968573.b3lyp_6-31g(d).log.xz 037968573.td-b3lyp_6-31g+(d).inp 037968573.td-b3lyp_6-31g+(d).log.xz

037968573.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968573.td-b3lyp_6-31+g(d).gjf (generated)

037968573.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968573.mol 037968573.PUBCHEM 037968573.mol (via Jmol)
037968637.b3lyp_6-31g(d).inp

037968637.b3lyp_6-31g(d).qchem.inp (generated)

037968637.b3lyp_6-31g(d).gjf (generated)

037968637.b3lyp_6-31g(d).firefly.inp (generated)

037968637.b3lyp_6-31g(d).smash.inp (generated)

037968637.b3lyp_6-31g(d).nwchem.inp (generated) 037968637.b3lyp_6-31g(d).log.xz 037968637.td-b3lyp_6-31g+(d).inp 037968637.td-b3lyp_6-31g+(d).log.xz

037968637.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968637.td-b3lyp_6-31+g(d).gjf (generated)

037968637.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968637.mol 037968637.PUBCHEM 037968637.mol (via Jmol)
037968643.b3lyp_6-31g(d).inp

037968643.b3lyp_6-31g(d).qchem.inp (generated)

037968643.b3lyp_6-31g(d).gjf (generated)

037968643.b3lyp_6-31g(d).firefly.inp (generated)

037968643.b3lyp_6-31g(d).smash.inp (generated)

037968643.b3lyp_6-31g(d).nwchem.inp (generated) 037968643.b3lyp_6-31g(d).log.xz 037968643.td-b3lyp_6-31g+(d).inp 037968643.td-b3lyp_6-31g+(d).log.xz

037968643.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968643.td-b3lyp_6-31+g(d).gjf (generated)

037968643.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968643.mol 037968643.PUBCHEM 037968643.mol (via Jmol)
037968706.b3lyp_6-31g(d).inp

037968706.b3lyp_6-31g(d).qchem.inp (generated)

037968706.b3lyp_6-31g(d).gjf (generated)

037968706.b3lyp_6-31g(d).firefly.inp (generated)

037968706.b3lyp_6-31g(d).smash.inp (generated)

037968706.b3lyp_6-31g(d).nwchem.inp (generated) 037968706.b3lyp_6-31g(d).log.xz 037968706.td-b3lyp_6-31g+(d).inp 037968706.td-b3lyp_6-31g+(d).log.xz

037968706.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968706.td-b3lyp_6-31+g(d).gjf (generated)

037968706.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968706.mol 037968706.PUBCHEM 037968706.mol (via Jmol)
037968712.b3lyp_6-31g(d).inp

037968712.b3lyp_6-31g(d).qchem.inp (generated)

037968712.b3lyp_6-31g(d).gjf (generated)

037968712.b3lyp_6-31g(d).firefly.inp (generated)

037968712.b3lyp_6-31g(d).smash.inp (generated)

037968712.b3lyp_6-31g(d).nwchem.inp (generated) 037968712.b3lyp_6-31g(d).log.xz 037968712.td-b3lyp_6-31g+(d).inp 037968712.td-b3lyp_6-31g+(d).log.xz

037968712.td-b3lyp_6-31+g(d).qchem.inp (generated)

037968712.td-b3lyp_6-31+g(d).gjf (generated)

037968712.td-b3lyp_6-31+g(d).firefly.inp (generated)

037968712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037968712.mol 037968712.PUBCHEM 037968712.mol (via Jmol)
037969120.b3lyp_6-31g(d).inp

037969120.b3lyp_6-31g(d).qchem.inp (generated)

037969120.b3lyp_6-31g(d).gjf (generated)

037969120.b3lyp_6-31g(d).firefly.inp (generated)

037969120.b3lyp_6-31g(d).smash.inp (generated)

037969120.b3lyp_6-31g(d).nwchem.inp (generated) 037969120.b3lyp_6-31g(d).log.xz 037969120.td-b3lyp_6-31g+(d).inp 037969120.td-b3lyp_6-31g+(d).log.xz

037969120.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969120.td-b3lyp_6-31+g(d).gjf (generated)

037969120.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969120.mol 037969120.PUBCHEM 037969120.mol (via Jmol)
037969180.b3lyp_6-31g(d).inp

037969180.b3lyp_6-31g(d).qchem.inp (generated)

037969180.b3lyp_6-31g(d).gjf (generated)

037969180.b3lyp_6-31g(d).firefly.inp (generated)

037969180.b3lyp_6-31g(d).smash.inp (generated)

037969180.b3lyp_6-31g(d).nwchem.inp (generated) 037969180.b3lyp_6-31g(d).log.xz 037969180.td-b3lyp_6-31g+(d).inp 037969180.td-b3lyp_6-31g+(d).log.xz

037969180.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969180.td-b3lyp_6-31+g(d).gjf (generated)

037969180.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969180.mol 037969180.PUBCHEM 037969180.mol (via Jmol)
037969254.b3lyp_6-31g(d).inp

037969254.b3lyp_6-31g(d).qchem.inp (generated)

037969254.b3lyp_6-31g(d).gjf (generated)

037969254.b3lyp_6-31g(d).firefly.inp (generated)

037969254.b3lyp_6-31g(d).smash.inp (generated)

037969254.b3lyp_6-31g(d).nwchem.inp (generated) 037969254.b3lyp_6-31g(d).log.xz 037969254.td-b3lyp_6-31g+(d).inp 037969254.td-b3lyp_6-31g+(d).log.xz

037969254.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969254.td-b3lyp_6-31+g(d).gjf (generated)

037969254.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969254.mol 037969254.PUBCHEM 037969254.mol (via Jmol)
037969316.b3lyp_6-31g(d).inp

037969316.b3lyp_6-31g(d).qchem.inp (generated)

037969316.b3lyp_6-31g(d).gjf (generated)

037969316.b3lyp_6-31g(d).firefly.inp (generated)

037969316.b3lyp_6-31g(d).smash.inp (generated)

037969316.b3lyp_6-31g(d).nwchem.inp (generated) 037969316.b3lyp_6-31g(d).log.xz 037969316.mol 037969316.PUBCHEM 037969316.mol (via Jmol)
037969318.b3lyp_6-31g(d).inp

037969318.b3lyp_6-31g(d).qchem.inp (generated)

037969318.b3lyp_6-31g(d).gjf (generated)

037969318.b3lyp_6-31g(d).firefly.inp (generated)

037969318.b3lyp_6-31g(d).smash.inp (generated)

037969318.b3lyp_6-31g(d).nwchem.inp (generated) 037969318.b3lyp_6-31g(d).log.xz 037969318.td-b3lyp_6-31g+(d).inp 037969318.td-b3lyp_6-31g+(d).log.xz

037969318.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969318.td-b3lyp_6-31+g(d).gjf (generated)

037969318.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969318.mol 037969318.PUBCHEM 037969318.mol (via Jmol)
037969324.b3lyp_6-31g(d).inp

037969324.b3lyp_6-31g(d).qchem.inp (generated)

037969324.b3lyp_6-31g(d).gjf (generated)

037969324.b3lyp_6-31g(d).firefly.inp (generated)

037969324.b3lyp_6-31g(d).smash.inp (generated)

037969324.b3lyp_6-31g(d).nwchem.inp (generated) 037969324.b3lyp_6-31g(d).log.xz 037969324.td-b3lyp_6-31g+(d).inp 037969324.td-b3lyp_6-31g+(d).log.xz

037969324.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969324.td-b3lyp_6-31+g(d).gjf (generated)

037969324.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969324.mol 037969324.PUBCHEM 037969324.mol (via Jmol)
037969388.b3lyp_6-31g(d).inp

037969388.b3lyp_6-31g(d).qchem.inp (generated)

037969388.b3lyp_6-31g(d).gjf (generated)

037969388.b3lyp_6-31g(d).firefly.inp (generated)

037969388.b3lyp_6-31g(d).smash.inp (generated)

037969388.b3lyp_6-31g(d).nwchem.inp (generated) 037969388.b3lyp_6-31g(d).log.xz 037969388.mol 037969388.PUBCHEM 037969388.mol (via Jmol)
037969390.b3lyp_6-31g(d).inp

037969390.b3lyp_6-31g(d).qchem.inp (generated)

037969390.b3lyp_6-31g(d).gjf (generated)

037969390.b3lyp_6-31g(d).firefly.inp (generated)

037969390.b3lyp_6-31g(d).smash.inp (generated)

037969390.b3lyp_6-31g(d).nwchem.inp (generated) 037969390.b3lyp_6-31g(d).log.xz 037969390.td-b3lyp_6-31g+(d).inp 037969390.td-b3lyp_6-31g+(d).log.xz

037969390.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969390.td-b3lyp_6-31+g(d).gjf (generated)

037969390.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969390.mol 037969390.PUBCHEM 037969390.mol (via Jmol)
037969396.b3lyp_6-31g(d).inp

037969396.b3lyp_6-31g(d).qchem.inp (generated)

037969396.b3lyp_6-31g(d).gjf (generated)

037969396.b3lyp_6-31g(d).firefly.inp (generated)

037969396.b3lyp_6-31g(d).smash.inp (generated)

037969396.b3lyp_6-31g(d).nwchem.inp (generated) 037969396.b3lyp_6-31g(d).log.xz 037969396.td-b3lyp_6-31g+(d).inp 037969396.td-b3lyp_6-31g+(d).log.xz

037969396.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969396.td-b3lyp_6-31+g(d).gjf (generated)

037969396.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969396.mol 037969396.PUBCHEM 037969396.mol (via Jmol)
037969462.b3lyp_6-31g(d).inp

037969462.b3lyp_6-31g(d).qchem.inp (generated)

037969462.b3lyp_6-31g(d).gjf (generated)

037969462.b3lyp_6-31g(d).firefly.inp (generated)

037969462.b3lyp_6-31g(d).smash.inp (generated)

037969462.b3lyp_6-31g(d).nwchem.inp (generated) 037969462.b3lyp_6-31g(d).log.xz 037969462.mol 037969462.PUBCHEM 037969462.mol (via Jmol)
037969464.b3lyp_6-31g(d).inp

037969464.b3lyp_6-31g(d).qchem.inp (generated)

037969464.b3lyp_6-31g(d).gjf (generated)

037969464.b3lyp_6-31g(d).firefly.inp (generated)

037969464.b3lyp_6-31g(d).smash.inp (generated)

037969464.b3lyp_6-31g(d).nwchem.inp (generated) 037969464.b3lyp_6-31g(d).log.xz 037969464.td-b3lyp_6-31g+(d).inp 037969464.td-b3lyp_6-31g+(d).log.xz

037969464.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969464.td-b3lyp_6-31+g(d).gjf (generated)

037969464.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969464.mol 037969464.PUBCHEM 037969464.mol (via Jmol)
037969470.b3lyp_6-31g(d).inp

037969470.b3lyp_6-31g(d).qchem.inp (generated)

037969470.b3lyp_6-31g(d).gjf (generated)

037969470.b3lyp_6-31g(d).firefly.inp (generated)

037969470.b3lyp_6-31g(d).smash.inp (generated)

037969470.b3lyp_6-31g(d).nwchem.inp (generated) 037969470.b3lyp_6-31g(d).log.xz 037969470.td-b3lyp_6-31g+(d).inp 037969470.td-b3lyp_6-31g+(d).log.xz

037969470.td-b3lyp_6-31+g(d).qchem.inp (generated)

037969470.td-b3lyp_6-31+g(d).gjf (generated)

037969470.td-b3lyp_6-31+g(d).firefly.inp (generated)

037969470.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037969470.mol 037969470.PUBCHEM 037969470.mol (via Jmol)
037970629.b3lyp_6-31g(d).inp

037970629.b3lyp_6-31g(d).qchem.inp (generated)

037970629.b3lyp_6-31g(d).gjf (generated)

037970629.b3lyp_6-31g(d).firefly.inp (generated)

037970629.b3lyp_6-31g(d).smash.inp (generated)

037970629.b3lyp_6-31g(d).nwchem.inp (generated) 037970629.b3lyp_6-31g(d).log.xz 037970629.td-b3lyp_6-31g+(d).inp 037970629.td-b3lyp_6-31g+(d).log.xz

037970629.td-b3lyp_6-31+g(d).qchem.inp (generated)

037970629.td-b3lyp_6-31+g(d).gjf (generated)

037970629.td-b3lyp_6-31+g(d).firefly.inp (generated)

037970629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037970629.mol 037970629.PUBCHEM 037970629.mol (via Jmol)
037971331.b3lyp_6-31g(d).inp

037971331.b3lyp_6-31g(d).qchem.inp (generated)

037971331.b3lyp_6-31g(d).gjf (generated)

037971331.b3lyp_6-31g(d).firefly.inp (generated)

037971331.b3lyp_6-31g(d).smash.inp (generated)

037971331.b3lyp_6-31g(d).nwchem.inp (generated) 037971331.b3lyp_6-31g(d).log.xz 037971331.td-b3lyp_6-31g+(d).inp 037971331.td-b3lyp_6-31g+(d).log.xz

037971331.td-b3lyp_6-31+g(d).qchem.inp (generated)

037971331.td-b3lyp_6-31+g(d).gjf (generated)

037971331.td-b3lyp_6-31+g(d).firefly.inp (generated)

037971331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 037971331.mol 037971331.PUBCHEM 037971331.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com