Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 2167 (1983) in this page
012600000.b3lyp_6-31g(d).inp

012600000.b3lyp_6-31g(d).qchem.inp (generated)

012600000.b3lyp_6-31g(d).gjf (generated)

012600000.b3lyp_6-31g(d).firefly.inp (generated)

012600000.b3lyp_6-31g(d).smash.inp (generated)

012600000.b3lyp_6-31g(d).nwchem.inp (generated) 012600000.b3lyp_6-31g(d).log.xz 012600000.td-b3lyp_6-31g+(d).inp 012600000.td-b3lyp_6-31g+(d).log.xz

012600000.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600000.td-b3lyp_6-31+g(d).gjf (generated)

012600000.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600000.mol 012600000.PUBCHEM 012600000.mol (via Jmol)
012600002.b3lyp_6-31g(d).inp

012600002.b3lyp_6-31g(d).qchem.inp (generated)

012600002.b3lyp_6-31g(d).gjf (generated)

012600002.b3lyp_6-31g(d).firefly.inp (generated)

012600002.b3lyp_6-31g(d).smash.inp (generated)

012600002.b3lyp_6-31g(d).nwchem.inp (generated) 012600002.b3lyp_6-31g(d).log.xz 012600002.td-b3lyp_6-31g+(d).inp 012600002.td-b3lyp_6-31g+(d).log.xz

012600002.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600002.td-b3lyp_6-31+g(d).gjf (generated)

012600002.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600002.mol 012600002.PUBCHEM 012600002.mol (via Jmol)
012600005.b3lyp_6-31g(d).inp

012600005.b3lyp_6-31g(d).qchem.inp (generated)

012600005.b3lyp_6-31g(d).gjf (generated)

012600005.b3lyp_6-31g(d).firefly.inp (generated)

012600005.b3lyp_6-31g(d).smash.inp (generated)

012600005.b3lyp_6-31g(d).nwchem.inp (generated) 012600005.b3lyp_6-31g(d).log.xz 012600005.td-b3lyp_6-31g+(d).inp 012600005.td-b3lyp_6-31g+(d).log.xz

012600005.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600005.td-b3lyp_6-31+g(d).gjf (generated)

012600005.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600005.mol 012600005.PUBCHEM 012600005.mol (via Jmol)
012600007.b3lyp_6-31g(d).inp

012600007.b3lyp_6-31g(d).qchem.inp (generated)

012600007.b3lyp_6-31g(d).gjf (generated)

012600007.b3lyp_6-31g(d).firefly.inp (generated)

012600007.b3lyp_6-31g(d).smash.inp (generated)

012600007.b3lyp_6-31g(d).nwchem.inp (generated) 012600007.b3lyp_6-31g(d).log.xz 012600007.td-b3lyp_6-31g+(d).inp 012600007.td-b3lyp_6-31g+(d).log.xz

012600007.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600007.td-b3lyp_6-31+g(d).gjf (generated)

012600007.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600007.mol 012600007.PUBCHEM 012600007.mol (via Jmol)
012600008.b3lyp_6-31g(d).inp

012600008.b3lyp_6-31g(d).qchem.inp (generated)

012600008.b3lyp_6-31g(d).gjf (generated)

012600008.b3lyp_6-31g(d).firefly.inp (generated)

012600008.b3lyp_6-31g(d).smash.inp (generated)

012600008.b3lyp_6-31g(d).nwchem.inp (generated) 012600008.b3lyp_6-31g(d).log.xz 012600008.td-b3lyp_6-31g+(d).inp 012600008.td-b3lyp_6-31g+(d).log.xz

012600008.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600008.td-b3lyp_6-31+g(d).gjf (generated)

012600008.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600008.mol 012600008.PUBCHEM 012600008.mol (via Jmol)
012600011.b3lyp_6-31g(d).inp

012600011.b3lyp_6-31g(d).qchem.inp (generated)

012600011.b3lyp_6-31g(d).gjf (generated)

012600011.b3lyp_6-31g(d).firefly.inp (generated)

012600011.b3lyp_6-31g(d).smash.inp (generated)

012600011.b3lyp_6-31g(d).nwchem.inp (generated) 012600011.b3lyp_6-31g(d).log.xz 012600011.td-b3lyp_6-31g+(d).inp 012600011.td-b3lyp_6-31g+(d).log.xz

012600011.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600011.td-b3lyp_6-31+g(d).gjf (generated)

012600011.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600011.mol 012600011.PUBCHEM 012600011.mol (via Jmol)
012600018.b3lyp_6-31g(d).inp

012600018.b3lyp_6-31g(d).qchem.inp (generated)

012600018.b3lyp_6-31g(d).gjf (generated)

012600018.b3lyp_6-31g(d).firefly.inp (generated)

012600018.b3lyp_6-31g(d).smash.inp (generated)

012600018.b3lyp_6-31g(d).nwchem.inp (generated) 012600018.b3lyp_6-31g(d).log.xz 012600018.td-b3lyp_6-31g+(d).inp 012600018.td-b3lyp_6-31g+(d).log.xz

012600018.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600018.td-b3lyp_6-31+g(d).gjf (generated)

012600018.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600018.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600018.mol 012600018.PUBCHEM 012600018.mol (via Jmol)
012600021.b3lyp_6-31g(d).inp

012600021.b3lyp_6-31g(d).qchem.inp (generated)

012600021.b3lyp_6-31g(d).gjf (generated)

012600021.b3lyp_6-31g(d).firefly.inp (generated)

012600021.b3lyp_6-31g(d).smash.inp (generated)

012600021.b3lyp_6-31g(d).nwchem.inp (generated) 012600021.b3lyp_6-31g(d).log.xz 012600021.td-b3lyp_6-31g+(d).inp 012600021.td-b3lyp_6-31g+(d).log.xz

012600021.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600021.td-b3lyp_6-31+g(d).gjf (generated)

012600021.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600021.mol 012600021.PUBCHEM 012600021.mol (via Jmol)
012600025.b3lyp_6-31g(d).inp

012600025.b3lyp_6-31g(d).qchem.inp (generated)

012600025.b3lyp_6-31g(d).gjf (generated)

012600025.b3lyp_6-31g(d).firefly.inp (generated)

012600025.b3lyp_6-31g(d).smash.inp (generated)

012600025.b3lyp_6-31g(d).nwchem.inp (generated) 012600025.b3lyp_6-31g(d).log.xz 012600025.td-b3lyp_6-31g+(d).inp 012600025.td-b3lyp_6-31g+(d).log.xz

012600025.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600025.td-b3lyp_6-31+g(d).gjf (generated)

012600025.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600025.mol 012600025.PUBCHEM 012600025.mol (via Jmol)
012600028.b3lyp_6-31g(d).inp

012600028.b3lyp_6-31g(d).qchem.inp (generated)

012600028.b3lyp_6-31g(d).gjf (generated)

012600028.b3lyp_6-31g(d).firefly.inp (generated)

012600028.b3lyp_6-31g(d).smash.inp (generated)

012600028.b3lyp_6-31g(d).nwchem.inp (generated) 012600028.b3lyp_6-31g(d).log.xz 012600028.td-b3lyp_6-31g+(d).inp 012600028.td-b3lyp_6-31g+(d).log.xz

012600028.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600028.td-b3lyp_6-31+g(d).gjf (generated)

012600028.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600028.mol 012600028.PUBCHEM 012600028.mol (via Jmol)
012600032.b3lyp_6-31g(d).inp

012600032.b3lyp_6-31g(d).qchem.inp (generated)

012600032.b3lyp_6-31g(d).gjf (generated)

012600032.b3lyp_6-31g(d).firefly.inp (generated)

012600032.b3lyp_6-31g(d).smash.inp (generated)

012600032.b3lyp_6-31g(d).nwchem.inp (generated) 012600032.b3lyp_6-31g(d).log.xz 012600032.td-b3lyp_6-31g+(d).inp 012600032.td-b3lyp_6-31g+(d).log.xz

012600032.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600032.td-b3lyp_6-31+g(d).gjf (generated)

012600032.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600032.mol 012600032.PUBCHEM 012600032.mol (via Jmol)
012600035.b3lyp_6-31g(d).inp

012600035.b3lyp_6-31g(d).qchem.inp (generated)

012600035.b3lyp_6-31g(d).gjf (generated)

012600035.b3lyp_6-31g(d).firefly.inp (generated)

012600035.b3lyp_6-31g(d).smash.inp (generated)

012600035.b3lyp_6-31g(d).nwchem.inp (generated) 012600035.b3lyp_6-31g(d).log.xz 012600035.td-b3lyp_6-31g+(d).inp 012600035.td-b3lyp_6-31g+(d).log.xz

012600035.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600035.td-b3lyp_6-31+g(d).gjf (generated)

012600035.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600035.mol 012600035.PUBCHEM 012600035.mol (via Jmol)
012600066.b3lyp_6-31g(d).inp

012600066.b3lyp_6-31g(d).qchem.inp (generated)

012600066.b3lyp_6-31g(d).gjf (generated)

012600066.b3lyp_6-31g(d).firefly.inp (generated)

012600066.b3lyp_6-31g(d).smash.inp (generated)

012600066.b3lyp_6-31g(d).nwchem.inp (generated) 012600066.b3lyp_6-31g(d).log.xz 012600066.td-b3lyp_6-31g+(d).inp 012600066.td-b3lyp_6-31g+(d).log.xz

012600066.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600066.td-b3lyp_6-31+g(d).gjf (generated)

012600066.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600066.mol 012600066.PUBCHEM 012600066.mol (via Jmol)
012600070.b3lyp_6-31g(d).inp

012600070.b3lyp_6-31g(d).qchem.inp (generated)

012600070.b3lyp_6-31g(d).gjf (generated)

012600070.b3lyp_6-31g(d).firefly.inp (generated)

012600070.b3lyp_6-31g(d).smash.inp (generated)

012600070.b3lyp_6-31g(d).nwchem.inp (generated) 012600070.b3lyp_6-31g(d).log.xz 012600070.td-b3lyp_6-31g+(d).inp 012600070.td-b3lyp_6-31g+(d).log.xz

012600070.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600070.td-b3lyp_6-31+g(d).gjf (generated)

012600070.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600070.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600070.mol 012600070.PUBCHEM 012600070.mol (via Jmol)
012600110.b3lyp_6-31g(d).inp

012600110.b3lyp_6-31g(d).qchem.inp (generated)

012600110.b3lyp_6-31g(d).gjf (generated)

012600110.b3lyp_6-31g(d).firefly.inp (generated)

012600110.b3lyp_6-31g(d).smash.inp (generated)

012600110.b3lyp_6-31g(d).nwchem.inp (generated) 012600110.b3lyp_6-31g(d).log.xz 012600110.td-b3lyp_6-31g+(d).inp 012600110.td-b3lyp_6-31g+(d).log.xz

012600110.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600110.td-b3lyp_6-31+g(d).gjf (generated)

012600110.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600110.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600110.mol 012600110.PUBCHEM 012600110.mol (via Jmol)
012600140.b3lyp_6-31g(d).inp

012600140.b3lyp_6-31g(d).qchem.inp (generated)

012600140.b3lyp_6-31g(d).gjf (generated)

012600140.b3lyp_6-31g(d).firefly.inp (generated)

012600140.b3lyp_6-31g(d).smash.inp (generated)

012600140.b3lyp_6-31g(d).nwchem.inp (generated) 012600140.b3lyp_6-31g(d).log.xz 012600140.td-b3lyp_6-31g+(d).inp 012600140.td-b3lyp_6-31g+(d).log.xz

012600140.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600140.td-b3lyp_6-31+g(d).gjf (generated)

012600140.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600140.mol 012600140.PUBCHEM 012600140.mol (via Jmol)
012600174.b3lyp_6-31g(d).inp

012600174.b3lyp_6-31g(d).qchem.inp (generated)

012600174.b3lyp_6-31g(d).gjf (generated)

012600174.b3lyp_6-31g(d).firefly.inp (generated)

012600174.b3lyp_6-31g(d).smash.inp (generated)

012600174.b3lyp_6-31g(d).nwchem.inp (generated) 012600174.b3lyp_6-31g(d).log.xz 012600174.td-b3lyp_6-31g+(d).inp 012600174.td-b3lyp_6-31g+(d).log.xz

012600174.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600174.td-b3lyp_6-31+g(d).gjf (generated)

012600174.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600174.mol 012600174.PUBCHEM 012600174.mol (via Jmol)
012600186.b3lyp_6-31g(d).inp

012600186.b3lyp_6-31g(d).qchem.inp (generated)

012600186.b3lyp_6-31g(d).gjf (generated)

012600186.b3lyp_6-31g(d).firefly.inp (generated)

012600186.b3lyp_6-31g(d).smash.inp (generated)

012600186.b3lyp_6-31g(d).nwchem.inp (generated) 012600186.b3lyp_6-31g(d).log.xz 012600186.td-b3lyp_6-31g+(d).inp 012600186.td-b3lyp_6-31g+(d).log.xz

012600186.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600186.td-b3lyp_6-31+g(d).gjf (generated)

012600186.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600186.mol 012600186.PUBCHEM 012600186.mol (via Jmol)
012600188.b3lyp_6-31g(d).inp

012600188.b3lyp_6-31g(d).qchem.inp (generated)

012600188.b3lyp_6-31g(d).gjf (generated)

012600188.b3lyp_6-31g(d).firefly.inp (generated)

012600188.b3lyp_6-31g(d).smash.inp (generated)

012600188.b3lyp_6-31g(d).nwchem.inp (generated) 012600188.b3lyp_6-31g(d).log.xz 012600188.td-b3lyp_6-31g+(d).inp 012600188.td-b3lyp_6-31g+(d).log.xz

012600188.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600188.td-b3lyp_6-31+g(d).gjf (generated)

012600188.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600188.mol 012600188.PUBCHEM 012600188.mol (via Jmol)
012600199.b3lyp_6-31g(d).inp

012600199.b3lyp_6-31g(d).qchem.inp (generated)

012600199.b3lyp_6-31g(d).gjf (generated)

012600199.b3lyp_6-31g(d).firefly.inp (generated)

012600199.b3lyp_6-31g(d).smash.inp (generated)

012600199.b3lyp_6-31g(d).nwchem.inp (generated) 012600199.b3lyp_6-31g(d).log.xz 012600199.td-b3lyp_6-31g+(d).inp 012600199.td-b3lyp_6-31g+(d).log.xz

012600199.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600199.td-b3lyp_6-31+g(d).gjf (generated)

012600199.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600199.mol 012600199.PUBCHEM 012600199.mol (via Jmol)
012600216.b3lyp_6-31g(d).inp

012600216.b3lyp_6-31g(d).qchem.inp (generated)

012600216.b3lyp_6-31g(d).gjf (generated)

012600216.b3lyp_6-31g(d).firefly.inp (generated)

012600216.b3lyp_6-31g(d).smash.inp (generated)

012600216.b3lyp_6-31g(d).nwchem.inp (generated) 012600216.b3lyp_6-31g(d).log.xz 012600216.td-b3lyp_6-31g+(d).inp 012600216.td-b3lyp_6-31g+(d).log.xz

012600216.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600216.td-b3lyp_6-31+g(d).gjf (generated)

012600216.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600216.mol 012600216.PUBCHEM 012600216.mol (via Jmol)
012600219.b3lyp_6-31g(d).inp

012600219.b3lyp_6-31g(d).qchem.inp (generated)

012600219.b3lyp_6-31g(d).gjf (generated)

012600219.b3lyp_6-31g(d).firefly.inp (generated)

012600219.b3lyp_6-31g(d).smash.inp (generated)

012600219.b3lyp_6-31g(d).nwchem.inp (generated) 012600219.b3lyp_6-31g(d).log.xz 012600219.mol 012600219.PUBCHEM 012600219.mol (via Jmol)
012600220.b3lyp_6-31g(d).inp

012600220.b3lyp_6-31g(d).qchem.inp (generated)

012600220.b3lyp_6-31g(d).gjf (generated)

012600220.b3lyp_6-31g(d).firefly.inp (generated)

012600220.b3lyp_6-31g(d).smash.inp (generated)

012600220.b3lyp_6-31g(d).nwchem.inp (generated) 012600220.b3lyp_6-31g(d).log.xz 012600220.td-b3lyp_6-31g+(d).inp 012600220.td-b3lyp_6-31g+(d).log.xz

012600220.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600220.td-b3lyp_6-31+g(d).gjf (generated)

012600220.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600220.mol 012600220.PUBCHEM 012600220.mol (via Jmol)
012600221.b3lyp_6-31g(d).inp

012600221.b3lyp_6-31g(d).qchem.inp (generated)

012600221.b3lyp_6-31g(d).gjf (generated)

012600221.b3lyp_6-31g(d).firefly.inp (generated)

012600221.b3lyp_6-31g(d).smash.inp (generated)

012600221.b3lyp_6-31g(d).nwchem.inp (generated) 012600221.b3lyp_6-31g(d).log.xz 012600221.mol 012600221.PUBCHEM 012600221.mol (via Jmol)
012600222.b3lyp_6-31g(d).inp

012600222.b3lyp_6-31g(d).qchem.inp (generated)

012600222.b3lyp_6-31g(d).gjf (generated)

012600222.b3lyp_6-31g(d).firefly.inp (generated)

012600222.b3lyp_6-31g(d).smash.inp (generated)

012600222.b3lyp_6-31g(d).nwchem.inp (generated) 012600222.b3lyp_6-31g(d).log.xz 012600222.td-b3lyp_6-31g+(d).inp 012600222.td-b3lyp_6-31g+(d).log.xz

012600222.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600222.td-b3lyp_6-31+g(d).gjf (generated)

012600222.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600222.mol 012600222.PUBCHEM 012600222.mol (via Jmol)
012600223.b3lyp_6-31g(d).inp

012600223.b3lyp_6-31g(d).qchem.inp (generated)

012600223.b3lyp_6-31g(d).gjf (generated)

012600223.b3lyp_6-31g(d).firefly.inp (generated)

012600223.b3lyp_6-31g(d).smash.inp (generated)

012600223.b3lyp_6-31g(d).nwchem.inp (generated) 012600223.b3lyp_6-31g(d).log.xz 012600223.mol 012600223.PUBCHEM 012600223.mol (via Jmol)
012600225.b3lyp_6-31g(d).inp

012600225.b3lyp_6-31g(d).qchem.inp (generated)

012600225.b3lyp_6-31g(d).gjf (generated)

012600225.b3lyp_6-31g(d).firefly.inp (generated)

012600225.b3lyp_6-31g(d).smash.inp (generated)

012600225.b3lyp_6-31g(d).nwchem.inp (generated) 012600225.b3lyp_6-31g(d).log.xz 012600225.mol 012600225.PUBCHEM 012600225.mol (via Jmol)
012600226.b3lyp_6-31g(d).inp

012600226.b3lyp_6-31g(d).qchem.inp (generated)

012600226.b3lyp_6-31g(d).gjf (generated)

012600226.b3lyp_6-31g(d).firefly.inp (generated)

012600226.b3lyp_6-31g(d).smash.inp (generated)

012600226.b3lyp_6-31g(d).nwchem.inp (generated) 012600226.b3lyp_6-31g(d).log.xz 012600226.td-b3lyp_6-31g+(d).inp 012600226.td-b3lyp_6-31g+(d).log.xz

012600226.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600226.td-b3lyp_6-31+g(d).gjf (generated)

012600226.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600226.mol 012600226.PUBCHEM 012600226.mol (via Jmol)
012600227.b3lyp_6-31g(d).inp

012600227.b3lyp_6-31g(d).qchem.inp (generated)

012600227.b3lyp_6-31g(d).gjf (generated)

012600227.b3lyp_6-31g(d).firefly.inp (generated)

012600227.b3lyp_6-31g(d).smash.inp (generated)

012600227.b3lyp_6-31g(d).nwchem.inp (generated) 012600227.b3lyp_6-31g(d).log.xz 012600227.mol 012600227.PUBCHEM 012600227.mol (via Jmol)
012600229.b3lyp_6-31g(d).inp

012600229.b3lyp_6-31g(d).qchem.inp (generated)

012600229.b3lyp_6-31g(d).gjf (generated)

012600229.b3lyp_6-31g(d).firefly.inp (generated)

012600229.b3lyp_6-31g(d).smash.inp (generated)

012600229.b3lyp_6-31g(d).nwchem.inp (generated) 012600229.b3lyp_6-31g(d).log.xz 012600229.td-b3lyp_6-31g+(d).inp 012600229.td-b3lyp_6-31g+(d).log.xz

012600229.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600229.td-b3lyp_6-31+g(d).gjf (generated)

012600229.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600229.mol 012600229.PUBCHEM 012600229.mol (via Jmol)
012600230.b3lyp_6-31g(d).inp

012600230.b3lyp_6-31g(d).qchem.inp (generated)

012600230.b3lyp_6-31g(d).gjf (generated)

012600230.b3lyp_6-31g(d).firefly.inp (generated)

012600230.b3lyp_6-31g(d).smash.inp (generated)

012600230.b3lyp_6-31g(d).nwchem.inp (generated) 012600230.b3lyp_6-31g(d).log.xz 012600230.td-b3lyp_6-31g+(d).inp 012600230.td-b3lyp_6-31g+(d).log.xz

012600230.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600230.td-b3lyp_6-31+g(d).gjf (generated)

012600230.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600230.mol 012600230.PUBCHEM 012600230.mol (via Jmol)
012600233.b3lyp_6-31g(d).inp

012600233.b3lyp_6-31g(d).qchem.inp (generated)

012600233.b3lyp_6-31g(d).gjf (generated)

012600233.b3lyp_6-31g(d).firefly.inp (generated)

012600233.b3lyp_6-31g(d).smash.inp (generated)

012600233.b3lyp_6-31g(d).nwchem.inp (generated) 012600233.b3lyp_6-31g(d).log.xz 012600233.td-b3lyp_6-31g+(d).inp 012600233.td-b3lyp_6-31g+(d).log.xz

012600233.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600233.td-b3lyp_6-31+g(d).gjf (generated)

012600233.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600233.mol 012600233.PUBCHEM 012600233.mol (via Jmol)
012600236.b3lyp_6-31g(d).inp

012600236.b3lyp_6-31g(d).qchem.inp (generated)

012600236.b3lyp_6-31g(d).gjf (generated)

012600236.b3lyp_6-31g(d).firefly.inp (generated)

012600236.b3lyp_6-31g(d).smash.inp (generated)

012600236.b3lyp_6-31g(d).nwchem.inp (generated) 012600236.b3lyp_6-31g(d).log.xz 012600236.td-b3lyp_6-31g+(d).inp 012600236.td-b3lyp_6-31g+(d).log.xz

012600236.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600236.td-b3lyp_6-31+g(d).gjf (generated)

012600236.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600236.mol 012600236.PUBCHEM 012600236.mol (via Jmol)
012600244.b3lyp_6-31g(d).inp

012600244.b3lyp_6-31g(d).qchem.inp (generated)

012600244.b3lyp_6-31g(d).gjf (generated)

012600244.b3lyp_6-31g(d).firefly.inp (generated)

012600244.b3lyp_6-31g(d).smash.inp (generated)

012600244.b3lyp_6-31g(d).nwchem.inp (generated) 012600244.b3lyp_6-31g(d).log.xz 012600244.td-b3lyp_6-31g+(d).inp 012600244.td-b3lyp_6-31g+(d).log.xz

012600244.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600244.td-b3lyp_6-31+g(d).gjf (generated)

012600244.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600244.mol 012600244.PUBCHEM 012600244.mol (via Jmol)
012600278.b3lyp_6-31g(d).inp

012600278.b3lyp_6-31g(d).qchem.inp (generated)

012600278.b3lyp_6-31g(d).gjf (generated)

012600278.b3lyp_6-31g(d).firefly.inp (generated)

012600278.b3lyp_6-31g(d).smash.inp (generated)

012600278.b3lyp_6-31g(d).nwchem.inp (generated) 012600278.b3lyp_6-31g(d).log.xz 012600278.td-b3lyp_6-31g+(d).inp 012600278.td-b3lyp_6-31g+(d).log.xz

012600278.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600278.td-b3lyp_6-31+g(d).gjf (generated)

012600278.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600278.mol 012600278.PUBCHEM 012600278.mol (via Jmol)
012600279.b3lyp_6-31g(d).inp

012600279.b3lyp_6-31g(d).qchem.inp (generated)

012600279.b3lyp_6-31g(d).gjf (generated)

012600279.b3lyp_6-31g(d).firefly.inp (generated)

012600279.b3lyp_6-31g(d).smash.inp (generated)

012600279.b3lyp_6-31g(d).nwchem.inp (generated) 012600279.b3lyp_6-31g(d).log.xz 012600279.td-b3lyp_6-31g+(d).inp 012600279.td-b3lyp_6-31g+(d).log.xz

012600279.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600279.td-b3lyp_6-31+g(d).gjf (generated)

012600279.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600279.mol 012600279.PUBCHEM 012600279.mol (via Jmol)
012600283.b3lyp_6-31g(d).inp

012600283.b3lyp_6-31g(d).qchem.inp (generated)

012600283.b3lyp_6-31g(d).gjf (generated)

012600283.b3lyp_6-31g(d).firefly.inp (generated)

012600283.b3lyp_6-31g(d).smash.inp (generated)

012600283.b3lyp_6-31g(d).nwchem.inp (generated) 012600283.b3lyp_6-31g(d).log.xz 012600283.td-b3lyp_6-31g+(d).inp 012600283.td-b3lyp_6-31g+(d).log.xz

012600283.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600283.td-b3lyp_6-31+g(d).gjf (generated)

012600283.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600283.mol 012600283.PUBCHEM 012600283.mol (via Jmol)
012600285.b3lyp_6-31g(d).inp

012600285.b3lyp_6-31g(d).qchem.inp (generated)

012600285.b3lyp_6-31g(d).gjf (generated)

012600285.b3lyp_6-31g(d).firefly.inp (generated)

012600285.b3lyp_6-31g(d).smash.inp (generated)

012600285.b3lyp_6-31g(d).nwchem.inp (generated) 012600285.b3lyp_6-31g(d).log.xz 012600285.td-b3lyp_6-31g+(d).inp 012600285.td-b3lyp_6-31g+(d).log.xz

012600285.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600285.td-b3lyp_6-31+g(d).gjf (generated)

012600285.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600285.mol 012600285.PUBCHEM 012600285.mol (via Jmol)
012600289.b3lyp_6-31g(d).inp

012600289.b3lyp_6-31g(d).qchem.inp (generated)

012600289.b3lyp_6-31g(d).gjf (generated)

012600289.b3lyp_6-31g(d).firefly.inp (generated)

012600289.b3lyp_6-31g(d).smash.inp (generated)

012600289.b3lyp_6-31g(d).nwchem.inp (generated) 012600289.b3lyp_6-31g(d).log.xz 012600289.td-b3lyp_6-31g+(d).inp 012600289.td-b3lyp_6-31g+(d).log.xz

012600289.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600289.td-b3lyp_6-31+g(d).gjf (generated)

012600289.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600289.mol 012600289.PUBCHEM 012600289.mol (via Jmol)
012600290.b3lyp_6-31g(d).inp

012600290.b3lyp_6-31g(d).qchem.inp (generated)

012600290.b3lyp_6-31g(d).gjf (generated)

012600290.b3lyp_6-31g(d).firefly.inp (generated)

012600290.b3lyp_6-31g(d).smash.inp (generated)

012600290.b3lyp_6-31g(d).nwchem.inp (generated) 012600290.b3lyp_6-31g(d).log.xz 012600290.td-b3lyp_6-31g+(d).inp 012600290.td-b3lyp_6-31g+(d).log.xz

012600290.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600290.td-b3lyp_6-31+g(d).gjf (generated)

012600290.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600290.mol 012600290.PUBCHEM 012600290.mol (via Jmol)
012600291.b3lyp_6-31g(d).inp

012600291.b3lyp_6-31g(d).qchem.inp (generated)

012600291.b3lyp_6-31g(d).gjf (generated)

012600291.b3lyp_6-31g(d).firefly.inp (generated)

012600291.b3lyp_6-31g(d).smash.inp (generated)

012600291.b3lyp_6-31g(d).nwchem.inp (generated) 012600291.b3lyp_6-31g(d).log.xz 012600291.td-b3lyp_6-31g+(d).inp 012600291.td-b3lyp_6-31g+(d).log.xz

012600291.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600291.td-b3lyp_6-31+g(d).gjf (generated)

012600291.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600291.mol 012600291.PUBCHEM 012600291.mol (via Jmol)
012600292.b3lyp_6-31g(d).inp

012600292.b3lyp_6-31g(d).qchem.inp (generated)

012600292.b3lyp_6-31g(d).gjf (generated)

012600292.b3lyp_6-31g(d).firefly.inp (generated)

012600292.b3lyp_6-31g(d).smash.inp (generated)

012600292.b3lyp_6-31g(d).nwchem.inp (generated) 012600292.b3lyp_6-31g(d).log.xz 012600292.td-b3lyp_6-31g+(d).inp 012600292.td-b3lyp_6-31g+(d).log.xz

012600292.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600292.td-b3lyp_6-31+g(d).gjf (generated)

012600292.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600292.mol 012600292.PUBCHEM 012600292.mol (via Jmol)
012600293.b3lyp_6-31g(d).inp

012600293.b3lyp_6-31g(d).qchem.inp (generated)

012600293.b3lyp_6-31g(d).gjf (generated)

012600293.b3lyp_6-31g(d).firefly.inp (generated)

012600293.b3lyp_6-31g(d).smash.inp (generated)

012600293.b3lyp_6-31g(d).nwchem.inp (generated) 012600293.b3lyp_6-31g(d).log.xz 012600293.td-b3lyp_6-31g+(d).inp 012600293.td-b3lyp_6-31g+(d).log.xz

012600293.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600293.td-b3lyp_6-31+g(d).gjf (generated)

012600293.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600293.mol 012600293.PUBCHEM 012600293.mol (via Jmol)
012600294.b3lyp_6-31g(d).inp

012600294.b3lyp_6-31g(d).qchem.inp (generated)

012600294.b3lyp_6-31g(d).gjf (generated)

012600294.b3lyp_6-31g(d).firefly.inp (generated)

012600294.b3lyp_6-31g(d).smash.inp (generated)

012600294.b3lyp_6-31g(d).nwchem.inp (generated) 012600294.b3lyp_6-31g(d).log.xz 012600294.td-b3lyp_6-31g+(d).inp 012600294.td-b3lyp_6-31g+(d).log.xz

012600294.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600294.td-b3lyp_6-31+g(d).gjf (generated)

012600294.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600294.mol 012600294.PUBCHEM 012600294.mol (via Jmol)
012600295.b3lyp_6-31g(d).inp

012600295.b3lyp_6-31g(d).qchem.inp (generated)

012600295.b3lyp_6-31g(d).gjf (generated)

012600295.b3lyp_6-31g(d).firefly.inp (generated)

012600295.b3lyp_6-31g(d).smash.inp (generated)

012600295.b3lyp_6-31g(d).nwchem.inp (generated) 012600295.b3lyp_6-31g(d).log.xz 012600295.td-b3lyp_6-31g+(d).inp 012600295.td-b3lyp_6-31g+(d).log.xz

012600295.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600295.td-b3lyp_6-31+g(d).gjf (generated)

012600295.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600295.mol 012600295.PUBCHEM 012600295.mol (via Jmol)
012600296.b3lyp_6-31g(d).inp

012600296.b3lyp_6-31g(d).qchem.inp (generated)

012600296.b3lyp_6-31g(d).gjf (generated)

012600296.b3lyp_6-31g(d).firefly.inp (generated)

012600296.b3lyp_6-31g(d).smash.inp (generated)

012600296.b3lyp_6-31g(d).nwchem.inp (generated) 012600296.b3lyp_6-31g(d).log.xz 012600296.td-b3lyp_6-31g+(d).inp 012600296.td-b3lyp_6-31g+(d).log.xz

012600296.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600296.td-b3lyp_6-31+g(d).gjf (generated)

012600296.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600296.mol 012600296.PUBCHEM 012600296.mol (via Jmol)
012600297.b3lyp_6-31g(d).inp

012600297.b3lyp_6-31g(d).qchem.inp (generated)

012600297.b3lyp_6-31g(d).gjf (generated)

012600297.b3lyp_6-31g(d).firefly.inp (generated)

012600297.b3lyp_6-31g(d).smash.inp (generated)

012600297.b3lyp_6-31g(d).nwchem.inp (generated) 012600297.b3lyp_6-31g(d).log.xz 012600297.td-b3lyp_6-31g+(d).inp 012600297.td-b3lyp_6-31g+(d).log.xz

012600297.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600297.td-b3lyp_6-31+g(d).gjf (generated)

012600297.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600297.mol 012600297.PUBCHEM 012600297.mol (via Jmol)
012600298.b3lyp_6-31g(d).inp

012600298.b3lyp_6-31g(d).qchem.inp (generated)

012600298.b3lyp_6-31g(d).gjf (generated)

012600298.b3lyp_6-31g(d).firefly.inp (generated)

012600298.b3lyp_6-31g(d).smash.inp (generated)

012600298.b3lyp_6-31g(d).nwchem.inp (generated) 012600298.b3lyp_6-31g(d).log.xz 012600298.td-b3lyp_6-31g+(d).inp 012600298.td-b3lyp_6-31g+(d).log.xz

012600298.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600298.td-b3lyp_6-31+g(d).gjf (generated)

012600298.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600298.mol 012600298.PUBCHEM 012600298.mol (via Jmol)
012600299.b3lyp_6-31g(d).inp

012600299.b3lyp_6-31g(d).qchem.inp (generated)

012600299.b3lyp_6-31g(d).gjf (generated)

012600299.b3lyp_6-31g(d).firefly.inp (generated)

012600299.b3lyp_6-31g(d).smash.inp (generated)

012600299.b3lyp_6-31g(d).nwchem.inp (generated) 012600299.b3lyp_6-31g(d).log.xz 012600299.td-b3lyp_6-31g+(d).inp 012600299.td-b3lyp_6-31g+(d).log.xz

012600299.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600299.td-b3lyp_6-31+g(d).gjf (generated)

012600299.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600299.mol 012600299.PUBCHEM 012600299.mol (via Jmol)
012600300.b3lyp_6-31g(d).inp

012600300.b3lyp_6-31g(d).qchem.inp (generated)

012600300.b3lyp_6-31g(d).gjf (generated)

012600300.b3lyp_6-31g(d).firefly.inp (generated)

012600300.b3lyp_6-31g(d).smash.inp (generated)

012600300.b3lyp_6-31g(d).nwchem.inp (generated) 012600300.b3lyp_6-31g(d).log.xz 012600300.td-b3lyp_6-31g+(d).inp 012600300.td-b3lyp_6-31g+(d).log.xz

012600300.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600300.td-b3lyp_6-31+g(d).gjf (generated)

012600300.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600300.mol 012600300.PUBCHEM 012600300.mol (via Jmol)
012600303.b3lyp_6-31g(d).inp

012600303.b3lyp_6-31g(d).qchem.inp (generated)

012600303.b3lyp_6-31g(d).gjf (generated)

012600303.b3lyp_6-31g(d).firefly.inp (generated)

012600303.b3lyp_6-31g(d).smash.inp (generated)

012600303.b3lyp_6-31g(d).nwchem.inp (generated) 012600303.b3lyp_6-31g(d).log.xz 012600303.td-b3lyp_6-31g+(d).inp 012600303.td-b3lyp_6-31g+(d).log.xz

012600303.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600303.td-b3lyp_6-31+g(d).gjf (generated)

012600303.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600303.mol 012600303.PUBCHEM 012600303.mol (via Jmol)
012600304.b3lyp_6-31g(d).inp

012600304.b3lyp_6-31g(d).qchem.inp (generated)

012600304.b3lyp_6-31g(d).gjf (generated)

012600304.b3lyp_6-31g(d).firefly.inp (generated)

012600304.b3lyp_6-31g(d).smash.inp (generated)

012600304.b3lyp_6-31g(d).nwchem.inp (generated) 012600304.b3lyp_6-31g(d).log.xz 012600304.td-b3lyp_6-31g+(d).inp 012600304.td-b3lyp_6-31g+(d).log.xz

012600304.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600304.td-b3lyp_6-31+g(d).gjf (generated)

012600304.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600304.mol 012600304.PUBCHEM 012600304.mol (via Jmol)
012600348.b3lyp_6-31g(d).inp

012600348.b3lyp_6-31g(d).qchem.inp (generated)

012600348.b3lyp_6-31g(d).gjf (generated)

012600348.b3lyp_6-31g(d).firefly.inp (generated)

012600348.b3lyp_6-31g(d).smash.inp (generated)

012600348.b3lyp_6-31g(d).nwchem.inp (generated) 012600348.b3lyp_6-31g(d).log.xz 012600348.td-b3lyp_6-31g+(d).inp 012600348.td-b3lyp_6-31g+(d).log.xz

012600348.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600348.td-b3lyp_6-31+g(d).gjf (generated)

012600348.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600348.mol 012600348.PUBCHEM 012600348.mol (via Jmol)
012600351.b3lyp_6-31g(d).inp

012600351.b3lyp_6-31g(d).qchem.inp (generated)

012600351.b3lyp_6-31g(d).gjf (generated)

012600351.b3lyp_6-31g(d).firefly.inp (generated)

012600351.b3lyp_6-31g(d).smash.inp (generated)

012600351.b3lyp_6-31g(d).nwchem.inp (generated) 012600351.b3lyp_6-31g(d).log.xz 012600351.td-b3lyp_6-31g+(d).inp 012600351.td-b3lyp_6-31g+(d).log.xz

012600351.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600351.td-b3lyp_6-31+g(d).gjf (generated)

012600351.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600351.mol 012600351.PUBCHEM 012600351.mol (via Jmol)
012600362.b3lyp_6-31g(d).inp

012600362.b3lyp_6-31g(d).qchem.inp (generated)

012600362.b3lyp_6-31g(d).gjf (generated)

012600362.b3lyp_6-31g(d).firefly.inp (generated)

012600362.b3lyp_6-31g(d).smash.inp (generated)

012600362.b3lyp_6-31g(d).nwchem.inp (generated) 012600362.b3lyp_6-31g(d).log.xz 012600362.td-b3lyp_6-31g+(d).inp 012600362.td-b3lyp_6-31g+(d).log.xz

012600362.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600362.td-b3lyp_6-31+g(d).gjf (generated)

012600362.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600362.mol 012600362.PUBCHEM 012600362.mol (via Jmol)
012600363.b3lyp_6-31g(d).inp

012600363.b3lyp_6-31g(d).qchem.inp (generated)

012600363.b3lyp_6-31g(d).gjf (generated)

012600363.b3lyp_6-31g(d).firefly.inp (generated)

012600363.b3lyp_6-31g(d).smash.inp (generated)

012600363.b3lyp_6-31g(d).nwchem.inp (generated) 012600363.b3lyp_6-31g(d).log.xz 012600363.td-b3lyp_6-31g+(d).inp 012600363.td-b3lyp_6-31g+(d).log.xz

012600363.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600363.td-b3lyp_6-31+g(d).gjf (generated)

012600363.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600363.mol 012600363.PUBCHEM 012600363.mol (via Jmol)
012600365.b3lyp_6-31g(d).inp

012600365.b3lyp_6-31g(d).qchem.inp (generated)

012600365.b3lyp_6-31g(d).gjf (generated)

012600365.b3lyp_6-31g(d).firefly.inp (generated)

012600365.b3lyp_6-31g(d).smash.inp (generated)

012600365.b3lyp_6-31g(d).nwchem.inp (generated) 012600365.b3lyp_6-31g(d).log.xz 012600365.td-b3lyp_6-31g+(d).inp 012600365.td-b3lyp_6-31g+(d).log.xz

012600365.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600365.td-b3lyp_6-31+g(d).gjf (generated)

012600365.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600365.mol 012600365.PUBCHEM 012600365.mol (via Jmol)
012600366.b3lyp_6-31g(d).inp

012600366.b3lyp_6-31g(d).qchem.inp (generated)

012600366.b3lyp_6-31g(d).gjf (generated)

012600366.b3lyp_6-31g(d).firefly.inp (generated)

012600366.b3lyp_6-31g(d).smash.inp (generated)

012600366.b3lyp_6-31g(d).nwchem.inp (generated) 012600366.b3lyp_6-31g(d).log.xz 012600366.td-b3lyp_6-31g+(d).inp 012600366.td-b3lyp_6-31g+(d).log.xz

012600366.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600366.td-b3lyp_6-31+g(d).gjf (generated)

012600366.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600366.mol 012600366.PUBCHEM 012600366.mol (via Jmol)
012600367.b3lyp_6-31g(d).inp

012600367.b3lyp_6-31g(d).qchem.inp (generated)

012600367.b3lyp_6-31g(d).gjf (generated)

012600367.b3lyp_6-31g(d).firefly.inp (generated)

012600367.b3lyp_6-31g(d).smash.inp (generated)

012600367.b3lyp_6-31g(d).nwchem.inp (generated) 012600367.b3lyp_6-31g(d).log.xz 012600367.td-b3lyp_6-31g+(d).inp 012600367.td-b3lyp_6-31g+(d).log.xz

012600367.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600367.td-b3lyp_6-31+g(d).gjf (generated)

012600367.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600367.mol 012600367.PUBCHEM 012600367.mol (via Jmol)
012600369.b3lyp_6-31g(d).inp

012600369.b3lyp_6-31g(d).qchem.inp (generated)

012600369.b3lyp_6-31g(d).gjf (generated)

012600369.b3lyp_6-31g(d).firefly.inp (generated)

012600369.b3lyp_6-31g(d).smash.inp (generated)

012600369.b3lyp_6-31g(d).nwchem.inp (generated) 012600369.b3lyp_6-31g(d).log.xz 012600369.td-b3lyp_6-31g+(d).inp 012600369.td-b3lyp_6-31g+(d).log.xz

012600369.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600369.td-b3lyp_6-31+g(d).gjf (generated)

012600369.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600369.mol 012600369.PUBCHEM 012600369.mol (via Jmol)
012600370.b3lyp_6-31g(d).inp

012600370.b3lyp_6-31g(d).qchem.inp (generated)

012600370.b3lyp_6-31g(d).gjf (generated)

012600370.b3lyp_6-31g(d).firefly.inp (generated)

012600370.b3lyp_6-31g(d).smash.inp (generated)

012600370.b3lyp_6-31g(d).nwchem.inp (generated) 012600370.b3lyp_6-31g(d).log.xz 012600370.td-b3lyp_6-31g+(d).inp 012600370.td-b3lyp_6-31g+(d).log.xz

012600370.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600370.td-b3lyp_6-31+g(d).gjf (generated)

012600370.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600370.mol 012600370.PUBCHEM 012600370.mol (via Jmol)
012600378.b3lyp_6-31g(d).inp

012600378.b3lyp_6-31g(d).qchem.inp (generated)

012600378.b3lyp_6-31g(d).gjf (generated)

012600378.b3lyp_6-31g(d).firefly.inp (generated)

012600378.b3lyp_6-31g(d).smash.inp (generated)

012600378.b3lyp_6-31g(d).nwchem.inp (generated) 012600378.b3lyp_6-31g(d).log.xz 012600378.td-b3lyp_6-31g+(d).inp 012600378.td-b3lyp_6-31g+(d).log.xz

012600378.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600378.td-b3lyp_6-31+g(d).gjf (generated)

012600378.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600378.mol 012600378.PUBCHEM 012600378.mol (via Jmol)
012600379.b3lyp_6-31g(d).inp

012600379.b3lyp_6-31g(d).qchem.inp (generated)

012600379.b3lyp_6-31g(d).gjf (generated)

012600379.b3lyp_6-31g(d).firefly.inp (generated)

012600379.b3lyp_6-31g(d).smash.inp (generated)

012600379.b3lyp_6-31g(d).nwchem.inp (generated) 012600379.b3lyp_6-31g(d).log.xz 012600379.td-b3lyp_6-31g+(d).inp 012600379.td-b3lyp_6-31g+(d).log.xz

012600379.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600379.td-b3lyp_6-31+g(d).gjf (generated)

012600379.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600379.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600379.mol 012600379.PUBCHEM 012600379.mol (via Jmol)
012600380.b3lyp_6-31g(d).inp

012600380.b3lyp_6-31g(d).qchem.inp (generated)

012600380.b3lyp_6-31g(d).gjf (generated)

012600380.b3lyp_6-31g(d).firefly.inp (generated)

012600380.b3lyp_6-31g(d).smash.inp (generated)

012600380.b3lyp_6-31g(d).nwchem.inp (generated) 012600380.b3lyp_6-31g(d).log.xz 012600380.td-b3lyp_6-31g+(d).inp 012600380.td-b3lyp_6-31g+(d).log.xz

012600380.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600380.td-b3lyp_6-31+g(d).gjf (generated)

012600380.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600380.mol 012600380.PUBCHEM 012600380.mol (via Jmol)
012600381.b3lyp_6-31g(d).inp

012600381.b3lyp_6-31g(d).qchem.inp (generated)

012600381.b3lyp_6-31g(d).gjf (generated)

012600381.b3lyp_6-31g(d).firefly.inp (generated)

012600381.b3lyp_6-31g(d).smash.inp (generated)

012600381.b3lyp_6-31g(d).nwchem.inp (generated) 012600381.b3lyp_6-31g(d).log.xz 012600381.td-b3lyp_6-31g+(d).inp 012600381.td-b3lyp_6-31g+(d).log.xz

012600381.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600381.td-b3lyp_6-31+g(d).gjf (generated)

012600381.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600381.mol 012600381.PUBCHEM 012600381.mol (via Jmol)
012600384.b3lyp_6-31g(d).inp

012600384.b3lyp_6-31g(d).qchem.inp (generated)

012600384.b3lyp_6-31g(d).gjf (generated)

012600384.b3lyp_6-31g(d).firefly.inp (generated)

012600384.b3lyp_6-31g(d).smash.inp (generated)

012600384.b3lyp_6-31g(d).nwchem.inp (generated) 012600384.b3lyp_6-31g(d).log.xz 012600384.td-b3lyp_6-31g+(d).inp 012600384.td-b3lyp_6-31g+(d).log.xz

012600384.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600384.td-b3lyp_6-31+g(d).gjf (generated)

012600384.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600384.mol 012600384.PUBCHEM 012600384.mol (via Jmol)
012600385.b3lyp_6-31g(d).inp

012600385.b3lyp_6-31g(d).qchem.inp (generated)

012600385.b3lyp_6-31g(d).gjf (generated)

012600385.b3lyp_6-31g(d).firefly.inp (generated)

012600385.b3lyp_6-31g(d).smash.inp (generated)

012600385.b3lyp_6-31g(d).nwchem.inp (generated) 012600385.b3lyp_6-31g(d).log.xz 012600385.td-b3lyp_6-31g+(d).inp 012600385.td-b3lyp_6-31g+(d).log.xz

012600385.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600385.td-b3lyp_6-31+g(d).gjf (generated)

012600385.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600385.mol 012600385.PUBCHEM 012600385.mol (via Jmol)
012600386.b3lyp_6-31g(d).inp

012600386.b3lyp_6-31g(d).qchem.inp (generated)

012600386.b3lyp_6-31g(d).gjf (generated)

012600386.b3lyp_6-31g(d).firefly.inp (generated)

012600386.b3lyp_6-31g(d).smash.inp (generated)

012600386.b3lyp_6-31g(d).nwchem.inp (generated) 012600386.b3lyp_6-31g(d).log.xz 012600386.td-b3lyp_6-31g+(d).inp 012600386.td-b3lyp_6-31g+(d).log.xz

012600386.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600386.td-b3lyp_6-31+g(d).gjf (generated)

012600386.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600386.mol 012600386.PUBCHEM 012600386.mol (via Jmol)
012600387.b3lyp_6-31g(d).inp

012600387.b3lyp_6-31g(d).qchem.inp (generated)

012600387.b3lyp_6-31g(d).gjf (generated)

012600387.b3lyp_6-31g(d).firefly.inp (generated)

012600387.b3lyp_6-31g(d).smash.inp (generated)

012600387.b3lyp_6-31g(d).nwchem.inp (generated) 012600387.b3lyp_6-31g(d).log.xz 012600387.td-b3lyp_6-31g+(d).inp 012600387.td-b3lyp_6-31g+(d).log.xz

012600387.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600387.td-b3lyp_6-31+g(d).gjf (generated)

012600387.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600387.mol 012600387.PUBCHEM 012600387.mol (via Jmol)
012600388.b3lyp_6-31g(d).inp

012600388.b3lyp_6-31g(d).qchem.inp (generated)

012600388.b3lyp_6-31g(d).gjf (generated)

012600388.b3lyp_6-31g(d).firefly.inp (generated)

012600388.b3lyp_6-31g(d).smash.inp (generated)

012600388.b3lyp_6-31g(d).nwchem.inp (generated) 012600388.b3lyp_6-31g(d).log.xz 012600388.td-b3lyp_6-31g+(d).inp 012600388.td-b3lyp_6-31g+(d).log.xz

012600388.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600388.td-b3lyp_6-31+g(d).gjf (generated)

012600388.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600388.mol 012600388.PUBCHEM 012600388.mol (via Jmol)
012600389.b3lyp_6-31g(d).inp

012600389.b3lyp_6-31g(d).qchem.inp (generated)

012600389.b3lyp_6-31g(d).gjf (generated)

012600389.b3lyp_6-31g(d).firefly.inp (generated)

012600389.b3lyp_6-31g(d).smash.inp (generated)

012600389.b3lyp_6-31g(d).nwchem.inp (generated) 012600389.b3lyp_6-31g(d).log.xz 012600389.td-b3lyp_6-31g+(d).inp 012600389.td-b3lyp_6-31g+(d).log.xz

012600389.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600389.td-b3lyp_6-31+g(d).gjf (generated)

012600389.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600389.mol 012600389.PUBCHEM 012600389.mol (via Jmol)
012600390.b3lyp_6-31g(d).inp

012600390.b3lyp_6-31g(d).qchem.inp (generated)

012600390.b3lyp_6-31g(d).gjf (generated)

012600390.b3lyp_6-31g(d).firefly.inp (generated)

012600390.b3lyp_6-31g(d).smash.inp (generated)

012600390.b3lyp_6-31g(d).nwchem.inp (generated) 012600390.b3lyp_6-31g(d).log.xz 012600390.td-b3lyp_6-31g+(d).inp 012600390.td-b3lyp_6-31g+(d).log.xz

012600390.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600390.td-b3lyp_6-31+g(d).gjf (generated)

012600390.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600390.mol 012600390.PUBCHEM 012600390.mol (via Jmol)
012600391.b3lyp_6-31g(d).inp

012600391.b3lyp_6-31g(d).qchem.inp (generated)

012600391.b3lyp_6-31g(d).gjf (generated)

012600391.b3lyp_6-31g(d).firefly.inp (generated)

012600391.b3lyp_6-31g(d).smash.inp (generated)

012600391.b3lyp_6-31g(d).nwchem.inp (generated) 012600391.b3lyp_6-31g(d).log.xz 012600391.td-b3lyp_6-31g+(d).inp 012600391.td-b3lyp_6-31g+(d).log.xz

012600391.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600391.td-b3lyp_6-31+g(d).gjf (generated)

012600391.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600391.mol 012600391.PUBCHEM 012600391.mol (via Jmol)
012600392.b3lyp_6-31g(d).inp

012600392.b3lyp_6-31g(d).qchem.inp (generated)

012600392.b3lyp_6-31g(d).gjf (generated)

012600392.b3lyp_6-31g(d).firefly.inp (generated)

012600392.b3lyp_6-31g(d).smash.inp (generated)

012600392.b3lyp_6-31g(d).nwchem.inp (generated) 012600392.b3lyp_6-31g(d).log.xz 012600392.td-b3lyp_6-31g+(d).inp 012600392.td-b3lyp_6-31g+(d).log.xz

012600392.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600392.td-b3lyp_6-31+g(d).gjf (generated)

012600392.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600392.mol 012600392.PUBCHEM 012600392.mol (via Jmol)
012600448.b3lyp_6-31g(d).inp

012600448.b3lyp_6-31g(d).qchem.inp (generated)

012600448.b3lyp_6-31g(d).gjf (generated)

012600448.b3lyp_6-31g(d).firefly.inp (generated)

012600448.b3lyp_6-31g(d).smash.inp (generated)

012600448.b3lyp_6-31g(d).nwchem.inp (generated) 012600448.b3lyp_6-31g(d).log.xz 012600448.td-b3lyp_6-31g+(d).inp 012600448.td-b3lyp_6-31g+(d).log.xz

012600448.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600448.td-b3lyp_6-31+g(d).gjf (generated)

012600448.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600448.mol 012600448.PUBCHEM 012600448.mol (via Jmol)
012600450.b3lyp_6-31g(d).inp

012600450.b3lyp_6-31g(d).qchem.inp (generated)

012600450.b3lyp_6-31g(d).gjf (generated)

012600450.b3lyp_6-31g(d).firefly.inp (generated)

012600450.b3lyp_6-31g(d).smash.inp (generated)

012600450.b3lyp_6-31g(d).nwchem.inp (generated) 012600450.b3lyp_6-31g(d).log.xz 012600450.td-b3lyp_6-31g+(d).inp 012600450.td-b3lyp_6-31g+(d).log.xz

012600450.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600450.td-b3lyp_6-31+g(d).gjf (generated)

012600450.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600450.mol 012600450.PUBCHEM 012600450.mol (via Jmol)
012600454.b3lyp_6-31g(d).inp

012600454.b3lyp_6-31g(d).qchem.inp (generated)

012600454.b3lyp_6-31g(d).gjf (generated)

012600454.b3lyp_6-31g(d).firefly.inp (generated)

012600454.b3lyp_6-31g(d).smash.inp (generated)

012600454.b3lyp_6-31g(d).nwchem.inp (generated) 012600454.b3lyp_6-31g(d).log.xz 012600454.td-b3lyp_6-31g+(d).inp 012600454.td-b3lyp_6-31g+(d).log.xz

012600454.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600454.td-b3lyp_6-31+g(d).gjf (generated)

012600454.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600454.mol 012600454.PUBCHEM 012600454.mol (via Jmol)
012600491.b3lyp_6-31g(d).inp

012600491.b3lyp_6-31g(d).qchem.inp (generated)

012600491.b3lyp_6-31g(d).gjf (generated)

012600491.b3lyp_6-31g(d).firefly.inp (generated)

012600491.b3lyp_6-31g(d).smash.inp (generated)

012600491.b3lyp_6-31g(d).nwchem.inp (generated) 012600491.b3lyp_6-31g(d).log.xz 012600491.mol 012600491.PUBCHEM 012600491.mol (via Jmol)
012600504.b3lyp_6-31g(d).inp

012600504.b3lyp_6-31g(d).qchem.inp (generated)

012600504.b3lyp_6-31g(d).gjf (generated)

012600504.b3lyp_6-31g(d).firefly.inp (generated)

012600504.b3lyp_6-31g(d).smash.inp (generated)

012600504.b3lyp_6-31g(d).nwchem.inp (generated) 012600504.b3lyp_6-31g(d).log.xz 012600504.td-b3lyp_6-31g+(d).inp 012600504.td-b3lyp_6-31g+(d).log.xz

012600504.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600504.td-b3lyp_6-31+g(d).gjf (generated)

012600504.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600504.mol 012600504.PUBCHEM 012600504.mol (via Jmol)
012600509.b3lyp_6-31g(d).inp

012600509.b3lyp_6-31g(d).qchem.inp (generated)

012600509.b3lyp_6-31g(d).gjf (generated)

012600509.b3lyp_6-31g(d).firefly.inp (generated)

012600509.b3lyp_6-31g(d).smash.inp (generated)

012600509.b3lyp_6-31g(d).nwchem.inp (generated) 012600509.b3lyp_6-31g(d).log.xz 012600509.td-b3lyp_6-31g+(d).inp 012600509.td-b3lyp_6-31g+(d).log.xz

012600509.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600509.td-b3lyp_6-31+g(d).gjf (generated)

012600509.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600509.mol 012600509.PUBCHEM 012600509.mol (via Jmol)
012600511.b3lyp_6-31g(d).inp

012600511.b3lyp_6-31g(d).qchem.inp (generated)

012600511.b3lyp_6-31g(d).gjf (generated)

012600511.b3lyp_6-31g(d).firefly.inp (generated)

012600511.b3lyp_6-31g(d).smash.inp (generated)

012600511.b3lyp_6-31g(d).nwchem.inp (generated) 012600511.b3lyp_6-31g(d).log.xz 012600511.td-b3lyp_6-31g+(d).inp 012600511.td-b3lyp_6-31g+(d).log.xz

012600511.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600511.td-b3lyp_6-31+g(d).gjf (generated)

012600511.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600511.mol 012600511.PUBCHEM 012600511.mol (via Jmol)
012600517.b3lyp_6-31g(d).inp

012600517.b3lyp_6-31g(d).qchem.inp (generated)

012600517.b3lyp_6-31g(d).gjf (generated)

012600517.b3lyp_6-31g(d).firefly.inp (generated)

012600517.b3lyp_6-31g(d).smash.inp (generated)

012600517.b3lyp_6-31g(d).nwchem.inp (generated) 012600517.b3lyp_6-31g(d).log.xz 012600517.td-b3lyp_6-31g+(d).inp 012600517.td-b3lyp_6-31g+(d).log.xz

012600517.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600517.td-b3lyp_6-31+g(d).gjf (generated)

012600517.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600517.mol 012600517.PUBCHEM 012600517.mol (via Jmol)
012600526.b3lyp_6-31g(d).inp

012600526.b3lyp_6-31g(d).qchem.inp (generated)

012600526.b3lyp_6-31g(d).gjf (generated)

012600526.b3lyp_6-31g(d).firefly.inp (generated)

012600526.b3lyp_6-31g(d).smash.inp (generated)

012600526.b3lyp_6-31g(d).nwchem.inp (generated) 012600526.b3lyp_6-31g(d).log.xz 012600526.td-b3lyp_6-31g+(d).inp 012600526.td-b3lyp_6-31g+(d).log.xz

012600526.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600526.td-b3lyp_6-31+g(d).gjf (generated)

012600526.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600526.mol 012600526.PUBCHEM 012600526.mol (via Jmol)
012600528.b3lyp_6-31g(d).inp

012600528.b3lyp_6-31g(d).qchem.inp (generated)

012600528.b3lyp_6-31g(d).gjf (generated)

012600528.b3lyp_6-31g(d).firefly.inp (generated)

012600528.b3lyp_6-31g(d).smash.inp (generated)

012600528.b3lyp_6-31g(d).nwchem.inp (generated) 012600528.b3lyp_6-31g(d).log.xz 012600528.td-b3lyp_6-31g+(d).inp 012600528.td-b3lyp_6-31g+(d).log.xz

012600528.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600528.td-b3lyp_6-31+g(d).gjf (generated)

012600528.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600528.mol 012600528.PUBCHEM 012600528.mol (via Jmol)
012600530.b3lyp_6-31g(d).inp

012600530.b3lyp_6-31g(d).qchem.inp (generated)

012600530.b3lyp_6-31g(d).gjf (generated)

012600530.b3lyp_6-31g(d).firefly.inp (generated)

012600530.b3lyp_6-31g(d).smash.inp (generated)

012600530.b3lyp_6-31g(d).nwchem.inp (generated) 012600530.b3lyp_6-31g(d).log.xz 012600530.td-b3lyp_6-31g+(d).inp 012600530.td-b3lyp_6-31g+(d).log.xz

012600530.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600530.td-b3lyp_6-31+g(d).gjf (generated)

012600530.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600530.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600530.mol 012600530.PUBCHEM 012600530.mol (via Jmol)
012600547.b3lyp_6-31g(d).inp

012600547.b3lyp_6-31g(d).qchem.inp (generated)

012600547.b3lyp_6-31g(d).gjf (generated)

012600547.b3lyp_6-31g(d).firefly.inp (generated)

012600547.b3lyp_6-31g(d).smash.inp (generated)

012600547.b3lyp_6-31g(d).nwchem.inp (generated) 012600547.b3lyp_6-31g(d).log.xz 012600547.td-b3lyp_6-31g+(d).inp 012600547.td-b3lyp_6-31g+(d).log.xz

012600547.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600547.td-b3lyp_6-31+g(d).gjf (generated)

012600547.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600547.mol 012600547.PUBCHEM 012600547.mol (via Jmol)
012600548.b3lyp_6-31g(d).inp

012600548.b3lyp_6-31g(d).qchem.inp (generated)

012600548.b3lyp_6-31g(d).gjf (generated)

012600548.b3lyp_6-31g(d).firefly.inp (generated)

012600548.b3lyp_6-31g(d).smash.inp (generated)

012600548.b3lyp_6-31g(d).nwchem.inp (generated) 012600548.b3lyp_6-31g(d).log.xz 012600548.td-b3lyp_6-31g+(d).inp 012600548.td-b3lyp_6-31g+(d).log.xz

012600548.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600548.td-b3lyp_6-31+g(d).gjf (generated)

012600548.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600548.mol 012600548.PUBCHEM 012600548.mol (via Jmol)
012600551.b3lyp_6-31g(d).inp

012600551.b3lyp_6-31g(d).qchem.inp (generated)

012600551.b3lyp_6-31g(d).gjf (generated)

012600551.b3lyp_6-31g(d).firefly.inp (generated)

012600551.b3lyp_6-31g(d).smash.inp (generated)

012600551.b3lyp_6-31g(d).nwchem.inp (generated) 012600551.b3lyp_6-31g(d).log.xz 012600551.td-b3lyp_6-31g+(d).inp 012600551.td-b3lyp_6-31g+(d).log.xz

012600551.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600551.td-b3lyp_6-31+g(d).gjf (generated)

012600551.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600551.mol 012600551.PUBCHEM 012600551.mol (via Jmol)
012600553.b3lyp_6-31g(d).inp

012600553.b3lyp_6-31g(d).qchem.inp (generated)

012600553.b3lyp_6-31g(d).gjf (generated)

012600553.b3lyp_6-31g(d).firefly.inp (generated)

012600553.b3lyp_6-31g(d).smash.inp (generated)

012600553.b3lyp_6-31g(d).nwchem.inp (generated) 012600553.b3lyp_6-31g(d).log.xz 012600553.td-b3lyp_6-31g+(d).inp 012600553.td-b3lyp_6-31g+(d).log.xz

012600553.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600553.td-b3lyp_6-31+g(d).gjf (generated)

012600553.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600553.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600553.mol 012600553.PUBCHEM 012600553.mol (via Jmol)
012600559.b3lyp_6-31g(d).inp

012600559.b3lyp_6-31g(d).qchem.inp (generated)

012600559.b3lyp_6-31g(d).gjf (generated)

012600559.b3lyp_6-31g(d).firefly.inp (generated)

012600559.b3lyp_6-31g(d).smash.inp (generated)

012600559.b3lyp_6-31g(d).nwchem.inp (generated) 012600559.b3lyp_6-31g(d).log.xz 012600559.td-b3lyp_6-31g+(d).inp 012600559.td-b3lyp_6-31g+(d).log.xz

012600559.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600559.td-b3lyp_6-31+g(d).gjf (generated)

012600559.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600559.mol 012600559.PUBCHEM 012600559.mol (via Jmol)
012600560.b3lyp_6-31g(d).inp

012600560.b3lyp_6-31g(d).qchem.inp (generated)

012600560.b3lyp_6-31g(d).gjf (generated)

012600560.b3lyp_6-31g(d).firefly.inp (generated)

012600560.b3lyp_6-31g(d).smash.inp (generated)

012600560.b3lyp_6-31g(d).nwchem.inp (generated) 012600560.b3lyp_6-31g(d).log.xz 012600560.td-b3lyp_6-31g+(d).inp 012600560.td-b3lyp_6-31g+(d).log.xz

012600560.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600560.td-b3lyp_6-31+g(d).gjf (generated)

012600560.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600560.mol 012600560.PUBCHEM 012600560.mol (via Jmol)
012600562.b3lyp_6-31g(d).inp

012600562.b3lyp_6-31g(d).qchem.inp (generated)

012600562.b3lyp_6-31g(d).gjf (generated)

012600562.b3lyp_6-31g(d).firefly.inp (generated)

012600562.b3lyp_6-31g(d).smash.inp (generated)

012600562.b3lyp_6-31g(d).nwchem.inp (generated) 012600562.b3lyp_6-31g(d).log.xz 012600562.td-b3lyp_6-31g+(d).inp 012600562.td-b3lyp_6-31g+(d).log.xz

012600562.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600562.td-b3lyp_6-31+g(d).gjf (generated)

012600562.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600562.mol 012600562.PUBCHEM 012600562.mol (via Jmol)
012600564.b3lyp_6-31g(d).inp

012600564.b3lyp_6-31g(d).qchem.inp (generated)

012600564.b3lyp_6-31g(d).gjf (generated)

012600564.b3lyp_6-31g(d).firefly.inp (generated)

012600564.b3lyp_6-31g(d).smash.inp (generated)

012600564.b3lyp_6-31g(d).nwchem.inp (generated) 012600564.b3lyp_6-31g(d).log.xz 012600564.td-b3lyp_6-31g+(d).inp 012600564.td-b3lyp_6-31g+(d).log.xz

012600564.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600564.td-b3lyp_6-31+g(d).gjf (generated)

012600564.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600564.mol 012600564.PUBCHEM 012600564.mol (via Jmol)
012600566.b3lyp_6-31g(d).inp

012600566.b3lyp_6-31g(d).qchem.inp (generated)

012600566.b3lyp_6-31g(d).gjf (generated)

012600566.b3lyp_6-31g(d).firefly.inp (generated)

012600566.b3lyp_6-31g(d).smash.inp (generated)

012600566.b3lyp_6-31g(d).nwchem.inp (generated) 012600566.b3lyp_6-31g(d).log.xz 012600566.td-b3lyp_6-31g+(d).inp 012600566.td-b3lyp_6-31g+(d).log.xz

012600566.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600566.td-b3lyp_6-31+g(d).gjf (generated)

012600566.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600566.mol 012600566.PUBCHEM 012600566.mol (via Jmol)
012600568.b3lyp_6-31g(d).inp

012600568.b3lyp_6-31g(d).qchem.inp (generated)

012600568.b3lyp_6-31g(d).gjf (generated)

012600568.b3lyp_6-31g(d).firefly.inp (generated)

012600568.b3lyp_6-31g(d).smash.inp (generated)

012600568.b3lyp_6-31g(d).nwchem.inp (generated) 012600568.b3lyp_6-31g(d).log.xz 012600568.td-b3lyp_6-31g+(d).inp 012600568.td-b3lyp_6-31g+(d).log.xz

012600568.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600568.td-b3lyp_6-31+g(d).gjf (generated)

012600568.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600568.mol 012600568.PUBCHEM 012600568.mol (via Jmol)
012600587.b3lyp_6-31g(d).inp

012600587.b3lyp_6-31g(d).qchem.inp (generated)

012600587.b3lyp_6-31g(d).gjf (generated)

012600587.b3lyp_6-31g(d).firefly.inp (generated)

012600587.b3lyp_6-31g(d).smash.inp (generated)

012600587.b3lyp_6-31g(d).nwchem.inp (generated) 012600587.b3lyp_6-31g(d).log.xz 012600587.mol 012600587.PUBCHEM 012600587.mol (via Jmol)
012600592.b3lyp_6-31g(d).inp

012600592.b3lyp_6-31g(d).qchem.inp (generated)

012600592.b3lyp_6-31g(d).gjf (generated)

012600592.b3lyp_6-31g(d).firefly.inp (generated)

012600592.b3lyp_6-31g(d).smash.inp (generated)

012600592.b3lyp_6-31g(d).nwchem.inp (generated) 012600592.b3lyp_6-31g(d).log.xz 012600592.td-b3lyp_6-31g+(d).inp 012600592.td-b3lyp_6-31g+(d).log.xz

012600592.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600592.td-b3lyp_6-31+g(d).gjf (generated)

012600592.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600592.mol 012600592.PUBCHEM 012600592.mol (via Jmol)
012600605.b3lyp_6-31g(d).inp

012600605.b3lyp_6-31g(d).qchem.inp (generated)

012600605.b3lyp_6-31g(d).gjf (generated)

012600605.b3lyp_6-31g(d).firefly.inp (generated)

012600605.b3lyp_6-31g(d).smash.inp (generated)

012600605.b3lyp_6-31g(d).nwchem.inp (generated) 012600605.b3lyp_6-31g(d).log.xz 012600605.td-b3lyp_6-31g+(d).inp 012600605.td-b3lyp_6-31g+(d).log.xz

012600605.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600605.td-b3lyp_6-31+g(d).gjf (generated)

012600605.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600605.mol 012600605.PUBCHEM 012600605.mol (via Jmol)
012600623.b3lyp_6-31g(d).inp

012600623.b3lyp_6-31g(d).qchem.inp (generated)

012600623.b3lyp_6-31g(d).gjf (generated)

012600623.b3lyp_6-31g(d).firefly.inp (generated)

012600623.b3lyp_6-31g(d).smash.inp (generated)

012600623.b3lyp_6-31g(d).nwchem.inp (generated) 012600623.b3lyp_6-31g(d).log.xz 012600623.td-b3lyp_6-31g+(d).inp 012600623.td-b3lyp_6-31g+(d).log.xz

012600623.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600623.td-b3lyp_6-31+g(d).gjf (generated)

012600623.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600623.mol 012600623.PUBCHEM 012600623.mol (via Jmol)
012600624.b3lyp_6-31g(d).inp

012600624.b3lyp_6-31g(d).qchem.inp (generated)

012600624.b3lyp_6-31g(d).gjf (generated)

012600624.b3lyp_6-31g(d).firefly.inp (generated)

012600624.b3lyp_6-31g(d).smash.inp (generated)

012600624.b3lyp_6-31g(d).nwchem.inp (generated) 012600624.b3lyp_6-31g(d).log.xz 012600624.td-b3lyp_6-31g+(d).inp 012600624.td-b3lyp_6-31g+(d).log.xz

012600624.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600624.td-b3lyp_6-31+g(d).gjf (generated)

012600624.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600624.mol 012600624.PUBCHEM 012600624.mol (via Jmol)
012600647.b3lyp_6-31g(d).inp

012600647.b3lyp_6-31g(d).qchem.inp (generated)

012600647.b3lyp_6-31g(d).gjf (generated)

012600647.b3lyp_6-31g(d).firefly.inp (generated)

012600647.b3lyp_6-31g(d).smash.inp (generated)

012600647.b3lyp_6-31g(d).nwchem.inp (generated) 012600647.b3lyp_6-31g(d).log.xz 012600647.td-b3lyp_6-31g+(d).inp 012600647.td-b3lyp_6-31g+(d).log.xz

012600647.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600647.td-b3lyp_6-31+g(d).gjf (generated)

012600647.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600647.mol 012600647.PUBCHEM 012600647.mol (via Jmol)
012600651.b3lyp_6-31g(d).inp

012600651.b3lyp_6-31g(d).qchem.inp (generated)

012600651.b3lyp_6-31g(d).gjf (generated)

012600651.b3lyp_6-31g(d).firefly.inp (generated)

012600651.b3lyp_6-31g(d).smash.inp (generated)

012600651.b3lyp_6-31g(d).nwchem.inp (generated) 012600651.b3lyp_6-31g(d).log.xz 012600651.mol 012600651.PUBCHEM 012600651.mol (via Jmol)
012600705.b3lyp_6-31g(d).inp

012600705.b3lyp_6-31g(d).qchem.inp (generated)

012600705.b3lyp_6-31g(d).gjf (generated)

012600705.b3lyp_6-31g(d).firefly.inp (generated)

012600705.b3lyp_6-31g(d).smash.inp (generated)

012600705.b3lyp_6-31g(d).nwchem.inp (generated) 012600705.b3lyp_6-31g(d).log.xz 012600705.mol 012600705.PUBCHEM 012600705.mol (via Jmol)
012600735.b3lyp_6-31g(d).inp

012600735.b3lyp_6-31g(d).qchem.inp (generated)

012600735.b3lyp_6-31g(d).gjf (generated)

012600735.b3lyp_6-31g(d).firefly.inp (generated)

012600735.b3lyp_6-31g(d).smash.inp (generated)

012600735.b3lyp_6-31g(d).nwchem.inp (generated) 012600735.b3lyp_6-31g(d).log.xz 012600735.td-b3lyp_6-31g+(d).inp 012600735.td-b3lyp_6-31g+(d).log.xz

012600735.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600735.td-b3lyp_6-31+g(d).gjf (generated)

012600735.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600735.mol 012600735.PUBCHEM 012600735.mol (via Jmol)
012600746.b3lyp_6-31g(d).inp

012600746.b3lyp_6-31g(d).qchem.inp (generated)

012600746.b3lyp_6-31g(d).gjf (generated)

012600746.b3lyp_6-31g(d).firefly.inp (generated)

012600746.b3lyp_6-31g(d).smash.inp (generated)

012600746.b3lyp_6-31g(d).nwchem.inp (generated) 012600746.b3lyp_6-31g(d).log.xz 012600746.td-b3lyp_6-31g+(d).inp 012600746.td-b3lyp_6-31g+(d).log.xz

012600746.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600746.td-b3lyp_6-31+g(d).gjf (generated)

012600746.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600746.mol 012600746.PUBCHEM 012600746.mol (via Jmol)
012600751.b3lyp_6-31g(d).inp

012600751.b3lyp_6-31g(d).qchem.inp (generated)

012600751.b3lyp_6-31g(d).gjf (generated)

012600751.b3lyp_6-31g(d).firefly.inp (generated)

012600751.b3lyp_6-31g(d).smash.inp (generated)

012600751.b3lyp_6-31g(d).nwchem.inp (generated) 012600751.b3lyp_6-31g(d).log.xz 012600751.td-b3lyp_6-31g+(d).inp 012600751.td-b3lyp_6-31g+(d).log.xz

012600751.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600751.td-b3lyp_6-31+g(d).gjf (generated)

012600751.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600751.mol 012600751.PUBCHEM 012600751.mol (via Jmol)
012600754.b3lyp_6-31g(d).inp

012600754.b3lyp_6-31g(d).qchem.inp (generated)

012600754.b3lyp_6-31g(d).gjf (generated)

012600754.b3lyp_6-31g(d).firefly.inp (generated)

012600754.b3lyp_6-31g(d).smash.inp (generated)

012600754.b3lyp_6-31g(d).nwchem.inp (generated) 012600754.b3lyp_6-31g(d).log.xz 012600754.td-b3lyp_6-31g+(d).inp 012600754.td-b3lyp_6-31g+(d).log.xz

012600754.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600754.td-b3lyp_6-31+g(d).gjf (generated)

012600754.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600754.mol 012600754.PUBCHEM 012600754.mol (via Jmol)
012600760.b3lyp_6-31g(d).inp

012600760.b3lyp_6-31g(d).qchem.inp (generated)

012600760.b3lyp_6-31g(d).gjf (generated)

012600760.b3lyp_6-31g(d).firefly.inp (generated)

012600760.b3lyp_6-31g(d).smash.inp (generated)

012600760.b3lyp_6-31g(d).nwchem.inp (generated) 012600760.b3lyp_6-31g(d).log.xz 012600760.td-b3lyp_6-31g+(d).inp 012600760.td-b3lyp_6-31g+(d).log.xz

012600760.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600760.td-b3lyp_6-31+g(d).gjf (generated)

012600760.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600760.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600760.mol 012600760.PUBCHEM 012600760.mol (via Jmol)
012600761.b3lyp_6-31g(d).inp

012600761.b3lyp_6-31g(d).qchem.inp (generated)

012600761.b3lyp_6-31g(d).gjf (generated)

012600761.b3lyp_6-31g(d).firefly.inp (generated)

012600761.b3lyp_6-31g(d).smash.inp (generated)

012600761.b3lyp_6-31g(d).nwchem.inp (generated) 012600761.b3lyp_6-31g(d).log.xz 012600761.td-b3lyp_6-31g+(d).inp 012600761.td-b3lyp_6-31g+(d).log.xz

012600761.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600761.td-b3lyp_6-31+g(d).gjf (generated)

012600761.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600761.mol 012600761.PUBCHEM 012600761.mol (via Jmol)
012600762.b3lyp_6-31g(d).inp

012600762.b3lyp_6-31g(d).qchem.inp (generated)

012600762.b3lyp_6-31g(d).gjf (generated)

012600762.b3lyp_6-31g(d).firefly.inp (generated)

012600762.b3lyp_6-31g(d).smash.inp (generated)

012600762.b3lyp_6-31g(d).nwchem.inp (generated) 012600762.b3lyp_6-31g(d).log.xz 012600762.td-b3lyp_6-31g+(d).inp 012600762.td-b3lyp_6-31g+(d).log.xz

012600762.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600762.td-b3lyp_6-31+g(d).gjf (generated)

012600762.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600762.mol 012600762.PUBCHEM 012600762.mol (via Jmol)
012600778.b3lyp_6-31g(d).inp

012600778.b3lyp_6-31g(d).qchem.inp (generated)

012600778.b3lyp_6-31g(d).gjf (generated)

012600778.b3lyp_6-31g(d).firefly.inp (generated)

012600778.b3lyp_6-31g(d).smash.inp (generated)

012600778.b3lyp_6-31g(d).nwchem.inp (generated) 012600778.b3lyp_6-31g(d).log.xz 012600778.td-b3lyp_6-31g+(d).inp 012600778.td-b3lyp_6-31g+(d).log.xz

012600778.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600778.td-b3lyp_6-31+g(d).gjf (generated)

012600778.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600778.mol 012600778.PUBCHEM 012600778.mol (via Jmol)
012600779.b3lyp_6-31g(d).inp

012600779.b3lyp_6-31g(d).qchem.inp (generated)

012600779.b3lyp_6-31g(d).gjf (generated)

012600779.b3lyp_6-31g(d).firefly.inp (generated)

012600779.b3lyp_6-31g(d).smash.inp (generated)

012600779.b3lyp_6-31g(d).nwchem.inp (generated) 012600779.b3lyp_6-31g(d).log.xz 012600779.td-b3lyp_6-31g+(d).inp 012600779.td-b3lyp_6-31g+(d).log.xz

012600779.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600779.td-b3lyp_6-31+g(d).gjf (generated)

012600779.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600779.mol 012600779.PUBCHEM 012600779.mol (via Jmol)
012600791.b3lyp_6-31g(d).inp

012600791.b3lyp_6-31g(d).qchem.inp (generated)

012600791.b3lyp_6-31g(d).gjf (generated)

012600791.b3lyp_6-31g(d).firefly.inp (generated)

012600791.b3lyp_6-31g(d).smash.inp (generated)

012600791.b3lyp_6-31g(d).nwchem.inp (generated) 012600791.b3lyp_6-31g(d).log.xz 012600791.td-b3lyp_6-31g+(d).inp 012600791.td-b3lyp_6-31g+(d).log.xz

012600791.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600791.td-b3lyp_6-31+g(d).gjf (generated)

012600791.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600791.mol 012600791.PUBCHEM 012600791.mol (via Jmol)
012600795.b3lyp_6-31g(d).inp

012600795.b3lyp_6-31g(d).qchem.inp (generated)

012600795.b3lyp_6-31g(d).gjf (generated)

012600795.b3lyp_6-31g(d).firefly.inp (generated)

012600795.b3lyp_6-31g(d).smash.inp (generated)

012600795.b3lyp_6-31g(d).nwchem.inp (generated) 012600795.b3lyp_6-31g(d).log.xz 012600795.td-b3lyp_6-31g+(d).inp 012600795.td-b3lyp_6-31g+(d).log.xz

012600795.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600795.td-b3lyp_6-31+g(d).gjf (generated)

012600795.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600795.mol 012600795.PUBCHEM 012600795.mol (via Jmol)
012600798.b3lyp_6-31g(d).inp

012600798.b3lyp_6-31g(d).qchem.inp (generated)

012600798.b3lyp_6-31g(d).gjf (generated)

012600798.b3lyp_6-31g(d).firefly.inp (generated)

012600798.b3lyp_6-31g(d).smash.inp (generated)

012600798.b3lyp_6-31g(d).nwchem.inp (generated) 012600798.b3lyp_6-31g(d).log.xz 012600798.td-b3lyp_6-31g+(d).inp 012600798.td-b3lyp_6-31g+(d).log.xz

012600798.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600798.td-b3lyp_6-31+g(d).gjf (generated)

012600798.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600798.mol 012600798.PUBCHEM 012600798.mol (via Jmol)
012600842.b3lyp_6-31g(d).inp

012600842.b3lyp_6-31g(d).qchem.inp (generated)

012600842.b3lyp_6-31g(d).gjf (generated)

012600842.b3lyp_6-31g(d).firefly.inp (generated)

012600842.b3lyp_6-31g(d).smash.inp (generated)

012600842.b3lyp_6-31g(d).nwchem.inp (generated) 012600842.b3lyp_6-31g(d).log.xz 012600842.mol 012600842.PUBCHEM 012600842.mol (via Jmol)
012600844.b3lyp_6-31g(d).inp

012600844.b3lyp_6-31g(d).qchem.inp (generated)

012600844.b3lyp_6-31g(d).gjf (generated)

012600844.b3lyp_6-31g(d).firefly.inp (generated)

012600844.b3lyp_6-31g(d).smash.inp (generated)

012600844.b3lyp_6-31g(d).nwchem.inp (generated) 012600844.b3lyp_6-31g(d).log.xz 012600844.mol 012600844.PUBCHEM 012600844.mol (via Jmol)
012600856.b3lyp_6-31g(d).inp

012600856.b3lyp_6-31g(d).qchem.inp (generated)

012600856.b3lyp_6-31g(d).gjf (generated)

012600856.b3lyp_6-31g(d).firefly.inp (generated)

012600856.b3lyp_6-31g(d).smash.inp (generated)

012600856.b3lyp_6-31g(d).nwchem.inp (generated) 012600856.b3lyp_6-31g(d).log.xz 012600856.td-b3lyp_6-31g+(d).inp 012600856.td-b3lyp_6-31g+(d).log.xz

012600856.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600856.td-b3lyp_6-31+g(d).gjf (generated)

012600856.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600856.mol 012600856.PUBCHEM 012600856.mol (via Jmol)
012600880.b3lyp_6-31g(d).inp

012600880.b3lyp_6-31g(d).qchem.inp (generated)

012600880.b3lyp_6-31g(d).gjf (generated)

012600880.b3lyp_6-31g(d).firefly.inp (generated)

012600880.b3lyp_6-31g(d).smash.inp (generated)

012600880.b3lyp_6-31g(d).nwchem.inp (generated) 012600880.b3lyp_6-31g(d).log.xz 012600880.td-b3lyp_6-31g+(d).inp 012600880.td-b3lyp_6-31g+(d).log.xz

012600880.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600880.td-b3lyp_6-31+g(d).gjf (generated)

012600880.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600880.mol 012600880.PUBCHEM 012600880.mol (via Jmol)
012600881.b3lyp_6-31g(d).inp

012600881.b3lyp_6-31g(d).qchem.inp (generated)

012600881.b3lyp_6-31g(d).gjf (generated)

012600881.b3lyp_6-31g(d).firefly.inp (generated)

012600881.b3lyp_6-31g(d).smash.inp (generated)

012600881.b3lyp_6-31g(d).nwchem.inp (generated) 012600881.b3lyp_6-31g(d).log.xz 012600881.td-b3lyp_6-31g+(d).inp 012600881.td-b3lyp_6-31g+(d).log.xz

012600881.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600881.td-b3lyp_6-31+g(d).gjf (generated)

012600881.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600881.mol 012600881.PUBCHEM 012600881.mol (via Jmol)
012600902.b3lyp_6-31g(d).inp

012600902.b3lyp_6-31g(d).qchem.inp (generated)

012600902.b3lyp_6-31g(d).gjf (generated)

012600902.b3lyp_6-31g(d).firefly.inp (generated)

012600902.b3lyp_6-31g(d).smash.inp (generated)

012600902.b3lyp_6-31g(d).nwchem.inp (generated) 012600902.b3lyp_6-31g(d).log.xz 012600902.td-b3lyp_6-31g+(d).inp 012600902.td-b3lyp_6-31g+(d).log.xz

012600902.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600902.td-b3lyp_6-31+g(d).gjf (generated)

012600902.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600902.mol 012600902.PUBCHEM 012600902.mol (via Jmol)
012600905.b3lyp_6-31g(d).inp

012600905.b3lyp_6-31g(d).qchem.inp (generated)

012600905.b3lyp_6-31g(d).gjf (generated)

012600905.b3lyp_6-31g(d).firefly.inp (generated)

012600905.b3lyp_6-31g(d).smash.inp (generated)

012600905.b3lyp_6-31g(d).nwchem.inp (generated) 012600905.b3lyp_6-31g(d).log.xz 012600905.td-b3lyp_6-31g+(d).inp 012600905.td-b3lyp_6-31g+(d).log.xz

012600905.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600905.td-b3lyp_6-31+g(d).gjf (generated)

012600905.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600905.mol 012600905.PUBCHEM 012600905.mol (via Jmol)
012600906.b3lyp_6-31g(d).inp

012600906.b3lyp_6-31g(d).qchem.inp (generated)

012600906.b3lyp_6-31g(d).gjf (generated)

012600906.b3lyp_6-31g(d).firefly.inp (generated)

012600906.b3lyp_6-31g(d).smash.inp (generated)

012600906.b3lyp_6-31g(d).nwchem.inp (generated) 012600906.b3lyp_6-31g(d).log.xz 012600906.td-b3lyp_6-31g+(d).inp 012600906.td-b3lyp_6-31g+(d).log.xz

012600906.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600906.td-b3lyp_6-31+g(d).gjf (generated)

012600906.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600906.mol 012600906.PUBCHEM 012600906.mol (via Jmol)
012600925.b3lyp_6-31g(d).inp

012600925.b3lyp_6-31g(d).qchem.inp (generated)

012600925.b3lyp_6-31g(d).gjf (generated)

012600925.b3lyp_6-31g(d).firefly.inp (generated)

012600925.b3lyp_6-31g(d).smash.inp (generated)

012600925.b3lyp_6-31g(d).nwchem.inp (generated) 012600925.b3lyp_6-31g(d).log.xz 012600925.td-b3lyp_6-31g+(d).inp 012600925.td-b3lyp_6-31g+(d).log.xz

012600925.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600925.td-b3lyp_6-31+g(d).gjf (generated)

012600925.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600925.mol 012600925.PUBCHEM 012600925.mol (via Jmol)
012600933.b3lyp_6-31g(d).inp

012600933.b3lyp_6-31g(d).qchem.inp (generated)

012600933.b3lyp_6-31g(d).gjf (generated)

012600933.b3lyp_6-31g(d).firefly.inp (generated)

012600933.b3lyp_6-31g(d).smash.inp (generated)

012600933.b3lyp_6-31g(d).nwchem.inp (generated) 012600933.b3lyp_6-31g(d).log.xz 012600933.td-b3lyp_6-31g+(d).inp 012600933.td-b3lyp_6-31g+(d).log.xz

012600933.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600933.td-b3lyp_6-31+g(d).gjf (generated)

012600933.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600933.mol 012600933.PUBCHEM 012600933.mol (via Jmol)
012600938.b3lyp_6-31g(d).inp

012600938.b3lyp_6-31g(d).qchem.inp (generated)

012600938.b3lyp_6-31g(d).gjf (generated)

012600938.b3lyp_6-31g(d).firefly.inp (generated)

012600938.b3lyp_6-31g(d).smash.inp (generated)

012600938.b3lyp_6-31g(d).nwchem.inp (generated) 012600938.b3lyp_6-31g(d).log.xz 012600938.mol 012600938.PUBCHEM 012600938.mol (via Jmol)
012600941.b3lyp_6-31g(d).inp

012600941.b3lyp_6-31g(d).qchem.inp (generated)

012600941.b3lyp_6-31g(d).gjf (generated)

012600941.b3lyp_6-31g(d).firefly.inp (generated)

012600941.b3lyp_6-31g(d).smash.inp (generated)

012600941.b3lyp_6-31g(d).nwchem.inp (generated) 012600941.b3lyp_6-31g(d).log.xz 012600941.td-b3lyp_6-31g+(d).inp 012600941.td-b3lyp_6-31g+(d).log.xz

012600941.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600941.td-b3lyp_6-31+g(d).gjf (generated)

012600941.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600941.mol 012600941.PUBCHEM 012600941.mol (via Jmol)
012600946.b3lyp_6-31g(d).inp

012600946.b3lyp_6-31g(d).qchem.inp (generated)

012600946.b3lyp_6-31g(d).gjf (generated)

012600946.b3lyp_6-31g(d).firefly.inp (generated)

012600946.b3lyp_6-31g(d).smash.inp (generated)

012600946.b3lyp_6-31g(d).nwchem.inp (generated) 012600946.b3lyp_6-31g(d).log.xz 012600946.td-b3lyp_6-31g+(d).inp 012600946.td-b3lyp_6-31g+(d).log.xz

012600946.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600946.td-b3lyp_6-31+g(d).gjf (generated)

012600946.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600946.mol 012600946.PUBCHEM 012600946.mol (via Jmol)
012600949.b3lyp_6-31g(d).inp

012600949.b3lyp_6-31g(d).qchem.inp (generated)

012600949.b3lyp_6-31g(d).gjf (generated)

012600949.b3lyp_6-31g(d).firefly.inp (generated)

012600949.b3lyp_6-31g(d).smash.inp (generated)

012600949.b3lyp_6-31g(d).nwchem.inp (generated) 012600949.b3lyp_6-31g(d).log.xz 012600949.mol 012600949.PUBCHEM 012600949.mol (via Jmol)
012600954.b3lyp_6-31g(d).inp

012600954.b3lyp_6-31g(d).qchem.inp (generated)

012600954.b3lyp_6-31g(d).gjf (generated)

012600954.b3lyp_6-31g(d).firefly.inp (generated)

012600954.b3lyp_6-31g(d).smash.inp (generated)

012600954.b3lyp_6-31g(d).nwchem.inp (generated) 012600954.b3lyp_6-31g(d).log.xz 012600954.td-b3lyp_6-31g+(d).inp 012600954.td-b3lyp_6-31g+(d).log.xz

012600954.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600954.td-b3lyp_6-31+g(d).gjf (generated)

012600954.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600954.mol 012600954.PUBCHEM 012600954.mol (via Jmol)
012600961.b3lyp_6-31g(d).inp

012600961.b3lyp_6-31g(d).qchem.inp (generated)

012600961.b3lyp_6-31g(d).gjf (generated)

012600961.b3lyp_6-31g(d).firefly.inp (generated)

012600961.b3lyp_6-31g(d).smash.inp (generated)

012600961.b3lyp_6-31g(d).nwchem.inp (generated) 012600961.b3lyp_6-31g(d).log.xz 012600961.mol 012600961.PUBCHEM 012600961.mol (via Jmol)
012600978.b3lyp_6-31g(d).inp

012600978.b3lyp_6-31g(d).qchem.inp (generated)

012600978.b3lyp_6-31g(d).gjf (generated)

012600978.b3lyp_6-31g(d).firefly.inp (generated)

012600978.b3lyp_6-31g(d).smash.inp (generated)

012600978.b3lyp_6-31g(d).nwchem.inp (generated) 012600978.b3lyp_6-31g(d).log.xz 012600978.td-b3lyp_6-31g+(d).inp 012600978.td-b3lyp_6-31g+(d).log.xz

012600978.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600978.td-b3lyp_6-31+g(d).gjf (generated)

012600978.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600978.mol 012600978.PUBCHEM 012600978.mol (via Jmol)
012600989.b3lyp_6-31g(d).inp

012600989.b3lyp_6-31g(d).qchem.inp (generated)

012600989.b3lyp_6-31g(d).gjf (generated)

012600989.b3lyp_6-31g(d).firefly.inp (generated)

012600989.b3lyp_6-31g(d).smash.inp (generated)

012600989.b3lyp_6-31g(d).nwchem.inp (generated) 012600989.b3lyp_6-31g(d).log.xz 012600989.td-b3lyp_6-31g+(d).inp 012600989.td-b3lyp_6-31g+(d).log.xz

012600989.td-b3lyp_6-31+g(d).qchem.inp (generated)

012600989.td-b3lyp_6-31+g(d).gjf (generated)

012600989.td-b3lyp_6-31+g(d).firefly.inp (generated)

012600989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012600989.mol 012600989.PUBCHEM 012600989.mol (via Jmol)
012601004.b3lyp_6-31g(d).inp

012601004.b3lyp_6-31g(d).qchem.inp (generated)

012601004.b3lyp_6-31g(d).gjf (generated)

012601004.b3lyp_6-31g(d).firefly.inp (generated)

012601004.b3lyp_6-31g(d).smash.inp (generated)

012601004.b3lyp_6-31g(d).nwchem.inp (generated) 012601004.b3lyp_6-31g(d).log.xz 012601004.td-b3lyp_6-31g+(d).inp 012601004.td-b3lyp_6-31g+(d).log.xz

012601004.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601004.td-b3lyp_6-31+g(d).gjf (generated)

012601004.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601004.mol 012601004.PUBCHEM 012601004.mol (via Jmol)
012601007.b3lyp_6-31g(d).inp

012601007.b3lyp_6-31g(d).qchem.inp (generated)

012601007.b3lyp_6-31g(d).gjf (generated)

012601007.b3lyp_6-31g(d).firefly.inp (generated)

012601007.b3lyp_6-31g(d).smash.inp (generated)

012601007.b3lyp_6-31g(d).nwchem.inp (generated) 012601007.b3lyp_6-31g(d).log.xz 012601007.td-b3lyp_6-31g+(d).inp 012601007.td-b3lyp_6-31g+(d).log.xz

012601007.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601007.td-b3lyp_6-31+g(d).gjf (generated)

012601007.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601007.mol 012601007.PUBCHEM 012601007.mol (via Jmol)
012601008.b3lyp_6-31g(d).inp

012601008.b3lyp_6-31g(d).qchem.inp (generated)

012601008.b3lyp_6-31g(d).gjf (generated)

012601008.b3lyp_6-31g(d).firefly.inp (generated)

012601008.b3lyp_6-31g(d).smash.inp (generated)

012601008.b3lyp_6-31g(d).nwchem.inp (generated) 012601008.b3lyp_6-31g(d).log.xz 012601008.td-b3lyp_6-31g+(d).inp 012601008.td-b3lyp_6-31g+(d).log.xz

012601008.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601008.td-b3lyp_6-31+g(d).gjf (generated)

012601008.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601008.mol 012601008.PUBCHEM 012601008.mol (via Jmol)
012601009.b3lyp_6-31g(d).inp

012601009.b3lyp_6-31g(d).qchem.inp (generated)

012601009.b3lyp_6-31g(d).gjf (generated)

012601009.b3lyp_6-31g(d).firefly.inp (generated)

012601009.b3lyp_6-31g(d).smash.inp (generated)

012601009.b3lyp_6-31g(d).nwchem.inp (generated) 012601009.b3lyp_6-31g(d).log.xz 012601009.td-b3lyp_6-31g+(d).inp 012601009.td-b3lyp_6-31g+(d).log.xz

012601009.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601009.td-b3lyp_6-31+g(d).gjf (generated)

012601009.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601009.mol 012601009.PUBCHEM 012601009.mol (via Jmol)
012601012.b3lyp_6-31g(d).inp

012601012.b3lyp_6-31g(d).qchem.inp (generated)

012601012.b3lyp_6-31g(d).gjf (generated)

012601012.b3lyp_6-31g(d).firefly.inp (generated)

012601012.b3lyp_6-31g(d).smash.inp (generated)

012601012.b3lyp_6-31g(d).nwchem.inp (generated) 012601012.b3lyp_6-31g(d).log.xz 012601012.td-b3lyp_6-31g+(d).inp 012601012.td-b3lyp_6-31g+(d).log.xz

012601012.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601012.td-b3lyp_6-31+g(d).gjf (generated)

012601012.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601012.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601012.mol 012601012.PUBCHEM 012601012.mol (via Jmol)
012601016.b3lyp_6-31g(d).inp

012601016.b3lyp_6-31g(d).qchem.inp (generated)

012601016.b3lyp_6-31g(d).gjf (generated)

012601016.b3lyp_6-31g(d).firefly.inp (generated)

012601016.b3lyp_6-31g(d).smash.inp (generated)

012601016.b3lyp_6-31g(d).nwchem.inp (generated) 012601016.b3lyp_6-31g(d).log.xz 012601016.td-b3lyp_6-31g+(d).inp 012601016.td-b3lyp_6-31g+(d).log.xz

012601016.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601016.td-b3lyp_6-31+g(d).gjf (generated)

012601016.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601016.mol 012601016.PUBCHEM 012601016.mol (via Jmol)
012601017.b3lyp_6-31g(d).inp

012601017.b3lyp_6-31g(d).qchem.inp (generated)

012601017.b3lyp_6-31g(d).gjf (generated)

012601017.b3lyp_6-31g(d).firefly.inp (generated)

012601017.b3lyp_6-31g(d).smash.inp (generated)

012601017.b3lyp_6-31g(d).nwchem.inp (generated) 012601017.b3lyp_6-31g(d).log.xz 012601017.td-b3lyp_6-31g+(d).inp 012601017.td-b3lyp_6-31g+(d).log.xz

012601017.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601017.td-b3lyp_6-31+g(d).gjf (generated)

012601017.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601017.mol 012601017.PUBCHEM 012601017.mol (via Jmol)
012601019.b3lyp_6-31g(d).inp

012601019.b3lyp_6-31g(d).qchem.inp (generated)

012601019.b3lyp_6-31g(d).gjf (generated)

012601019.b3lyp_6-31g(d).firefly.inp (generated)

012601019.b3lyp_6-31g(d).smash.inp (generated)

012601019.b3lyp_6-31g(d).nwchem.inp (generated) 012601019.b3lyp_6-31g(d).log.xz 012601019.td-b3lyp_6-31g+(d).inp 012601019.td-b3lyp_6-31g+(d).log.xz

012601019.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601019.td-b3lyp_6-31+g(d).gjf (generated)

012601019.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601019.mol 012601019.PUBCHEM 012601019.mol (via Jmol)
012601026.b3lyp_6-31g(d).inp

012601026.b3lyp_6-31g(d).qchem.inp (generated)

012601026.b3lyp_6-31g(d).gjf (generated)

012601026.b3lyp_6-31g(d).firefly.inp (generated)

012601026.b3lyp_6-31g(d).smash.inp (generated)

012601026.b3lyp_6-31g(d).nwchem.inp (generated) 012601026.b3lyp_6-31g(d).log.xz 012601026.td-b3lyp_6-31g+(d).inp 012601026.td-b3lyp_6-31g+(d).log.xz

012601026.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601026.td-b3lyp_6-31+g(d).gjf (generated)

012601026.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601026.mol 012601026.PUBCHEM 012601026.mol (via Jmol)
012601034.b3lyp_6-31g(d).inp

012601034.b3lyp_6-31g(d).qchem.inp (generated)

012601034.b3lyp_6-31g(d).gjf (generated)

012601034.b3lyp_6-31g(d).firefly.inp (generated)

012601034.b3lyp_6-31g(d).smash.inp (generated)

012601034.b3lyp_6-31g(d).nwchem.inp (generated) 012601034.b3lyp_6-31g(d).log.xz 012601034.td-b3lyp_6-31g+(d).inp 012601034.td-b3lyp_6-31g+(d).log.xz

012601034.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601034.td-b3lyp_6-31+g(d).gjf (generated)

012601034.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601034.mol 012601034.PUBCHEM 012601034.mol (via Jmol)
012601036.b3lyp_6-31g(d).inp

012601036.b3lyp_6-31g(d).qchem.inp (generated)

012601036.b3lyp_6-31g(d).gjf (generated)

012601036.b3lyp_6-31g(d).firefly.inp (generated)

012601036.b3lyp_6-31g(d).smash.inp (generated)

012601036.b3lyp_6-31g(d).nwchem.inp (generated) 012601036.b3lyp_6-31g(d).log.xz 012601036.td-b3lyp_6-31g+(d).inp 012601036.td-b3lyp_6-31g+(d).log.xz

012601036.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601036.td-b3lyp_6-31+g(d).gjf (generated)

012601036.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601036.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601036.mol 012601036.PUBCHEM 012601036.mol (via Jmol)
012601038.b3lyp_6-31g(d).inp

012601038.b3lyp_6-31g(d).qchem.inp (generated)

012601038.b3lyp_6-31g(d).gjf (generated)

012601038.b3lyp_6-31g(d).firefly.inp (generated)

012601038.b3lyp_6-31g(d).smash.inp (generated)

012601038.b3lyp_6-31g(d).nwchem.inp (generated) 012601038.b3lyp_6-31g(d).log.xz 012601038.td-b3lyp_6-31g+(d).inp 012601038.td-b3lyp_6-31g+(d).log.xz

012601038.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601038.td-b3lyp_6-31+g(d).gjf (generated)

012601038.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601038.mol 012601038.PUBCHEM 012601038.mol (via Jmol)
012601122.b3lyp_6-31g(d).inp

012601122.b3lyp_6-31g(d).qchem.inp (generated)

012601122.b3lyp_6-31g(d).gjf (generated)

012601122.b3lyp_6-31g(d).firefly.inp (generated)

012601122.b3lyp_6-31g(d).smash.inp (generated)

012601122.b3lyp_6-31g(d).nwchem.inp (generated) 012601122.b3lyp_6-31g(d).log.xz 012601122.td-b3lyp_6-31g+(d).inp 012601122.td-b3lyp_6-31g+(d).log.xz

012601122.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601122.td-b3lyp_6-31+g(d).gjf (generated)

012601122.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601122.mol 012601122.PUBCHEM 012601122.mol (via Jmol)
012601130.b3lyp_6-31g(d).inp

012601130.b3lyp_6-31g(d).qchem.inp (generated)

012601130.b3lyp_6-31g(d).gjf (generated)

012601130.b3lyp_6-31g(d).firefly.inp (generated)

012601130.b3lyp_6-31g(d).smash.inp (generated)

012601130.b3lyp_6-31g(d).nwchem.inp (generated) 012601130.b3lyp_6-31g(d).log.xz 012601130.td-b3lyp_6-31g+(d).inp 012601130.td-b3lyp_6-31g+(d).log.xz

012601130.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601130.td-b3lyp_6-31+g(d).gjf (generated)

012601130.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601130.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601130.mol 012601130.PUBCHEM 012601130.mol (via Jmol)
012601142.b3lyp_6-31g(d).inp

012601142.b3lyp_6-31g(d).qchem.inp (generated)

012601142.b3lyp_6-31g(d).gjf (generated)

012601142.b3lyp_6-31g(d).firefly.inp (generated)

012601142.b3lyp_6-31g(d).smash.inp (generated)

012601142.b3lyp_6-31g(d).nwchem.inp (generated) 012601142.b3lyp_6-31g(d).log.xz 012601142.td-b3lyp_6-31g+(d).inp 012601142.td-b3lyp_6-31g+(d).log.xz

012601142.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601142.td-b3lyp_6-31+g(d).gjf (generated)

012601142.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601142.mol 012601142.PUBCHEM 012601142.mol (via Jmol)
012601144.b3lyp_6-31g(d).inp

012601144.b3lyp_6-31g(d).qchem.inp (generated)

012601144.b3lyp_6-31g(d).gjf (generated)

012601144.b3lyp_6-31g(d).firefly.inp (generated)

012601144.b3lyp_6-31g(d).smash.inp (generated)

012601144.b3lyp_6-31g(d).nwchem.inp (generated) 012601144.b3lyp_6-31g(d).log.xz 012601144.td-b3lyp_6-31g+(d).inp 012601144.td-b3lyp_6-31g+(d).log.xz

012601144.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601144.td-b3lyp_6-31+g(d).gjf (generated)

012601144.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601144.mol 012601144.PUBCHEM 012601144.mol (via Jmol)
012601184.b3lyp_6-31g(d).inp

012601184.b3lyp_6-31g(d).qchem.inp (generated)

012601184.b3lyp_6-31g(d).gjf (generated)

012601184.b3lyp_6-31g(d).firefly.inp (generated)

012601184.b3lyp_6-31g(d).smash.inp (generated)

012601184.b3lyp_6-31g(d).nwchem.inp (generated) 012601184.b3lyp_6-31g(d).log.xz 012601184.td-b3lyp_6-31g+(d).inp 012601184.td-b3lyp_6-31g+(d).log.xz

012601184.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601184.td-b3lyp_6-31+g(d).gjf (generated)

012601184.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601184.mol 012601184.PUBCHEM 012601184.mol (via Jmol)
012601189.b3lyp_6-31g(d).inp

012601189.b3lyp_6-31g(d).qchem.inp (generated)

012601189.b3lyp_6-31g(d).gjf (generated)

012601189.b3lyp_6-31g(d).firefly.inp (generated)

012601189.b3lyp_6-31g(d).smash.inp (generated)

012601189.b3lyp_6-31g(d).nwchem.inp (generated) 012601189.b3lyp_6-31g(d).log.xz 012601189.td-b3lyp_6-31g+(d).inp 012601189.td-b3lyp_6-31g+(d).log.xz

012601189.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601189.td-b3lyp_6-31+g(d).gjf (generated)

012601189.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601189.mol 012601189.PUBCHEM 012601189.mol (via Jmol)
012601199.b3lyp_6-31g(d).inp

012601199.b3lyp_6-31g(d).qchem.inp (generated)

012601199.b3lyp_6-31g(d).gjf (generated)

012601199.b3lyp_6-31g(d).firefly.inp (generated)

012601199.b3lyp_6-31g(d).smash.inp (generated)

012601199.b3lyp_6-31g(d).nwchem.inp (generated) 012601199.b3lyp_6-31g(d).log.xz 012601199.td-b3lyp_6-31g+(d).inp 012601199.td-b3lyp_6-31g+(d).log.xz

012601199.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601199.td-b3lyp_6-31+g(d).gjf (generated)

012601199.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601199.mol 012601199.PUBCHEM 012601199.mol (via Jmol)
012601213.b3lyp_6-31g(d).inp

012601213.b3lyp_6-31g(d).qchem.inp (generated)

012601213.b3lyp_6-31g(d).gjf (generated)

012601213.b3lyp_6-31g(d).firefly.inp (generated)

012601213.b3lyp_6-31g(d).smash.inp (generated)

012601213.b3lyp_6-31g(d).nwchem.inp (generated) 012601213.b3lyp_6-31g(d).log.xz 012601213.td-b3lyp_6-31g+(d).inp 012601213.td-b3lyp_6-31g+(d).log.xz

012601213.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601213.td-b3lyp_6-31+g(d).gjf (generated)

012601213.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601213.mol 012601213.PUBCHEM 012601213.mol (via Jmol)
012601214.b3lyp_6-31g(d).inp

012601214.b3lyp_6-31g(d).qchem.inp (generated)

012601214.b3lyp_6-31g(d).gjf (generated)

012601214.b3lyp_6-31g(d).firefly.inp (generated)

012601214.b3lyp_6-31g(d).smash.inp (generated)

012601214.b3lyp_6-31g(d).nwchem.inp (generated) 012601214.b3lyp_6-31g(d).log.xz 012601214.td-b3lyp_6-31g+(d).inp 012601214.td-b3lyp_6-31g+(d).log.xz

012601214.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601214.td-b3lyp_6-31+g(d).gjf (generated)

012601214.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601214.mol 012601214.PUBCHEM 012601214.mol (via Jmol)
012601219.b3lyp_6-31g(d).inp

012601219.b3lyp_6-31g(d).qchem.inp (generated)

012601219.b3lyp_6-31g(d).gjf (generated)

012601219.b3lyp_6-31g(d).firefly.inp (generated)

012601219.b3lyp_6-31g(d).smash.inp (generated)

012601219.b3lyp_6-31g(d).nwchem.inp (generated) 012601219.b3lyp_6-31g(d).log.xz 012601219.mol 012601219.PUBCHEM 012601219.mol (via Jmol)
012601291.b3lyp_6-31g(d).inp

012601291.b3lyp_6-31g(d).qchem.inp (generated)

012601291.b3lyp_6-31g(d).gjf (generated)

012601291.b3lyp_6-31g(d).firefly.inp (generated)

012601291.b3lyp_6-31g(d).smash.inp (generated)

012601291.b3lyp_6-31g(d).nwchem.inp (generated) 012601291.b3lyp_6-31g(d).log.xz 012601291.td-b3lyp_6-31g+(d).inp 012601291.td-b3lyp_6-31g+(d).log.xz

012601291.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601291.td-b3lyp_6-31+g(d).gjf (generated)

012601291.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601291.mol 012601291.PUBCHEM 012601291.mol (via Jmol)
012601292.b3lyp_6-31g(d).inp

012601292.b3lyp_6-31g(d).qchem.inp (generated)

012601292.b3lyp_6-31g(d).gjf (generated)

012601292.b3lyp_6-31g(d).firefly.inp (generated)

012601292.b3lyp_6-31g(d).smash.inp (generated)

012601292.b3lyp_6-31g(d).nwchem.inp (generated) 012601292.b3lyp_6-31g(d).log.xz 012601292.td-b3lyp_6-31g+(d).inp 012601292.td-b3lyp_6-31g+(d).log.xz

012601292.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601292.td-b3lyp_6-31+g(d).gjf (generated)

012601292.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601292.mol 012601292.PUBCHEM 012601292.mol (via Jmol)
012601305.b3lyp_6-31g(d).inp

012601305.b3lyp_6-31g(d).qchem.inp (generated)

012601305.b3lyp_6-31g(d).gjf (generated)

012601305.b3lyp_6-31g(d).firefly.inp (generated)

012601305.b3lyp_6-31g(d).smash.inp (generated)

012601305.b3lyp_6-31g(d).nwchem.inp (generated) 012601305.b3lyp_6-31g(d).log.xz 012601305.td-b3lyp_6-31g+(d).inp 012601305.td-b3lyp_6-31g+(d).log.xz

012601305.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601305.td-b3lyp_6-31+g(d).gjf (generated)

012601305.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601305.mol 012601305.PUBCHEM 012601305.mol (via Jmol)
012601311.b3lyp_6-31g(d).inp

012601311.b3lyp_6-31g(d).qchem.inp (generated)

012601311.b3lyp_6-31g(d).gjf (generated)

012601311.b3lyp_6-31g(d).firefly.inp (generated)

012601311.b3lyp_6-31g(d).smash.inp (generated)

012601311.b3lyp_6-31g(d).nwchem.inp (generated) 012601311.b3lyp_6-31g(d).log.xz 012601311.mol 012601311.PUBCHEM 012601311.mol (via Jmol)
012601312.b3lyp_6-31g(d).inp

012601312.b3lyp_6-31g(d).qchem.inp (generated)

012601312.b3lyp_6-31g(d).gjf (generated)

012601312.b3lyp_6-31g(d).firefly.inp (generated)

012601312.b3lyp_6-31g(d).smash.inp (generated)

012601312.b3lyp_6-31g(d).nwchem.inp (generated) 012601312.b3lyp_6-31g(d).log.xz 012601312.td-b3lyp_6-31g+(d).inp 012601312.td-b3lyp_6-31g+(d).log.xz

012601312.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601312.td-b3lyp_6-31+g(d).gjf (generated)

012601312.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601312.mol 012601312.PUBCHEM 012601312.mol (via Jmol)
012601315.b3lyp_6-31g(d).inp

012601315.b3lyp_6-31g(d).qchem.inp (generated)

012601315.b3lyp_6-31g(d).gjf (generated)

012601315.b3lyp_6-31g(d).firefly.inp (generated)

012601315.b3lyp_6-31g(d).smash.inp (generated)

012601315.b3lyp_6-31g(d).nwchem.inp (generated) 012601315.b3lyp_6-31g(d).log.xz 012601315.td-b3lyp_6-31g+(d).inp 012601315.td-b3lyp_6-31g+(d).log.xz

012601315.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601315.td-b3lyp_6-31+g(d).gjf (generated)

012601315.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601315.mol 012601315.PUBCHEM 012601315.mol (via Jmol)
012601326.b3lyp_6-31g(d).inp

012601326.b3lyp_6-31g(d).qchem.inp (generated)

012601326.b3lyp_6-31g(d).gjf (generated)

012601326.b3lyp_6-31g(d).firefly.inp (generated)

012601326.b3lyp_6-31g(d).smash.inp (generated)

012601326.b3lyp_6-31g(d).nwchem.inp (generated) 012601326.b3lyp_6-31g(d).log.xz 012601326.td-b3lyp_6-31g+(d).inp 012601326.td-b3lyp_6-31g+(d).log.xz

012601326.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601326.td-b3lyp_6-31+g(d).gjf (generated)

012601326.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601326.mol 012601326.PUBCHEM 012601326.mol (via Jmol)
012601329.b3lyp_6-31g(d).inp

012601329.b3lyp_6-31g(d).qchem.inp (generated)

012601329.b3lyp_6-31g(d).gjf (generated)

012601329.b3lyp_6-31g(d).firefly.inp (generated)

012601329.b3lyp_6-31g(d).smash.inp (generated)

012601329.b3lyp_6-31g(d).nwchem.inp (generated) 012601329.b3lyp_6-31g(d).log.xz 012601329.td-b3lyp_6-31g+(d).inp 012601329.td-b3lyp_6-31g+(d).log.xz

012601329.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601329.td-b3lyp_6-31+g(d).gjf (generated)

012601329.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601329.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601329.mol 012601329.PUBCHEM 012601329.mol (via Jmol)
012601333.b3lyp_6-31g(d).inp

012601333.b3lyp_6-31g(d).qchem.inp (generated)

012601333.b3lyp_6-31g(d).gjf (generated)

012601333.b3lyp_6-31g(d).firefly.inp (generated)

012601333.b3lyp_6-31g(d).smash.inp (generated)

012601333.b3lyp_6-31g(d).nwchem.inp (generated) 012601333.b3lyp_6-31g(d).log.xz 012601333.td-b3lyp_6-31g+(d).inp 012601333.td-b3lyp_6-31g+(d).log.xz

012601333.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601333.td-b3lyp_6-31+g(d).gjf (generated)

012601333.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601333.mol 012601333.PUBCHEM 012601333.mol (via Jmol)
012601334.b3lyp_6-31g(d).inp

012601334.b3lyp_6-31g(d).qchem.inp (generated)

012601334.b3lyp_6-31g(d).gjf (generated)

012601334.b3lyp_6-31g(d).firefly.inp (generated)

012601334.b3lyp_6-31g(d).smash.inp (generated)

012601334.b3lyp_6-31g(d).nwchem.inp (generated) 012601334.b3lyp_6-31g(d).log.xz 012601334.td-b3lyp_6-31g+(d).inp 012601334.td-b3lyp_6-31g+(d).log.xz

012601334.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601334.td-b3lyp_6-31+g(d).gjf (generated)

012601334.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601334.mol 012601334.PUBCHEM 012601334.mol (via Jmol)
012601431.b3lyp_6-31g(d).inp

012601431.b3lyp_6-31g(d).qchem.inp (generated)

012601431.b3lyp_6-31g(d).gjf (generated)

012601431.b3lyp_6-31g(d).firefly.inp (generated)

012601431.b3lyp_6-31g(d).smash.inp (generated)

012601431.b3lyp_6-31g(d).nwchem.inp (generated) 012601431.b3lyp_6-31g(d).log.xz 012601431.td-b3lyp_6-31g+(d).inp 012601431.td-b3lyp_6-31g+(d).log.xz

012601431.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601431.td-b3lyp_6-31+g(d).gjf (generated)

012601431.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601431.mol 012601431.PUBCHEM 012601431.mol (via Jmol)
012601432.b3lyp_6-31g(d).inp

012601432.b3lyp_6-31g(d).qchem.inp (generated)

012601432.b3lyp_6-31g(d).gjf (generated)

012601432.b3lyp_6-31g(d).firefly.inp (generated)

012601432.b3lyp_6-31g(d).smash.inp (generated)

012601432.b3lyp_6-31g(d).nwchem.inp (generated) 012601432.b3lyp_6-31g(d).log.xz 012601432.td-b3lyp_6-31g+(d).inp 012601432.td-b3lyp_6-31g+(d).log.xz

012601432.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601432.td-b3lyp_6-31+g(d).gjf (generated)

012601432.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601432.mol 012601432.PUBCHEM 012601432.mol (via Jmol)
012601433.b3lyp_6-31g(d).inp

012601433.b3lyp_6-31g(d).qchem.inp (generated)

012601433.b3lyp_6-31g(d).gjf (generated)

012601433.b3lyp_6-31g(d).firefly.inp (generated)

012601433.b3lyp_6-31g(d).smash.inp (generated)

012601433.b3lyp_6-31g(d).nwchem.inp (generated) 012601433.b3lyp_6-31g(d).log.xz 012601433.td-b3lyp_6-31g+(d).inp 012601433.td-b3lyp_6-31g+(d).log.xz

012601433.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601433.td-b3lyp_6-31+g(d).gjf (generated)

012601433.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601433.mol 012601433.PUBCHEM 012601433.mol (via Jmol)
012601434.b3lyp_6-31g(d).inp

012601434.b3lyp_6-31g(d).qchem.inp (generated)

012601434.b3lyp_6-31g(d).gjf (generated)

012601434.b3lyp_6-31g(d).firefly.inp (generated)

012601434.b3lyp_6-31g(d).smash.inp (generated)

012601434.b3lyp_6-31g(d).nwchem.inp (generated) 012601434.b3lyp_6-31g(d).log.xz 012601434.td-b3lyp_6-31g+(d).inp 012601434.td-b3lyp_6-31g+(d).log.xz

012601434.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601434.td-b3lyp_6-31+g(d).gjf (generated)

012601434.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601434.mol 012601434.PUBCHEM 012601434.mol (via Jmol)
012601436.b3lyp_6-31g(d).inp

012601436.b3lyp_6-31g(d).qchem.inp (generated)

012601436.b3lyp_6-31g(d).gjf (generated)

012601436.b3lyp_6-31g(d).firefly.inp (generated)

012601436.b3lyp_6-31g(d).smash.inp (generated)

012601436.b3lyp_6-31g(d).nwchem.inp (generated) 012601436.b3lyp_6-31g(d).log.xz 012601436.td-b3lyp_6-31g+(d).inp 012601436.td-b3lyp_6-31g+(d).log.xz

012601436.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601436.td-b3lyp_6-31+g(d).gjf (generated)

012601436.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601436.mol 012601436.PUBCHEM 012601436.mol (via Jmol)
012601437.b3lyp_6-31g(d).inp

012601437.b3lyp_6-31g(d).qchem.inp (generated)

012601437.b3lyp_6-31g(d).gjf (generated)

012601437.b3lyp_6-31g(d).firefly.inp (generated)

012601437.b3lyp_6-31g(d).smash.inp (generated)

012601437.b3lyp_6-31g(d).nwchem.inp (generated) 012601437.b3lyp_6-31g(d).log.xz 012601437.td-b3lyp_6-31g+(d).inp 012601437.td-b3lyp_6-31g+(d).log.xz

012601437.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601437.td-b3lyp_6-31+g(d).gjf (generated)

012601437.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601437.mol 012601437.PUBCHEM 012601437.mol (via Jmol)
012601438.b3lyp_6-31g(d).inp

012601438.b3lyp_6-31g(d).qchem.inp (generated)

012601438.b3lyp_6-31g(d).gjf (generated)

012601438.b3lyp_6-31g(d).firefly.inp (generated)

012601438.b3lyp_6-31g(d).smash.inp (generated)

012601438.b3lyp_6-31g(d).nwchem.inp (generated) 012601438.b3lyp_6-31g(d).log.xz 012601438.td-b3lyp_6-31g+(d).inp 012601438.td-b3lyp_6-31g+(d).log.xz

012601438.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601438.td-b3lyp_6-31+g(d).gjf (generated)

012601438.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601438.mol 012601438.PUBCHEM 012601438.mol (via Jmol)
012601439.b3lyp_6-31g(d).inp

012601439.b3lyp_6-31g(d).qchem.inp (generated)

012601439.b3lyp_6-31g(d).gjf (generated)

012601439.b3lyp_6-31g(d).firefly.inp (generated)

012601439.b3lyp_6-31g(d).smash.inp (generated)

012601439.b3lyp_6-31g(d).nwchem.inp (generated) 012601439.b3lyp_6-31g(d).log.xz 012601439.td-b3lyp_6-31g+(d).inp 012601439.td-b3lyp_6-31g+(d).log.xz

012601439.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601439.td-b3lyp_6-31+g(d).gjf (generated)

012601439.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601439.mol 012601439.PUBCHEM 012601439.mol (via Jmol)
012601440.b3lyp_6-31g(d).inp

012601440.b3lyp_6-31g(d).qchem.inp (generated)

012601440.b3lyp_6-31g(d).gjf (generated)

012601440.b3lyp_6-31g(d).firefly.inp (generated)

012601440.b3lyp_6-31g(d).smash.inp (generated)

012601440.b3lyp_6-31g(d).nwchem.inp (generated) 012601440.b3lyp_6-31g(d).log.xz 012601440.td-b3lyp_6-31g+(d).inp 012601440.td-b3lyp_6-31g+(d).log.xz

012601440.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601440.td-b3lyp_6-31+g(d).gjf (generated)

012601440.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601440.mol 012601440.PUBCHEM 012601440.mol (via Jmol)
012601441.b3lyp_6-31g(d).inp

012601441.b3lyp_6-31g(d).qchem.inp (generated)

012601441.b3lyp_6-31g(d).gjf (generated)

012601441.b3lyp_6-31g(d).firefly.inp (generated)

012601441.b3lyp_6-31g(d).smash.inp (generated)

012601441.b3lyp_6-31g(d).nwchem.inp (generated) 012601441.b3lyp_6-31g(d).log.xz 012601441.td-b3lyp_6-31g+(d).inp 012601441.td-b3lyp_6-31g+(d).log.xz

012601441.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601441.td-b3lyp_6-31+g(d).gjf (generated)

012601441.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601441.mol 012601441.PUBCHEM 012601441.mol (via Jmol)
012601442.b3lyp_6-31g(d).inp

012601442.b3lyp_6-31g(d).qchem.inp (generated)

012601442.b3lyp_6-31g(d).gjf (generated)

012601442.b3lyp_6-31g(d).firefly.inp (generated)

012601442.b3lyp_6-31g(d).smash.inp (generated)

012601442.b3lyp_6-31g(d).nwchem.inp (generated) 012601442.b3lyp_6-31g(d).log.xz 012601442.td-b3lyp_6-31g+(d).inp 012601442.td-b3lyp_6-31g+(d).log.xz

012601442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601442.td-b3lyp_6-31+g(d).gjf (generated)

012601442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601442.mol 012601442.PUBCHEM 012601442.mol (via Jmol)
012601444.b3lyp_6-31g(d).inp

012601444.b3lyp_6-31g(d).qchem.inp (generated)

012601444.b3lyp_6-31g(d).gjf (generated)

012601444.b3lyp_6-31g(d).firefly.inp (generated)

012601444.b3lyp_6-31g(d).smash.inp (generated)

012601444.b3lyp_6-31g(d).nwchem.inp (generated) 012601444.b3lyp_6-31g(d).log.xz 012601444.td-b3lyp_6-31g+(d).inp 012601444.td-b3lyp_6-31g+(d).log.xz

012601444.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601444.td-b3lyp_6-31+g(d).gjf (generated)

012601444.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601444.mol 012601444.PUBCHEM 012601444.mol (via Jmol)
012601446.b3lyp_6-31g(d).inp

012601446.b3lyp_6-31g(d).qchem.inp (generated)

012601446.b3lyp_6-31g(d).gjf (generated)

012601446.b3lyp_6-31g(d).firefly.inp (generated)

012601446.b3lyp_6-31g(d).smash.inp (generated)

012601446.b3lyp_6-31g(d).nwchem.inp (generated) 012601446.b3lyp_6-31g(d).log.xz 012601446.td-b3lyp_6-31g+(d).inp 012601446.td-b3lyp_6-31g+(d).log.xz

012601446.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601446.td-b3lyp_6-31+g(d).gjf (generated)

012601446.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601446.mol 012601446.PUBCHEM 012601446.mol (via Jmol)
012601447.b3lyp_6-31g(d).inp

012601447.b3lyp_6-31g(d).qchem.inp (generated)

012601447.b3lyp_6-31g(d).gjf (generated)

012601447.b3lyp_6-31g(d).firefly.inp (generated)

012601447.b3lyp_6-31g(d).smash.inp (generated)

012601447.b3lyp_6-31g(d).nwchem.inp (generated) 012601447.b3lyp_6-31g(d).log.xz 012601447.td-b3lyp_6-31g+(d).inp 012601447.td-b3lyp_6-31g+(d).log.xz

012601447.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601447.td-b3lyp_6-31+g(d).gjf (generated)

012601447.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601447.mol 012601447.PUBCHEM 012601447.mol (via Jmol)
012601448.b3lyp_6-31g(d).inp

012601448.b3lyp_6-31g(d).qchem.inp (generated)

012601448.b3lyp_6-31g(d).gjf (generated)

012601448.b3lyp_6-31g(d).firefly.inp (generated)

012601448.b3lyp_6-31g(d).smash.inp (generated)

012601448.b3lyp_6-31g(d).nwchem.inp (generated) 012601448.b3lyp_6-31g(d).log.xz 012601448.td-b3lyp_6-31g+(d).inp 012601448.td-b3lyp_6-31g+(d).log.xz

012601448.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601448.td-b3lyp_6-31+g(d).gjf (generated)

012601448.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601448.mol 012601448.PUBCHEM 012601448.mol (via Jmol)
012601449.b3lyp_6-31g(d).inp

012601449.b3lyp_6-31g(d).qchem.inp (generated)

012601449.b3lyp_6-31g(d).gjf (generated)

012601449.b3lyp_6-31g(d).firefly.inp (generated)

012601449.b3lyp_6-31g(d).smash.inp (generated)

012601449.b3lyp_6-31g(d).nwchem.inp (generated) 012601449.b3lyp_6-31g(d).log.xz 012601449.td-b3lyp_6-31g+(d).inp 012601449.td-b3lyp_6-31g+(d).log.xz

012601449.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601449.td-b3lyp_6-31+g(d).gjf (generated)

012601449.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601449.mol 012601449.PUBCHEM 012601449.mol (via Jmol)
012601450.b3lyp_6-31g(d).inp

012601450.b3lyp_6-31g(d).qchem.inp (generated)

012601450.b3lyp_6-31g(d).gjf (generated)

012601450.b3lyp_6-31g(d).firefly.inp (generated)

012601450.b3lyp_6-31g(d).smash.inp (generated)

012601450.b3lyp_6-31g(d).nwchem.inp (generated) 012601450.b3lyp_6-31g(d).log.xz 012601450.td-b3lyp_6-31g+(d).inp 012601450.td-b3lyp_6-31g+(d).log.xz

012601450.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601450.td-b3lyp_6-31+g(d).gjf (generated)

012601450.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601450.mol 012601450.PUBCHEM 012601450.mol (via Jmol)
012601457.b3lyp_6-31g(d).inp

012601457.b3lyp_6-31g(d).qchem.inp (generated)

012601457.b3lyp_6-31g(d).gjf (generated)

012601457.b3lyp_6-31g(d).firefly.inp (generated)

012601457.b3lyp_6-31g(d).smash.inp (generated)

012601457.b3lyp_6-31g(d).nwchem.inp (generated) 012601457.b3lyp_6-31g(d).log.xz 012601457.td-b3lyp_6-31g+(d).inp 012601457.td-b3lyp_6-31g+(d).log.xz

012601457.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601457.td-b3lyp_6-31+g(d).gjf (generated)

012601457.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601457.mol 012601457.PUBCHEM 012601457.mol (via Jmol)
012601479.b3lyp_6-31g(d).inp

012601479.b3lyp_6-31g(d).qchem.inp (generated)

012601479.b3lyp_6-31g(d).gjf (generated)

012601479.b3lyp_6-31g(d).firefly.inp (generated)

012601479.b3lyp_6-31g(d).smash.inp (generated)

012601479.b3lyp_6-31g(d).nwchem.inp (generated) 012601479.b3lyp_6-31g(d).log.xz 012601479.td-b3lyp_6-31g+(d).inp 012601479.td-b3lyp_6-31g+(d).log.xz

012601479.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601479.td-b3lyp_6-31+g(d).gjf (generated)

012601479.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601479.mol 012601479.PUBCHEM 012601479.mol (via Jmol)
012601485.b3lyp_6-31g(d).inp

012601485.b3lyp_6-31g(d).qchem.inp (generated)

012601485.b3lyp_6-31g(d).gjf (generated)

012601485.b3lyp_6-31g(d).firefly.inp (generated)

012601485.b3lyp_6-31g(d).smash.inp (generated)

012601485.b3lyp_6-31g(d).nwchem.inp (generated) 012601485.b3lyp_6-31g(d).log.xz 012601485.td-b3lyp_6-31g+(d).inp 012601485.td-b3lyp_6-31g+(d).log.xz

012601485.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601485.td-b3lyp_6-31+g(d).gjf (generated)

012601485.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601485.mol 012601485.PUBCHEM 012601485.mol (via Jmol)
012601490.b3lyp_6-31g(d).inp

012601490.b3lyp_6-31g(d).qchem.inp (generated)

012601490.b3lyp_6-31g(d).gjf (generated)

012601490.b3lyp_6-31g(d).firefly.inp (generated)

012601490.b3lyp_6-31g(d).smash.inp (generated)

012601490.b3lyp_6-31g(d).nwchem.inp (generated) 012601490.b3lyp_6-31g(d).log.xz 012601490.td-b3lyp_6-31g+(d).inp 012601490.td-b3lyp_6-31g+(d).log.xz

012601490.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601490.td-b3lyp_6-31+g(d).gjf (generated)

012601490.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601490.mol 012601490.PUBCHEM 012601490.mol (via Jmol)
012601559.b3lyp_6-31g(d).inp

012601559.b3lyp_6-31g(d).qchem.inp (generated)

012601559.b3lyp_6-31g(d).gjf (generated)

012601559.b3lyp_6-31g(d).firefly.inp (generated)

012601559.b3lyp_6-31g(d).smash.inp (generated)

012601559.b3lyp_6-31g(d).nwchem.inp (generated) 012601559.b3lyp_6-31g(d).log.xz 012601559.td-b3lyp_6-31g+(d).inp 012601559.td-b3lyp_6-31g+(d).log.xz

012601559.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601559.td-b3lyp_6-31+g(d).gjf (generated)

012601559.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601559.mol 012601559.PUBCHEM 012601559.mol (via Jmol)
012601560.b3lyp_6-31g(d).inp

012601560.b3lyp_6-31g(d).qchem.inp (generated)

012601560.b3lyp_6-31g(d).gjf (generated)

012601560.b3lyp_6-31g(d).firefly.inp (generated)

012601560.b3lyp_6-31g(d).smash.inp (generated)

012601560.b3lyp_6-31g(d).nwchem.inp (generated) 012601560.b3lyp_6-31g(d).log.xz 012601560.td-b3lyp_6-31g+(d).inp 012601560.td-b3lyp_6-31g+(d).log.xz

012601560.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601560.td-b3lyp_6-31+g(d).gjf (generated)

012601560.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601560.mol 012601560.PUBCHEM 012601560.mol (via Jmol)
012601562.b3lyp_6-31g(d).inp

012601562.b3lyp_6-31g(d).qchem.inp (generated)

012601562.b3lyp_6-31g(d).gjf (generated)

012601562.b3lyp_6-31g(d).firefly.inp (generated)

012601562.b3lyp_6-31g(d).smash.inp (generated)

012601562.b3lyp_6-31g(d).nwchem.inp (generated) 012601562.b3lyp_6-31g(d).log.xz 012601562.td-b3lyp_6-31g+(d).inp 012601562.td-b3lyp_6-31g+(d).log.xz

012601562.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601562.td-b3lyp_6-31+g(d).gjf (generated)

012601562.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601562.mol 012601562.PUBCHEM 012601562.mol (via Jmol)
012601564.b3lyp_6-31g(d).inp

012601564.b3lyp_6-31g(d).qchem.inp (generated)

012601564.b3lyp_6-31g(d).gjf (generated)

012601564.b3lyp_6-31g(d).firefly.inp (generated)

012601564.b3lyp_6-31g(d).smash.inp (generated)

012601564.b3lyp_6-31g(d).nwchem.inp (generated) 012601564.b3lyp_6-31g(d).log.xz 012601564.td-b3lyp_6-31g+(d).inp 012601564.td-b3lyp_6-31g+(d).log.xz

012601564.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601564.td-b3lyp_6-31+g(d).gjf (generated)

012601564.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601564.mol 012601564.PUBCHEM 012601564.mol (via Jmol)
012601568.b3lyp_6-31g(d).inp

012601568.b3lyp_6-31g(d).qchem.inp (generated)

012601568.b3lyp_6-31g(d).gjf (generated)

012601568.b3lyp_6-31g(d).firefly.inp (generated)

012601568.b3lyp_6-31g(d).smash.inp (generated)

012601568.b3lyp_6-31g(d).nwchem.inp (generated) 012601568.b3lyp_6-31g(d).log.xz 012601568.td-b3lyp_6-31g+(d).inp 012601568.td-b3lyp_6-31g+(d).log.xz

012601568.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601568.td-b3lyp_6-31+g(d).gjf (generated)

012601568.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601568.mol 012601568.PUBCHEM 012601568.mol (via Jmol)
012601608.b3lyp_6-31g(d).inp

012601608.b3lyp_6-31g(d).qchem.inp (generated)

012601608.b3lyp_6-31g(d).gjf (generated)

012601608.b3lyp_6-31g(d).firefly.inp (generated)

012601608.b3lyp_6-31g(d).smash.inp (generated)

012601608.b3lyp_6-31g(d).nwchem.inp (generated) 012601608.b3lyp_6-31g(d).log.xz 012601608.td-b3lyp_6-31g+(d).inp 012601608.td-b3lyp_6-31g+(d).log.xz

012601608.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601608.td-b3lyp_6-31+g(d).gjf (generated)

012601608.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601608.mol 012601608.PUBCHEM 012601608.mol (via Jmol)
012601609.b3lyp_6-31g(d).inp

012601609.b3lyp_6-31g(d).qchem.inp (generated)

012601609.b3lyp_6-31g(d).gjf (generated)

012601609.b3lyp_6-31g(d).firefly.inp (generated)

012601609.b3lyp_6-31g(d).smash.inp (generated)

012601609.b3lyp_6-31g(d).nwchem.inp (generated) 012601609.b3lyp_6-31g(d).log.xz 012601609.td-b3lyp_6-31g+(d).inp 012601609.td-b3lyp_6-31g+(d).log.xz

012601609.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601609.td-b3lyp_6-31+g(d).gjf (generated)

012601609.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601609.mol 012601609.PUBCHEM 012601609.mol (via Jmol)
012601610.b3lyp_6-31g(d).inp

012601610.b3lyp_6-31g(d).qchem.inp (generated)

012601610.b3lyp_6-31g(d).gjf (generated)

012601610.b3lyp_6-31g(d).firefly.inp (generated)

012601610.b3lyp_6-31g(d).smash.inp (generated)

012601610.b3lyp_6-31g(d).nwchem.inp (generated) 012601610.b3lyp_6-31g(d).log.xz 012601610.td-b3lyp_6-31g+(d).inp 012601610.td-b3lyp_6-31g+(d).log.xz

012601610.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601610.td-b3lyp_6-31+g(d).gjf (generated)

012601610.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601610.mol 012601610.PUBCHEM 012601610.mol (via Jmol)
012601615.b3lyp_6-31g(d).inp

012601615.b3lyp_6-31g(d).qchem.inp (generated)

012601615.b3lyp_6-31g(d).gjf (generated)

012601615.b3lyp_6-31g(d).firefly.inp (generated)

012601615.b3lyp_6-31g(d).smash.inp (generated)

012601615.b3lyp_6-31g(d).nwchem.inp (generated) 012601615.b3lyp_6-31g(d).log.xz 012601615.td-b3lyp_6-31g+(d).inp 012601615.td-b3lyp_6-31g+(d).log.xz

012601615.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601615.td-b3lyp_6-31+g(d).gjf (generated)

012601615.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601615.mol 012601615.PUBCHEM 012601615.mol (via Jmol)
012601617.b3lyp_6-31g(d).inp

012601617.b3lyp_6-31g(d).qchem.inp (generated)

012601617.b3lyp_6-31g(d).gjf (generated)

012601617.b3lyp_6-31g(d).firefly.inp (generated)

012601617.b3lyp_6-31g(d).smash.inp (generated)

012601617.b3lyp_6-31g(d).nwchem.inp (generated) 012601617.b3lyp_6-31g(d).log.xz 012601617.td-b3lyp_6-31g+(d).inp 012601617.td-b3lyp_6-31g+(d).log.xz

012601617.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601617.td-b3lyp_6-31+g(d).gjf (generated)

012601617.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601617.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601617.mol 012601617.PUBCHEM 012601617.mol (via Jmol)
012601697.b3lyp_6-31g(d).inp

012601697.b3lyp_6-31g(d).qchem.inp (generated)

012601697.b3lyp_6-31g(d).gjf (generated)

012601697.b3lyp_6-31g(d).firefly.inp (generated)

012601697.b3lyp_6-31g(d).smash.inp (generated)

012601697.b3lyp_6-31g(d).nwchem.inp (generated) 012601697.b3lyp_6-31g(d).log.xz 012601697.td-b3lyp_6-31g+(d).inp 012601697.td-b3lyp_6-31g+(d).log.xz

012601697.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601697.td-b3lyp_6-31+g(d).gjf (generated)

012601697.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601697.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601697.mol 012601697.PUBCHEM 012601697.mol (via Jmol)
012601741.b3lyp_6-31g(d).inp

012601741.b3lyp_6-31g(d).qchem.inp (generated)

012601741.b3lyp_6-31g(d).gjf (generated)

012601741.b3lyp_6-31g(d).firefly.inp (generated)

012601741.b3lyp_6-31g(d).smash.inp (generated)

012601741.b3lyp_6-31g(d).nwchem.inp (generated) 012601741.b3lyp_6-31g(d).log.xz 012601741.mol 012601741.PUBCHEM 012601741.mol (via Jmol)
012601752.b3lyp_6-31g(d).inp

012601752.b3lyp_6-31g(d).qchem.inp (generated)

012601752.b3lyp_6-31g(d).gjf (generated)

012601752.b3lyp_6-31g(d).firefly.inp (generated)

012601752.b3lyp_6-31g(d).smash.inp (generated)

012601752.b3lyp_6-31g(d).nwchem.inp (generated) 012601752.b3lyp_6-31g(d).log.xz 012601752.mol 012601752.PUBCHEM 012601752.mol (via Jmol)
012601823.b3lyp_6-31g(d).inp

012601823.b3lyp_6-31g(d).qchem.inp (generated)

012601823.b3lyp_6-31g(d).gjf (generated)

012601823.b3lyp_6-31g(d).firefly.inp (generated)

012601823.b3lyp_6-31g(d).smash.inp (generated)

012601823.b3lyp_6-31g(d).nwchem.inp (generated) 012601823.b3lyp_6-31g(d).log.xz 012601823.td-b3lyp_6-31g+(d).inp 012601823.td-b3lyp_6-31g+(d).log.xz

012601823.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601823.td-b3lyp_6-31+g(d).gjf (generated)

012601823.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601823.mol 012601823.PUBCHEM 012601823.mol (via Jmol)
012601848.b3lyp_6-31g(d).inp

012601848.b3lyp_6-31g(d).qchem.inp (generated)

012601848.b3lyp_6-31g(d).gjf (generated)

012601848.b3lyp_6-31g(d).firefly.inp (generated)

012601848.b3lyp_6-31g(d).smash.inp (generated)

012601848.b3lyp_6-31g(d).nwchem.inp (generated) 012601848.b3lyp_6-31g(d).log.xz 012601848.td-b3lyp_6-31g+(d).inp 012601848.td-b3lyp_6-31g+(d).log.xz

012601848.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601848.td-b3lyp_6-31+g(d).gjf (generated)

012601848.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601848.mol 012601848.PUBCHEM 012601848.mol (via Jmol)
012601870.b3lyp_6-31g(d).inp

012601870.b3lyp_6-31g(d).qchem.inp (generated)

012601870.b3lyp_6-31g(d).gjf (generated)

012601870.b3lyp_6-31g(d).firefly.inp (generated)

012601870.b3lyp_6-31g(d).smash.inp (generated)

012601870.b3lyp_6-31g(d).nwchem.inp (generated) 012601870.b3lyp_6-31g(d).log.xz 012601870.td-b3lyp_6-31g+(d).inp 012601870.td-b3lyp_6-31g+(d).log.xz

012601870.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601870.td-b3lyp_6-31+g(d).gjf (generated)

012601870.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601870.mol 012601870.PUBCHEM 012601870.mol (via Jmol)
012601871.b3lyp_6-31g(d).inp

012601871.b3lyp_6-31g(d).qchem.inp (generated)

012601871.b3lyp_6-31g(d).gjf (generated)

012601871.b3lyp_6-31g(d).firefly.inp (generated)

012601871.b3lyp_6-31g(d).smash.inp (generated)

012601871.b3lyp_6-31g(d).nwchem.inp (generated) 012601871.b3lyp_6-31g(d).log.xz 012601871.td-b3lyp_6-31g+(d).inp 012601871.td-b3lyp_6-31g+(d).log.xz

012601871.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601871.td-b3lyp_6-31+g(d).gjf (generated)

012601871.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601871.mol 012601871.PUBCHEM 012601871.mol (via Jmol)
012601886.b3lyp_6-31g(d).inp

012601886.b3lyp_6-31g(d).qchem.inp (generated)

012601886.b3lyp_6-31g(d).gjf (generated)

012601886.b3lyp_6-31g(d).firefly.inp (generated)

012601886.b3lyp_6-31g(d).smash.inp (generated)

012601886.b3lyp_6-31g(d).nwchem.inp (generated) 012601886.b3lyp_6-31g(d).log.xz 012601886.mol 012601886.PUBCHEM 012601886.mol (via Jmol)
012601891.b3lyp_6-31g(d).inp

012601891.b3lyp_6-31g(d).qchem.inp (generated)

012601891.b3lyp_6-31g(d).gjf (generated)

012601891.b3lyp_6-31g(d).firefly.inp (generated)

012601891.b3lyp_6-31g(d).smash.inp (generated)

012601891.b3lyp_6-31g(d).nwchem.inp (generated) 012601891.b3lyp_6-31g(d).log.xz 012601891.td-b3lyp_6-31g+(d).inp 012601891.td-b3lyp_6-31g+(d).log.xz

012601891.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601891.td-b3lyp_6-31+g(d).gjf (generated)

012601891.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601891.mol 012601891.PUBCHEM 012601891.mol (via Jmol)
012601908.b3lyp_6-31g(d).inp

012601908.b3lyp_6-31g(d).qchem.inp (generated)

012601908.b3lyp_6-31g(d).gjf (generated)

012601908.b3lyp_6-31g(d).firefly.inp (generated)

012601908.b3lyp_6-31g(d).smash.inp (generated)

012601908.b3lyp_6-31g(d).nwchem.inp (generated) 012601908.b3lyp_6-31g(d).log.xz 012601908.td-b3lyp_6-31g+(d).inp 012601908.td-b3lyp_6-31g+(d).log.xz

012601908.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601908.td-b3lyp_6-31+g(d).gjf (generated)

012601908.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601908.mol 012601908.PUBCHEM 012601908.mol (via Jmol)
012601909.b3lyp_6-31g(d).inp

012601909.b3lyp_6-31g(d).qchem.inp (generated)

012601909.b3lyp_6-31g(d).gjf (generated)

012601909.b3lyp_6-31g(d).firefly.inp (generated)

012601909.b3lyp_6-31g(d).smash.inp (generated)

012601909.b3lyp_6-31g(d).nwchem.inp (generated) 012601909.b3lyp_6-31g(d).log.xz 012601909.td-b3lyp_6-31g+(d).inp 012601909.td-b3lyp_6-31g+(d).log.xz

012601909.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601909.td-b3lyp_6-31+g(d).gjf (generated)

012601909.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601909.mol 012601909.PUBCHEM 012601909.mol (via Jmol)
012601919.b3lyp_6-31g(d).inp

012601919.b3lyp_6-31g(d).qchem.inp (generated)

012601919.b3lyp_6-31g(d).gjf (generated)

012601919.b3lyp_6-31g(d).firefly.inp (generated)

012601919.b3lyp_6-31g(d).smash.inp (generated)

012601919.b3lyp_6-31g(d).nwchem.inp (generated) 012601919.b3lyp_6-31g(d).log.xz 012601919.td-b3lyp_6-31g+(d).inp 012601919.td-b3lyp_6-31g+(d).log.xz

012601919.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601919.td-b3lyp_6-31+g(d).gjf (generated)

012601919.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601919.mol 012601919.PUBCHEM 012601919.mol (via Jmol)
012601974.b3lyp_6-31g(d).inp

012601974.b3lyp_6-31g(d).qchem.inp (generated)

012601974.b3lyp_6-31g(d).gjf (generated)

012601974.b3lyp_6-31g(d).firefly.inp (generated)

012601974.b3lyp_6-31g(d).smash.inp (generated)

012601974.b3lyp_6-31g(d).nwchem.inp (generated) 012601974.b3lyp_6-31g(d).log.xz 012601974.td-b3lyp_6-31g+(d).inp 012601974.td-b3lyp_6-31g+(d).log.xz

012601974.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601974.td-b3lyp_6-31+g(d).gjf (generated)

012601974.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601974.mol 012601974.PUBCHEM 012601974.mol (via Jmol)
012601975.b3lyp_6-31g(d).inp

012601975.b3lyp_6-31g(d).qchem.inp (generated)

012601975.b3lyp_6-31g(d).gjf (generated)

012601975.b3lyp_6-31g(d).firefly.inp (generated)

012601975.b3lyp_6-31g(d).smash.inp (generated)

012601975.b3lyp_6-31g(d).nwchem.inp (generated) 012601975.b3lyp_6-31g(d).log.xz 012601975.td-b3lyp_6-31g+(d).inp 012601975.td-b3lyp_6-31g+(d).log.xz

012601975.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601975.td-b3lyp_6-31+g(d).gjf (generated)

012601975.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601975.mol 012601975.PUBCHEM 012601975.mol (via Jmol)
012601976.b3lyp_6-31g(d).inp

012601976.b3lyp_6-31g(d).qchem.inp (generated)

012601976.b3lyp_6-31g(d).gjf (generated)

012601976.b3lyp_6-31g(d).firefly.inp (generated)

012601976.b3lyp_6-31g(d).smash.inp (generated)

012601976.b3lyp_6-31g(d).nwchem.inp (generated) 012601976.b3lyp_6-31g(d).log.xz 012601976.mol 012601976.PUBCHEM 012601976.mol (via Jmol)
012601977.b3lyp_6-31g(d).inp

012601977.b3lyp_6-31g(d).qchem.inp (generated)

012601977.b3lyp_6-31g(d).gjf (generated)

012601977.b3lyp_6-31g(d).firefly.inp (generated)

012601977.b3lyp_6-31g(d).smash.inp (generated)

012601977.b3lyp_6-31g(d).nwchem.inp (generated) 012601977.b3lyp_6-31g(d).log.xz 012601977.td-b3lyp_6-31g+(d).inp 012601977.td-b3lyp_6-31g+(d).log.xz

012601977.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601977.td-b3lyp_6-31+g(d).gjf (generated)

012601977.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601977.mol 012601977.PUBCHEM 012601977.mol (via Jmol)
012601978.b3lyp_6-31g(d).inp

012601978.b3lyp_6-31g(d).qchem.inp (generated)

012601978.b3lyp_6-31g(d).gjf (generated)

012601978.b3lyp_6-31g(d).firefly.inp (generated)

012601978.b3lyp_6-31g(d).smash.inp (generated)

012601978.b3lyp_6-31g(d).nwchem.inp (generated) 012601978.b3lyp_6-31g(d).log.xz 012601978.mol 012601978.PUBCHEM 012601978.mol (via Jmol)
012601983.b3lyp_6-31g(d).inp

012601983.b3lyp_6-31g(d).qchem.inp (generated)

012601983.b3lyp_6-31g(d).gjf (generated)

012601983.b3lyp_6-31g(d).firefly.inp (generated)

012601983.b3lyp_6-31g(d).smash.inp (generated)

012601983.b3lyp_6-31g(d).nwchem.inp (generated) 012601983.b3lyp_6-31g(d).log.xz 012601983.td-b3lyp_6-31g+(d).inp 012601983.td-b3lyp_6-31g+(d).log.xz

012601983.td-b3lyp_6-31+g(d).qchem.inp (generated)

012601983.td-b3lyp_6-31+g(d).gjf (generated)

012601983.td-b3lyp_6-31+g(d).firefly.inp (generated)

012601983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012601983.mol 012601983.PUBCHEM 012601983.mol (via Jmol)
012602004.b3lyp_6-31g(d).inp

012602004.b3lyp_6-31g(d).qchem.inp (generated)

012602004.b3lyp_6-31g(d).gjf (generated)

012602004.b3lyp_6-31g(d).firefly.inp (generated)

012602004.b3lyp_6-31g(d).smash.inp (generated)

012602004.b3lyp_6-31g(d).nwchem.inp (generated) 012602004.b3lyp_6-31g(d).log.xz 012602004.td-b3lyp_6-31g+(d).inp 012602004.td-b3lyp_6-31g+(d).log.xz

012602004.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602004.td-b3lyp_6-31+g(d).gjf (generated)

012602004.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602004.mol 012602004.PUBCHEM 012602004.mol (via Jmol)
012602027.b3lyp_6-31g(d).inp

012602027.b3lyp_6-31g(d).qchem.inp (generated)

012602027.b3lyp_6-31g(d).gjf (generated)

012602027.b3lyp_6-31g(d).firefly.inp (generated)

012602027.b3lyp_6-31g(d).smash.inp (generated)

012602027.b3lyp_6-31g(d).nwchem.inp (generated) 012602027.b3lyp_6-31g(d).log.xz 012602027.td-b3lyp_6-31g+(d).inp 012602027.td-b3lyp_6-31g+(d).log.xz

012602027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602027.td-b3lyp_6-31+g(d).gjf (generated)

012602027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602027.mol 012602027.PUBCHEM 012602027.mol (via Jmol)
012602031.b3lyp_6-31g(d).inp

012602031.b3lyp_6-31g(d).qchem.inp (generated)

012602031.b3lyp_6-31g(d).gjf (generated)

012602031.b3lyp_6-31g(d).firefly.inp (generated)

012602031.b3lyp_6-31g(d).smash.inp (generated)

012602031.b3lyp_6-31g(d).nwchem.inp (generated) 012602031.b3lyp_6-31g(d).log.xz 012602031.td-b3lyp_6-31g+(d).inp 012602031.td-b3lyp_6-31g+(d).log.xz

012602031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602031.td-b3lyp_6-31+g(d).gjf (generated)

012602031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602031.mol 012602031.PUBCHEM 012602031.mol (via Jmol)
012602048.b3lyp_6-31g(d).inp

012602048.b3lyp_6-31g(d).qchem.inp (generated)

012602048.b3lyp_6-31g(d).gjf (generated)

012602048.b3lyp_6-31g(d).firefly.inp (generated)

012602048.b3lyp_6-31g(d).smash.inp (generated)

012602048.b3lyp_6-31g(d).nwchem.inp (generated) 012602048.b3lyp_6-31g(d).log.xz 012602048.td-b3lyp_6-31g+(d).inp 012602048.td-b3lyp_6-31g+(d).log.xz

012602048.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602048.td-b3lyp_6-31+g(d).gjf (generated)

012602048.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602048.mol 012602048.PUBCHEM 012602048.mol (via Jmol)
012602079.b3lyp_6-31g(d).inp

012602079.b3lyp_6-31g(d).qchem.inp (generated)

012602079.b3lyp_6-31g(d).gjf (generated)

012602079.b3lyp_6-31g(d).firefly.inp (generated)

012602079.b3lyp_6-31g(d).smash.inp (generated)

012602079.b3lyp_6-31g(d).nwchem.inp (generated) 012602079.b3lyp_6-31g(d).log.xz 012602079.td-b3lyp_6-31g+(d).inp 012602079.td-b3lyp_6-31g+(d).log.xz

012602079.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602079.td-b3lyp_6-31+g(d).gjf (generated)

012602079.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602079.mol 012602079.PUBCHEM 012602079.mol (via Jmol)
012602087.b3lyp_6-31g(d).inp

012602087.b3lyp_6-31g(d).qchem.inp (generated)

012602087.b3lyp_6-31g(d).gjf (generated)

012602087.b3lyp_6-31g(d).firefly.inp (generated)

012602087.b3lyp_6-31g(d).smash.inp (generated)

012602087.b3lyp_6-31g(d).nwchem.inp (generated) 012602087.b3lyp_6-31g(d).log.xz 012602087.td-b3lyp_6-31g+(d).inp 012602087.td-b3lyp_6-31g+(d).log.xz

012602087.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602087.td-b3lyp_6-31+g(d).gjf (generated)

012602087.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602087.mol 012602087.PUBCHEM 012602087.mol (via Jmol)
012602095.b3lyp_6-31g(d).inp

012602095.b3lyp_6-31g(d).qchem.inp (generated)

012602095.b3lyp_6-31g(d).gjf (generated)

012602095.b3lyp_6-31g(d).firefly.inp (generated)

012602095.b3lyp_6-31g(d).smash.inp (generated)

012602095.b3lyp_6-31g(d).nwchem.inp (generated) 012602095.b3lyp_6-31g(d).log.xz 012602095.td-b3lyp_6-31g+(d).inp 012602095.td-b3lyp_6-31g+(d).log.xz

012602095.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602095.td-b3lyp_6-31+g(d).gjf (generated)

012602095.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602095.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602095.mol 012602095.PUBCHEM 012602095.mol (via Jmol)
012602096.b3lyp_6-31g(d).inp

012602096.b3lyp_6-31g(d).qchem.inp (generated)

012602096.b3lyp_6-31g(d).gjf (generated)

012602096.b3lyp_6-31g(d).firefly.inp (generated)

012602096.b3lyp_6-31g(d).smash.inp (generated)

012602096.b3lyp_6-31g(d).nwchem.inp (generated) 012602096.b3lyp_6-31g(d).log.xz 012602096.td-b3lyp_6-31g+(d).inp 012602096.td-b3lyp_6-31g+(d).log.xz

012602096.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602096.td-b3lyp_6-31+g(d).gjf (generated)

012602096.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602096.mol 012602096.PUBCHEM 012602096.mol (via Jmol)
012602097.b3lyp_6-31g(d).inp

012602097.b3lyp_6-31g(d).qchem.inp (generated)

012602097.b3lyp_6-31g(d).gjf (generated)

012602097.b3lyp_6-31g(d).firefly.inp (generated)

012602097.b3lyp_6-31g(d).smash.inp (generated)

012602097.b3lyp_6-31g(d).nwchem.inp (generated) 012602097.b3lyp_6-31g(d).log.xz 012602097.td-b3lyp_6-31g+(d).inp 012602097.td-b3lyp_6-31g+(d).log.xz

012602097.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602097.td-b3lyp_6-31+g(d).gjf (generated)

012602097.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602097.mol 012602097.PUBCHEM 012602097.mol (via Jmol)
012602112.b3lyp_6-31g(d).inp

012602112.b3lyp_6-31g(d).qchem.inp (generated)

012602112.b3lyp_6-31g(d).gjf (generated)

012602112.b3lyp_6-31g(d).firefly.inp (generated)

012602112.b3lyp_6-31g(d).smash.inp (generated)

012602112.b3lyp_6-31g(d).nwchem.inp (generated) 012602112.b3lyp_6-31g(d).log.xz 012602112.td-b3lyp_6-31g+(d).inp 012602112.td-b3lyp_6-31g+(d).log.xz

012602112.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602112.td-b3lyp_6-31+g(d).gjf (generated)

012602112.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602112.mol 012602112.PUBCHEM 012602112.mol (via Jmol)
012602113.b3lyp_6-31g(d).inp

012602113.b3lyp_6-31g(d).qchem.inp (generated)

012602113.b3lyp_6-31g(d).gjf (generated)

012602113.b3lyp_6-31g(d).firefly.inp (generated)

012602113.b3lyp_6-31g(d).smash.inp (generated)

012602113.b3lyp_6-31g(d).nwchem.inp (generated) 012602113.b3lyp_6-31g(d).log.xz 012602113.td-b3lyp_6-31g+(d).inp 012602113.td-b3lyp_6-31g+(d).log.xz

012602113.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602113.td-b3lyp_6-31+g(d).gjf (generated)

012602113.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602113.mol 012602113.PUBCHEM 012602113.mol (via Jmol)
012602114.b3lyp_6-31g(d).inp

012602114.b3lyp_6-31g(d).qchem.inp (generated)

012602114.b3lyp_6-31g(d).gjf (generated)

012602114.b3lyp_6-31g(d).firefly.inp (generated)

012602114.b3lyp_6-31g(d).smash.inp (generated)

012602114.b3lyp_6-31g(d).nwchem.inp (generated) 012602114.b3lyp_6-31g(d).log.xz 012602114.td-b3lyp_6-31g+(d).inp 012602114.td-b3lyp_6-31g+(d).log.xz

012602114.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602114.td-b3lyp_6-31+g(d).gjf (generated)

012602114.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602114.mol 012602114.PUBCHEM 012602114.mol (via Jmol)
012602115.b3lyp_6-31g(d).inp

012602115.b3lyp_6-31g(d).qchem.inp (generated)

012602115.b3lyp_6-31g(d).gjf (generated)

012602115.b3lyp_6-31g(d).firefly.inp (generated)

012602115.b3lyp_6-31g(d).smash.inp (generated)

012602115.b3lyp_6-31g(d).nwchem.inp (generated) 012602115.b3lyp_6-31g(d).log.xz 012602115.td-b3lyp_6-31g+(d).inp 012602115.td-b3lyp_6-31g+(d).log.xz

012602115.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602115.td-b3lyp_6-31+g(d).gjf (generated)

012602115.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602115.mol 012602115.PUBCHEM 012602115.mol (via Jmol)
012602116.b3lyp_6-31g(d).inp

012602116.b3lyp_6-31g(d).qchem.inp (generated)

012602116.b3lyp_6-31g(d).gjf (generated)

012602116.b3lyp_6-31g(d).firefly.inp (generated)

012602116.b3lyp_6-31g(d).smash.inp (generated)

012602116.b3lyp_6-31g(d).nwchem.inp (generated) 012602116.b3lyp_6-31g(d).log.xz 012602116.td-b3lyp_6-31g+(d).inp 012602116.td-b3lyp_6-31g+(d).log.xz

012602116.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602116.td-b3lyp_6-31+g(d).gjf (generated)

012602116.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602116.mol 012602116.PUBCHEM 012602116.mol (via Jmol)
012602118.b3lyp_6-31g(d).inp

012602118.b3lyp_6-31g(d).qchem.inp (generated)

012602118.b3lyp_6-31g(d).gjf (generated)

012602118.b3lyp_6-31g(d).firefly.inp (generated)

012602118.b3lyp_6-31g(d).smash.inp (generated)

012602118.b3lyp_6-31g(d).nwchem.inp (generated) 012602118.b3lyp_6-31g(d).log.xz 012602118.mol 012602118.PUBCHEM 012602118.mol (via Jmol)
012602150.b3lyp_6-31g(d).inp

012602150.b3lyp_6-31g(d).qchem.inp (generated)

012602150.b3lyp_6-31g(d).gjf (generated)

012602150.b3lyp_6-31g(d).firefly.inp (generated)

012602150.b3lyp_6-31g(d).smash.inp (generated)

012602150.b3lyp_6-31g(d).nwchem.inp (generated) 012602150.b3lyp_6-31g(d).log.xz 012602150.td-b3lyp_6-31g+(d).inp 012602150.td-b3lyp_6-31g+(d).log.xz

012602150.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602150.td-b3lyp_6-31+g(d).gjf (generated)

012602150.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602150.mol 012602150.PUBCHEM 012602150.mol (via Jmol)
012602151.b3lyp_6-31g(d).inp

012602151.b3lyp_6-31g(d).qchem.inp (generated)

012602151.b3lyp_6-31g(d).gjf (generated)

012602151.b3lyp_6-31g(d).firefly.inp (generated)

012602151.b3lyp_6-31g(d).smash.inp (generated)

012602151.b3lyp_6-31g(d).nwchem.inp (generated) 012602151.b3lyp_6-31g(d).log.xz 012602151.td-b3lyp_6-31g+(d).inp 012602151.td-b3lyp_6-31g+(d).log.xz

012602151.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602151.td-b3lyp_6-31+g(d).gjf (generated)

012602151.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602151.mol 012602151.PUBCHEM 012602151.mol (via Jmol)
012602159.b3lyp_6-31g(d).inp

012602159.b3lyp_6-31g(d).qchem.inp (generated)

012602159.b3lyp_6-31g(d).gjf (generated)

012602159.b3lyp_6-31g(d).firefly.inp (generated)

012602159.b3lyp_6-31g(d).smash.inp (generated)

012602159.b3lyp_6-31g(d).nwchem.inp (generated) 012602159.b3lyp_6-31g(d).log.xz 012602159.td-b3lyp_6-31g+(d).inp 012602159.td-b3lyp_6-31g+(d).log.xz

012602159.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602159.td-b3lyp_6-31+g(d).gjf (generated)

012602159.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602159.mol 012602159.PUBCHEM 012602159.mol (via Jmol)
012602161.b3lyp_6-31g(d).inp

012602161.b3lyp_6-31g(d).qchem.inp (generated)

012602161.b3lyp_6-31g(d).gjf (generated)

012602161.b3lyp_6-31g(d).firefly.inp (generated)

012602161.b3lyp_6-31g(d).smash.inp (generated)

012602161.b3lyp_6-31g(d).nwchem.inp (generated) 012602161.b3lyp_6-31g(d).log.xz 012602161.td-b3lyp_6-31g+(d).inp 012602161.td-b3lyp_6-31g+(d).log.xz

012602161.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602161.td-b3lyp_6-31+g(d).gjf (generated)

012602161.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602161.mol 012602161.PUBCHEM 012602161.mol (via Jmol)
012602163.b3lyp_6-31g(d).inp

012602163.b3lyp_6-31g(d).qchem.inp (generated)

012602163.b3lyp_6-31g(d).gjf (generated)

012602163.b3lyp_6-31g(d).firefly.inp (generated)

012602163.b3lyp_6-31g(d).smash.inp (generated)

012602163.b3lyp_6-31g(d).nwchem.inp (generated) 012602163.b3lyp_6-31g(d).log.xz 012602163.td-b3lyp_6-31g+(d).inp 012602163.td-b3lyp_6-31g+(d).log.xz

012602163.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602163.td-b3lyp_6-31+g(d).gjf (generated)

012602163.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602163.mol 012602163.PUBCHEM 012602163.mol (via Jmol)
012602164.b3lyp_6-31g(d).inp

012602164.b3lyp_6-31g(d).qchem.inp (generated)

012602164.b3lyp_6-31g(d).gjf (generated)

012602164.b3lyp_6-31g(d).firefly.inp (generated)

012602164.b3lyp_6-31g(d).smash.inp (generated)

012602164.b3lyp_6-31g(d).nwchem.inp (generated) 012602164.b3lyp_6-31g(d).log.xz 012602164.td-b3lyp_6-31g+(d).inp 012602164.td-b3lyp_6-31g+(d).log.xz

012602164.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602164.td-b3lyp_6-31+g(d).gjf (generated)

012602164.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602164.mol 012602164.PUBCHEM 012602164.mol (via Jmol)
012602168.b3lyp_6-31g(d).inp

012602168.b3lyp_6-31g(d).qchem.inp (generated)

012602168.b3lyp_6-31g(d).gjf (generated)

012602168.b3lyp_6-31g(d).firefly.inp (generated)

012602168.b3lyp_6-31g(d).smash.inp (generated)

012602168.b3lyp_6-31g(d).nwchem.inp (generated) 012602168.b3lyp_6-31g(d).log.xz 012602168.td-b3lyp_6-31g+(d).inp 012602168.td-b3lyp_6-31g+(d).log.xz

012602168.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602168.td-b3lyp_6-31+g(d).gjf (generated)

012602168.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602168.mol 012602168.PUBCHEM 012602168.mol (via Jmol)
012602170.b3lyp_6-31g(d).inp

012602170.b3lyp_6-31g(d).qchem.inp (generated)

012602170.b3lyp_6-31g(d).gjf (generated)

012602170.b3lyp_6-31g(d).firefly.inp (generated)

012602170.b3lyp_6-31g(d).smash.inp (generated)

012602170.b3lyp_6-31g(d).nwchem.inp (generated) 012602170.b3lyp_6-31g(d).log.xz 012602170.td-b3lyp_6-31g+(d).inp 012602170.td-b3lyp_6-31g+(d).log.xz

012602170.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602170.td-b3lyp_6-31+g(d).gjf (generated)

012602170.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602170.mol 012602170.PUBCHEM 012602170.mol (via Jmol)
012602171.b3lyp_6-31g(d).inp

012602171.b3lyp_6-31g(d).qchem.inp (generated)

012602171.b3lyp_6-31g(d).gjf (generated)

012602171.b3lyp_6-31g(d).firefly.inp (generated)

012602171.b3lyp_6-31g(d).smash.inp (generated)

012602171.b3lyp_6-31g(d).nwchem.inp (generated) 012602171.b3lyp_6-31g(d).log.xz 012602171.td-b3lyp_6-31g+(d).inp 012602171.td-b3lyp_6-31g+(d).log.xz

012602171.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602171.td-b3lyp_6-31+g(d).gjf (generated)

012602171.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602171.mol 012602171.PUBCHEM 012602171.mol (via Jmol)
012602176.b3lyp_6-31g(d).inp

012602176.b3lyp_6-31g(d).qchem.inp (generated)

012602176.b3lyp_6-31g(d).gjf (generated)

012602176.b3lyp_6-31g(d).firefly.inp (generated)

012602176.b3lyp_6-31g(d).smash.inp (generated)

012602176.b3lyp_6-31g(d).nwchem.inp (generated) 012602176.b3lyp_6-31g(d).log.xz 012602176.td-b3lyp_6-31g+(d).inp 012602176.td-b3lyp_6-31g+(d).log.xz

012602176.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602176.td-b3lyp_6-31+g(d).gjf (generated)

012602176.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602176.mol 012602176.PUBCHEM 012602176.mol (via Jmol)
012602181.b3lyp_6-31g(d).inp

012602181.b3lyp_6-31g(d).qchem.inp (generated)

012602181.b3lyp_6-31g(d).gjf (generated)

012602181.b3lyp_6-31g(d).firefly.inp (generated)

012602181.b3lyp_6-31g(d).smash.inp (generated)

012602181.b3lyp_6-31g(d).nwchem.inp (generated) 012602181.b3lyp_6-31g(d).log.xz 012602181.td-b3lyp_6-31g+(d).inp 012602181.td-b3lyp_6-31g+(d).log.xz

012602181.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602181.td-b3lyp_6-31+g(d).gjf (generated)

012602181.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602181.mol 012602181.PUBCHEM 012602181.mol (via Jmol)
012602197.b3lyp_6-31g(d).inp

012602197.b3lyp_6-31g(d).qchem.inp (generated)

012602197.b3lyp_6-31g(d).gjf (generated)

012602197.b3lyp_6-31g(d).firefly.inp (generated)

012602197.b3lyp_6-31g(d).smash.inp (generated)

012602197.b3lyp_6-31g(d).nwchem.inp (generated) 012602197.b3lyp_6-31g(d).log.xz 012602197.td-b3lyp_6-31g+(d).inp 012602197.td-b3lyp_6-31g+(d).log.xz

012602197.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602197.td-b3lyp_6-31+g(d).gjf (generated)

012602197.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602197.mol 012602197.PUBCHEM 012602197.mol (via Jmol)
012602198.b3lyp_6-31g(d).inp

012602198.b3lyp_6-31g(d).qchem.inp (generated)

012602198.b3lyp_6-31g(d).gjf (generated)

012602198.b3lyp_6-31g(d).firefly.inp (generated)

012602198.b3lyp_6-31g(d).smash.inp (generated)

012602198.b3lyp_6-31g(d).nwchem.inp (generated) 012602198.b3lyp_6-31g(d).log.xz 012602198.td-b3lyp_6-31g+(d).inp 012602198.td-b3lyp_6-31g+(d).log.xz

012602198.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602198.td-b3lyp_6-31+g(d).gjf (generated)

012602198.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602198.mol 012602198.PUBCHEM 012602198.mol (via Jmol)
012602202.b3lyp_6-31g(d).inp

012602202.b3lyp_6-31g(d).qchem.inp (generated)

012602202.b3lyp_6-31g(d).gjf (generated)

012602202.b3lyp_6-31g(d).firefly.inp (generated)

012602202.b3lyp_6-31g(d).smash.inp (generated)

012602202.b3lyp_6-31g(d).nwchem.inp (generated) 012602202.b3lyp_6-31g(d).log.xz 012602202.mol 012602202.PUBCHEM 012602202.mol (via Jmol)
012602204.b3lyp_6-31g(d).inp

012602204.b3lyp_6-31g(d).qchem.inp (generated)

012602204.b3lyp_6-31g(d).gjf (generated)

012602204.b3lyp_6-31g(d).firefly.inp (generated)

012602204.b3lyp_6-31g(d).smash.inp (generated)

012602204.b3lyp_6-31g(d).nwchem.inp (generated) 012602204.b3lyp_6-31g(d).log.xz 012602204.td-b3lyp_6-31g+(d).inp 012602204.td-b3lyp_6-31g+(d).log.xz

012602204.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602204.td-b3lyp_6-31+g(d).gjf (generated)

012602204.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602204.mol 012602204.PUBCHEM 012602204.mol (via Jmol)
012602206.b3lyp_6-31g(d).inp

012602206.b3lyp_6-31g(d).qchem.inp (generated)

012602206.b3lyp_6-31g(d).gjf (generated)

012602206.b3lyp_6-31g(d).firefly.inp (generated)

012602206.b3lyp_6-31g(d).smash.inp (generated)

012602206.b3lyp_6-31g(d).nwchem.inp (generated) 012602206.b3lyp_6-31g(d).log.xz 012602206.td-b3lyp_6-31g+(d).inp 012602206.td-b3lyp_6-31g+(d).log.xz

012602206.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602206.td-b3lyp_6-31+g(d).gjf (generated)

012602206.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602206.mol 012602206.PUBCHEM 012602206.mol (via Jmol)
012602208.b3lyp_6-31g(d).inp

012602208.b3lyp_6-31g(d).qchem.inp (generated)

012602208.b3lyp_6-31g(d).gjf (generated)

012602208.b3lyp_6-31g(d).firefly.inp (generated)

012602208.b3lyp_6-31g(d).smash.inp (generated)

012602208.b3lyp_6-31g(d).nwchem.inp (generated) 012602208.b3lyp_6-31g(d).log.xz 012602208.td-b3lyp_6-31g+(d).inp 012602208.td-b3lyp_6-31g+(d).log.xz

012602208.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602208.td-b3lyp_6-31+g(d).gjf (generated)

012602208.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602208.mol 012602208.PUBCHEM 012602208.mol (via Jmol)
012602213.b3lyp_6-31g(d).inp

012602213.b3lyp_6-31g(d).qchem.inp (generated)

012602213.b3lyp_6-31g(d).gjf (generated)

012602213.b3lyp_6-31g(d).firefly.inp (generated)

012602213.b3lyp_6-31g(d).smash.inp (generated)

012602213.b3lyp_6-31g(d).nwchem.inp (generated) 012602213.b3lyp_6-31g(d).log.xz 012602213.td-b3lyp_6-31g+(d).inp 012602213.td-b3lyp_6-31g+(d).log.xz

012602213.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602213.td-b3lyp_6-31+g(d).gjf (generated)

012602213.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602213.mol 012602213.PUBCHEM 012602213.mol (via Jmol)
012602214.b3lyp_6-31g(d).inp

012602214.b3lyp_6-31g(d).qchem.inp (generated)

012602214.b3lyp_6-31g(d).gjf (generated)

012602214.b3lyp_6-31g(d).firefly.inp (generated)

012602214.b3lyp_6-31g(d).smash.inp (generated)

012602214.b3lyp_6-31g(d).nwchem.inp (generated) 012602214.b3lyp_6-31g(d).log.xz 012602214.td-b3lyp_6-31g+(d).inp 012602214.td-b3lyp_6-31g+(d).log.xz

012602214.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602214.td-b3lyp_6-31+g(d).gjf (generated)

012602214.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602214.mol 012602214.PUBCHEM 012602214.mol (via Jmol)
012602215.b3lyp_6-31g(d).inp

012602215.b3lyp_6-31g(d).qchem.inp (generated)

012602215.b3lyp_6-31g(d).gjf (generated)

012602215.b3lyp_6-31g(d).firefly.inp (generated)

012602215.b3lyp_6-31g(d).smash.inp (generated)

012602215.b3lyp_6-31g(d).nwchem.inp (generated) 012602215.b3lyp_6-31g(d).log.xz 012602215.td-b3lyp_6-31g+(d).inp 012602215.td-b3lyp_6-31g+(d).log.xz

012602215.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602215.td-b3lyp_6-31+g(d).gjf (generated)

012602215.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602215.mol 012602215.PUBCHEM 012602215.mol (via Jmol)
012602216.b3lyp_6-31g(d).inp

012602216.b3lyp_6-31g(d).qchem.inp (generated)

012602216.b3lyp_6-31g(d).gjf (generated)

012602216.b3lyp_6-31g(d).firefly.inp (generated)

012602216.b3lyp_6-31g(d).smash.inp (generated)

012602216.b3lyp_6-31g(d).nwchem.inp (generated) 012602216.b3lyp_6-31g(d).log.xz 012602216.mol 012602216.PUBCHEM 012602216.mol (via Jmol)
012602217.b3lyp_6-31g(d).inp

012602217.b3lyp_6-31g(d).qchem.inp (generated)

012602217.b3lyp_6-31g(d).gjf (generated)

012602217.b3lyp_6-31g(d).firefly.inp (generated)

012602217.b3lyp_6-31g(d).smash.inp (generated)

012602217.b3lyp_6-31g(d).nwchem.inp (generated) 012602217.b3lyp_6-31g(d).log.xz 012602217.td-b3lyp_6-31g+(d).inp 012602217.td-b3lyp_6-31g+(d).log.xz

012602217.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602217.td-b3lyp_6-31+g(d).gjf (generated)

012602217.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602217.mol 012602217.PUBCHEM 012602217.mol (via Jmol)
012602218.b3lyp_6-31g(d).inp

012602218.b3lyp_6-31g(d).qchem.inp (generated)

012602218.b3lyp_6-31g(d).gjf (generated)

012602218.b3lyp_6-31g(d).firefly.inp (generated)

012602218.b3lyp_6-31g(d).smash.inp (generated)

012602218.b3lyp_6-31g(d).nwchem.inp (generated) 012602218.b3lyp_6-31g(d).log.xz 012602218.td-b3lyp_6-31g+(d).inp 012602218.td-b3lyp_6-31g+(d).log.xz

012602218.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602218.td-b3lyp_6-31+g(d).gjf (generated)

012602218.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602218.mol 012602218.PUBCHEM 012602218.mol (via Jmol)
012602219.b3lyp_6-31g(d).inp

012602219.b3lyp_6-31g(d).qchem.inp (generated)

012602219.b3lyp_6-31g(d).gjf (generated)

012602219.b3lyp_6-31g(d).firefly.inp (generated)

012602219.b3lyp_6-31g(d).smash.inp (generated)

012602219.b3lyp_6-31g(d).nwchem.inp (generated) 012602219.b3lyp_6-31g(d).log.xz 012602219.mol 012602219.PUBCHEM 012602219.mol (via Jmol)
012602220.b3lyp_6-31g(d).inp

012602220.b3lyp_6-31g(d).qchem.inp (generated)

012602220.b3lyp_6-31g(d).gjf (generated)

012602220.b3lyp_6-31g(d).firefly.inp (generated)

012602220.b3lyp_6-31g(d).smash.inp (generated)

012602220.b3lyp_6-31g(d).nwchem.inp (generated) 012602220.b3lyp_6-31g(d).log.xz 012602220.td-b3lyp_6-31g+(d).inp 012602220.td-b3lyp_6-31g+(d).log.xz

012602220.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602220.td-b3lyp_6-31+g(d).gjf (generated)

012602220.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602220.mol 012602220.PUBCHEM 012602220.mol (via Jmol)
012602221.b3lyp_6-31g(d).inp

012602221.b3lyp_6-31g(d).qchem.inp (generated)

012602221.b3lyp_6-31g(d).gjf (generated)

012602221.b3lyp_6-31g(d).firefly.inp (generated)

012602221.b3lyp_6-31g(d).smash.inp (generated)

012602221.b3lyp_6-31g(d).nwchem.inp (generated) 012602221.b3lyp_6-31g(d).log.xz 012602221.td-b3lyp_6-31g+(d).inp 012602221.td-b3lyp_6-31g+(d).log.xz

012602221.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602221.td-b3lyp_6-31+g(d).gjf (generated)

012602221.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602221.mol 012602221.PUBCHEM 012602221.mol (via Jmol)
012602222.b3lyp_6-31g(d).inp

012602222.b3lyp_6-31g(d).qchem.inp (generated)

012602222.b3lyp_6-31g(d).gjf (generated)

012602222.b3lyp_6-31g(d).firefly.inp (generated)

012602222.b3lyp_6-31g(d).smash.inp (generated)

012602222.b3lyp_6-31g(d).nwchem.inp (generated) 012602222.b3lyp_6-31g(d).log.xz 012602222.td-b3lyp_6-31g+(d).inp 012602222.td-b3lyp_6-31g+(d).log.xz

012602222.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602222.td-b3lyp_6-31+g(d).gjf (generated)

012602222.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602222.mol 012602222.PUBCHEM 012602222.mol (via Jmol)
012602223.b3lyp_6-31g(d).inp

012602223.b3lyp_6-31g(d).qchem.inp (generated)

012602223.b3lyp_6-31g(d).gjf (generated)

012602223.b3lyp_6-31g(d).firefly.inp (generated)

012602223.b3lyp_6-31g(d).smash.inp (generated)

012602223.b3lyp_6-31g(d).nwchem.inp (generated) 012602223.b3lyp_6-31g(d).log.xz 012602223.mol 012602223.PUBCHEM 012602223.mol (via Jmol)
012602233.b3lyp_6-31g(d).inp

012602233.b3lyp_6-31g(d).qchem.inp (generated)

012602233.b3lyp_6-31g(d).gjf (generated)

012602233.b3lyp_6-31g(d).firefly.inp (generated)

012602233.b3lyp_6-31g(d).smash.inp (generated)

012602233.b3lyp_6-31g(d).nwchem.inp (generated) 012602233.b3lyp_6-31g(d).log.xz 012602233.td-b3lyp_6-31g+(d).inp 012602233.td-b3lyp_6-31g+(d).log.xz

012602233.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602233.td-b3lyp_6-31+g(d).gjf (generated)

012602233.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602233.mol 012602233.PUBCHEM 012602233.mol (via Jmol)
012602278.b3lyp_6-31g(d).inp

012602278.b3lyp_6-31g(d).qchem.inp (generated)

012602278.b3lyp_6-31g(d).gjf (generated)

012602278.b3lyp_6-31g(d).firefly.inp (generated)

012602278.b3lyp_6-31g(d).smash.inp (generated)

012602278.b3lyp_6-31g(d).nwchem.inp (generated) 012602278.b3lyp_6-31g(d).log.xz 012602278.td-b3lyp_6-31g+(d).inp 012602278.td-b3lyp_6-31g+(d).log.xz

012602278.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602278.td-b3lyp_6-31+g(d).gjf (generated)

012602278.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602278.mol 012602278.PUBCHEM 012602278.mol (via Jmol)
012602279.b3lyp_6-31g(d).inp

012602279.b3lyp_6-31g(d).qchem.inp (generated)

012602279.b3lyp_6-31g(d).gjf (generated)

012602279.b3lyp_6-31g(d).firefly.inp (generated)

012602279.b3lyp_6-31g(d).smash.inp (generated)

012602279.b3lyp_6-31g(d).nwchem.inp (generated) 012602279.b3lyp_6-31g(d).log.xz 012602279.td-b3lyp_6-31g+(d).inp 012602279.td-b3lyp_6-31g+(d).log.xz

012602279.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602279.td-b3lyp_6-31+g(d).gjf (generated)

012602279.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602279.mol 012602279.PUBCHEM 012602279.mol (via Jmol)
012602289.b3lyp_6-31g(d).inp

012602289.b3lyp_6-31g(d).qchem.inp (generated)

012602289.b3lyp_6-31g(d).gjf (generated)

012602289.b3lyp_6-31g(d).firefly.inp (generated)

012602289.b3lyp_6-31g(d).smash.inp (generated)

012602289.b3lyp_6-31g(d).nwchem.inp (generated) 012602289.b3lyp_6-31g(d).log.xz 012602289.td-b3lyp_6-31g+(d).inp 012602289.td-b3lyp_6-31g+(d).log.xz

012602289.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602289.td-b3lyp_6-31+g(d).gjf (generated)

012602289.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602289.mol 012602289.PUBCHEM 012602289.mol (via Jmol)
012602298.b3lyp_6-31g(d).inp

012602298.b3lyp_6-31g(d).qchem.inp (generated)

012602298.b3lyp_6-31g(d).gjf (generated)

012602298.b3lyp_6-31g(d).firefly.inp (generated)

012602298.b3lyp_6-31g(d).smash.inp (generated)

012602298.b3lyp_6-31g(d).nwchem.inp (generated) 012602298.b3lyp_6-31g(d).log.xz 012602298.td-b3lyp_6-31g+(d).inp 012602298.td-b3lyp_6-31g+(d).log.xz

012602298.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602298.td-b3lyp_6-31+g(d).gjf (generated)

012602298.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602298.mol 012602298.PUBCHEM 012602298.mol (via Jmol)
012602308.b3lyp_6-31g(d).inp

012602308.b3lyp_6-31g(d).qchem.inp (generated)

012602308.b3lyp_6-31g(d).gjf (generated)

012602308.b3lyp_6-31g(d).firefly.inp (generated)

012602308.b3lyp_6-31g(d).smash.inp (generated)

012602308.b3lyp_6-31g(d).nwchem.inp (generated) 012602308.b3lyp_6-31g(d).log.xz 012602308.td-b3lyp_6-31g+(d).inp 012602308.td-b3lyp_6-31g+(d).log.xz

012602308.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602308.td-b3lyp_6-31+g(d).gjf (generated)

012602308.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602308.mol 012602308.PUBCHEM 012602308.mol (via Jmol)
012602337.b3lyp_6-31g(d).inp

012602337.b3lyp_6-31g(d).qchem.inp (generated)

012602337.b3lyp_6-31g(d).gjf (generated)

012602337.b3lyp_6-31g(d).firefly.inp (generated)

012602337.b3lyp_6-31g(d).smash.inp (generated)

012602337.b3lyp_6-31g(d).nwchem.inp (generated) 012602337.b3lyp_6-31g(d).log.xz 012602337.mol 012602337.PUBCHEM 012602337.mol (via Jmol)
012602341.b3lyp_6-31g(d).inp

012602341.b3lyp_6-31g(d).qchem.inp (generated)

012602341.b3lyp_6-31g(d).gjf (generated)

012602341.b3lyp_6-31g(d).firefly.inp (generated)

012602341.b3lyp_6-31g(d).smash.inp (generated)

012602341.b3lyp_6-31g(d).nwchem.inp (generated) 012602341.b3lyp_6-31g(d).log.xz 012602341.td-b3lyp_6-31g+(d).inp 012602341.td-b3lyp_6-31g+(d).log.xz

012602341.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602341.td-b3lyp_6-31+g(d).gjf (generated)

012602341.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602341.mol 012602341.PUBCHEM 012602341.mol (via Jmol)
012602342.b3lyp_6-31g(d).inp

012602342.b3lyp_6-31g(d).qchem.inp (generated)

012602342.b3lyp_6-31g(d).gjf (generated)

012602342.b3lyp_6-31g(d).firefly.inp (generated)

012602342.b3lyp_6-31g(d).smash.inp (generated)

012602342.b3lyp_6-31g(d).nwchem.inp (generated) 012602342.b3lyp_6-31g(d).log.xz 012602342.td-b3lyp_6-31g+(d).inp 012602342.td-b3lyp_6-31g+(d).log.xz

012602342.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602342.td-b3lyp_6-31+g(d).gjf (generated)

012602342.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602342.mol 012602342.PUBCHEM 012602342.mol (via Jmol)
012602343.b3lyp_6-31g(d).inp

012602343.b3lyp_6-31g(d).qchem.inp (generated)

012602343.b3lyp_6-31g(d).gjf (generated)

012602343.b3lyp_6-31g(d).firefly.inp (generated)

012602343.b3lyp_6-31g(d).smash.inp (generated)

012602343.b3lyp_6-31g(d).nwchem.inp (generated) 012602343.b3lyp_6-31g(d).log.xz 012602343.td-b3lyp_6-31g+(d).inp 012602343.td-b3lyp_6-31g+(d).log.xz

012602343.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602343.td-b3lyp_6-31+g(d).gjf (generated)

012602343.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602343.mol 012602343.PUBCHEM 012602343.mol (via Jmol)
012602344.b3lyp_6-31g(d).inp

012602344.b3lyp_6-31g(d).qchem.inp (generated)

012602344.b3lyp_6-31g(d).gjf (generated)

012602344.b3lyp_6-31g(d).firefly.inp (generated)

012602344.b3lyp_6-31g(d).smash.inp (generated)

012602344.b3lyp_6-31g(d).nwchem.inp (generated) 012602344.b3lyp_6-31g(d).log.xz 012602344.td-b3lyp_6-31g+(d).inp 012602344.td-b3lyp_6-31g+(d).log.xz

012602344.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602344.td-b3lyp_6-31+g(d).gjf (generated)

012602344.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602344.mol 012602344.PUBCHEM 012602344.mol (via Jmol)
012602346.b3lyp_6-31g(d).inp

012602346.b3lyp_6-31g(d).qchem.inp (generated)

012602346.b3lyp_6-31g(d).gjf (generated)

012602346.b3lyp_6-31g(d).firefly.inp (generated)

012602346.b3lyp_6-31g(d).smash.inp (generated)

012602346.b3lyp_6-31g(d).nwchem.inp (generated) 012602346.b3lyp_6-31g(d).log.xz 012602346.td-b3lyp_6-31g+(d).inp 012602346.td-b3lyp_6-31g+(d).log.xz

012602346.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602346.td-b3lyp_6-31+g(d).gjf (generated)

012602346.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602346.mol 012602346.PUBCHEM 012602346.mol (via Jmol)
012602348.b3lyp_6-31g(d).inp

012602348.b3lyp_6-31g(d).qchem.inp (generated)

012602348.b3lyp_6-31g(d).gjf (generated)

012602348.b3lyp_6-31g(d).firefly.inp (generated)

012602348.b3lyp_6-31g(d).smash.inp (generated)

012602348.b3lyp_6-31g(d).nwchem.inp (generated) 012602348.b3lyp_6-31g(d).log.xz 012602348.td-b3lyp_6-31g+(d).inp 012602348.td-b3lyp_6-31g+(d).log.xz

012602348.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602348.td-b3lyp_6-31+g(d).gjf (generated)

012602348.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602348.mol 012602348.PUBCHEM 012602348.mol (via Jmol)
012602351.b3lyp_6-31g(d).inp

012602351.b3lyp_6-31g(d).qchem.inp (generated)

012602351.b3lyp_6-31g(d).gjf (generated)

012602351.b3lyp_6-31g(d).firefly.inp (generated)

012602351.b3lyp_6-31g(d).smash.inp (generated)

012602351.b3lyp_6-31g(d).nwchem.inp (generated) 012602351.b3lyp_6-31g(d).log.xz 012602351.td-b3lyp_6-31g+(d).inp 012602351.td-b3lyp_6-31g+(d).log.xz

012602351.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602351.td-b3lyp_6-31+g(d).gjf (generated)

012602351.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602351.mol 012602351.PUBCHEM 012602351.mol (via Jmol)
012602353.b3lyp_6-31g(d).inp

012602353.b3lyp_6-31g(d).qchem.inp (generated)

012602353.b3lyp_6-31g(d).gjf (generated)

012602353.b3lyp_6-31g(d).firefly.inp (generated)

012602353.b3lyp_6-31g(d).smash.inp (generated)

012602353.b3lyp_6-31g(d).nwchem.inp (generated) 012602353.b3lyp_6-31g(d).log.xz 012602353.td-b3lyp_6-31g+(d).inp 012602353.td-b3lyp_6-31g+(d).log.xz

012602353.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602353.td-b3lyp_6-31+g(d).gjf (generated)

012602353.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602353.mol 012602353.PUBCHEM 012602353.mol (via Jmol)
012602357.b3lyp_6-31g(d).inp

012602357.b3lyp_6-31g(d).qchem.inp (generated)

012602357.b3lyp_6-31g(d).gjf (generated)

012602357.b3lyp_6-31g(d).firefly.inp (generated)

012602357.b3lyp_6-31g(d).smash.inp (generated)

012602357.b3lyp_6-31g(d).nwchem.inp (generated) 012602357.b3lyp_6-31g(d).log.xz 012602357.td-b3lyp_6-31g+(d).inp 012602357.td-b3lyp_6-31g+(d).log.xz

012602357.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602357.td-b3lyp_6-31+g(d).gjf (generated)

012602357.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602357.mol 012602357.PUBCHEM 012602357.mol (via Jmol)
012602359.b3lyp_6-31g(d).inp

012602359.b3lyp_6-31g(d).qchem.inp (generated)

012602359.b3lyp_6-31g(d).gjf (generated)

012602359.b3lyp_6-31g(d).firefly.inp (generated)

012602359.b3lyp_6-31g(d).smash.inp (generated)

012602359.b3lyp_6-31g(d).nwchem.inp (generated) 012602359.b3lyp_6-31g(d).log.xz 012602359.td-b3lyp_6-31g+(d).inp 012602359.td-b3lyp_6-31g+(d).log.xz

012602359.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602359.td-b3lyp_6-31+g(d).gjf (generated)

012602359.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602359.mol 012602359.PUBCHEM 012602359.mol (via Jmol)
012602360.b3lyp_6-31g(d).inp

012602360.b3lyp_6-31g(d).qchem.inp (generated)

012602360.b3lyp_6-31g(d).gjf (generated)

012602360.b3lyp_6-31g(d).firefly.inp (generated)

012602360.b3lyp_6-31g(d).smash.inp (generated)

012602360.b3lyp_6-31g(d).nwchem.inp (generated) 012602360.b3lyp_6-31g(d).log.xz 012602360.td-b3lyp_6-31g+(d).inp 012602360.td-b3lyp_6-31g+(d).log.xz

012602360.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602360.td-b3lyp_6-31+g(d).gjf (generated)

012602360.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602360.mol 012602360.PUBCHEM 012602360.mol (via Jmol)
012602361.b3lyp_6-31g(d).inp

012602361.b3lyp_6-31g(d).qchem.inp (generated)

012602361.b3lyp_6-31g(d).gjf (generated)

012602361.b3lyp_6-31g(d).firefly.inp (generated)

012602361.b3lyp_6-31g(d).smash.inp (generated)

012602361.b3lyp_6-31g(d).nwchem.inp (generated) 012602361.b3lyp_6-31g(d).log.xz 012602361.td-b3lyp_6-31g+(d).inp 012602361.td-b3lyp_6-31g+(d).log.xz

012602361.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602361.td-b3lyp_6-31+g(d).gjf (generated)

012602361.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602361.mol 012602361.PUBCHEM 012602361.mol (via Jmol)
012602362.b3lyp_6-31g(d).inp

012602362.b3lyp_6-31g(d).qchem.inp (generated)

012602362.b3lyp_6-31g(d).gjf (generated)

012602362.b3lyp_6-31g(d).firefly.inp (generated)

012602362.b3lyp_6-31g(d).smash.inp (generated)

012602362.b3lyp_6-31g(d).nwchem.inp (generated) 012602362.b3lyp_6-31g(d).log.xz 012602362.td-b3lyp_6-31g+(d).inp 012602362.td-b3lyp_6-31g+(d).log.xz

012602362.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602362.td-b3lyp_6-31+g(d).gjf (generated)

012602362.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602362.mol 012602362.PUBCHEM 012602362.mol (via Jmol)
012602363.b3lyp_6-31g(d).inp

012602363.b3lyp_6-31g(d).qchem.inp (generated)

012602363.b3lyp_6-31g(d).gjf (generated)

012602363.b3lyp_6-31g(d).firefly.inp (generated)

012602363.b3lyp_6-31g(d).smash.inp (generated)

012602363.b3lyp_6-31g(d).nwchem.inp (generated) 012602363.b3lyp_6-31g(d).log.xz 012602363.td-b3lyp_6-31g+(d).inp 012602363.td-b3lyp_6-31g+(d).log.xz

012602363.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602363.td-b3lyp_6-31+g(d).gjf (generated)

012602363.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602363.mol 012602363.PUBCHEM 012602363.mol (via Jmol)
012602365.b3lyp_6-31g(d).inp

012602365.b3lyp_6-31g(d).qchem.inp (generated)

012602365.b3lyp_6-31g(d).gjf (generated)

012602365.b3lyp_6-31g(d).firefly.inp (generated)

012602365.b3lyp_6-31g(d).smash.inp (generated)

012602365.b3lyp_6-31g(d).nwchem.inp (generated) 012602365.b3lyp_6-31g(d).log.xz 012602365.td-b3lyp_6-31g+(d).inp 012602365.td-b3lyp_6-31g+(d).log.xz

012602365.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602365.td-b3lyp_6-31+g(d).gjf (generated)

012602365.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602365.mol 012602365.PUBCHEM 012602365.mol (via Jmol)
012602366.b3lyp_6-31g(d).inp

012602366.b3lyp_6-31g(d).qchem.inp (generated)

012602366.b3lyp_6-31g(d).gjf (generated)

012602366.b3lyp_6-31g(d).firefly.inp (generated)

012602366.b3lyp_6-31g(d).smash.inp (generated)

012602366.b3lyp_6-31g(d).nwchem.inp (generated) 012602366.b3lyp_6-31g(d).log.xz 012602366.td-b3lyp_6-31g+(d).inp 012602366.td-b3lyp_6-31g+(d).log.xz

012602366.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602366.td-b3lyp_6-31+g(d).gjf (generated)

012602366.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602366.mol 012602366.PUBCHEM 012602366.mol (via Jmol)
012602367.b3lyp_6-31g(d).inp

012602367.b3lyp_6-31g(d).qchem.inp (generated)

012602367.b3lyp_6-31g(d).gjf (generated)

012602367.b3lyp_6-31g(d).firefly.inp (generated)

012602367.b3lyp_6-31g(d).smash.inp (generated)

012602367.b3lyp_6-31g(d).nwchem.inp (generated) 012602367.b3lyp_6-31g(d).log.xz 012602367.td-b3lyp_6-31g+(d).inp 012602367.td-b3lyp_6-31g+(d).log.xz

012602367.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602367.td-b3lyp_6-31+g(d).gjf (generated)

012602367.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602367.mol 012602367.PUBCHEM 012602367.mol (via Jmol)
012602377.b3lyp_6-31g(d).inp

012602377.b3lyp_6-31g(d).qchem.inp (generated)

012602377.b3lyp_6-31g(d).gjf (generated)

012602377.b3lyp_6-31g(d).firefly.inp (generated)

012602377.b3lyp_6-31g(d).smash.inp (generated)

012602377.b3lyp_6-31g(d).nwchem.inp (generated) 012602377.b3lyp_6-31g(d).log.xz 012602377.td-b3lyp_6-31g+(d).inp 012602377.td-b3lyp_6-31g+(d).log.xz

012602377.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602377.td-b3lyp_6-31+g(d).gjf (generated)

012602377.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602377.mol 012602377.PUBCHEM 012602377.mol (via Jmol)
012602378.b3lyp_6-31g(d).inp

012602378.b3lyp_6-31g(d).qchem.inp (generated)

012602378.b3lyp_6-31g(d).gjf (generated)

012602378.b3lyp_6-31g(d).firefly.inp (generated)

012602378.b3lyp_6-31g(d).smash.inp (generated)

012602378.b3lyp_6-31g(d).nwchem.inp (generated) 012602378.b3lyp_6-31g(d).log.xz 012602378.td-b3lyp_6-31g+(d).inp 012602378.td-b3lyp_6-31g+(d).log.xz

012602378.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602378.td-b3lyp_6-31+g(d).gjf (generated)

012602378.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602378.mol 012602378.PUBCHEM 012602378.mol (via Jmol)
012602499.b3lyp_6-31g(d).inp

012602499.b3lyp_6-31g(d).qchem.inp (generated)

012602499.b3lyp_6-31g(d).gjf (generated)

012602499.b3lyp_6-31g(d).firefly.inp (generated)

012602499.b3lyp_6-31g(d).smash.inp (generated)

012602499.b3lyp_6-31g(d).nwchem.inp (generated) 012602499.b3lyp_6-31g(d).log.xz 012602499.td-b3lyp_6-31g+(d).inp 012602499.td-b3lyp_6-31g+(d).log.xz

012602499.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602499.td-b3lyp_6-31+g(d).gjf (generated)

012602499.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602499.mol 012602499.PUBCHEM 012602499.mol (via Jmol)
012602520.b3lyp_6-31g(d).inp

012602520.b3lyp_6-31g(d).qchem.inp (generated)

012602520.b3lyp_6-31g(d).gjf (generated)

012602520.b3lyp_6-31g(d).firefly.inp (generated)

012602520.b3lyp_6-31g(d).smash.inp (generated)

012602520.b3lyp_6-31g(d).nwchem.inp (generated) 012602520.b3lyp_6-31g(d).log.xz 012602520.mol 012602520.PUBCHEM 012602520.mol (via Jmol)
012602521.b3lyp_6-31g(d).inp

012602521.b3lyp_6-31g(d).qchem.inp (generated)

012602521.b3lyp_6-31g(d).gjf (generated)

012602521.b3lyp_6-31g(d).firefly.inp (generated)

012602521.b3lyp_6-31g(d).smash.inp (generated)

012602521.b3lyp_6-31g(d).nwchem.inp (generated) 012602521.b3lyp_6-31g(d).log.xz 012602521.mol 012602521.PUBCHEM 012602521.mol (via Jmol)
012602523.b3lyp_6-31g(d).inp

012602523.b3lyp_6-31g(d).qchem.inp (generated)

012602523.b3lyp_6-31g(d).gjf (generated)

012602523.b3lyp_6-31g(d).firefly.inp (generated)

012602523.b3lyp_6-31g(d).smash.inp (generated)

012602523.b3lyp_6-31g(d).nwchem.inp (generated) 012602523.b3lyp_6-31g(d).log.xz 012602523.td-b3lyp_6-31g+(d).inp 012602523.td-b3lyp_6-31g+(d).log.xz

012602523.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602523.td-b3lyp_6-31+g(d).gjf (generated)

012602523.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602523.mol 012602523.PUBCHEM 012602523.mol (via Jmol)
012602574.b3lyp_6-31g(d).inp

012602574.b3lyp_6-31g(d).qchem.inp (generated)

012602574.b3lyp_6-31g(d).gjf (generated)

012602574.b3lyp_6-31g(d).firefly.inp (generated)

012602574.b3lyp_6-31g(d).smash.inp (generated)

012602574.b3lyp_6-31g(d).nwchem.inp (generated) 012602574.b3lyp_6-31g(d).log.xz 012602574.td-b3lyp_6-31g+(d).inp 012602574.td-b3lyp_6-31g+(d).log.xz

012602574.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602574.td-b3lyp_6-31+g(d).gjf (generated)

012602574.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602574.mol 012602574.PUBCHEM 012602574.mol (via Jmol)
012602681.b3lyp_6-31g(d).inp

012602681.b3lyp_6-31g(d).qchem.inp (generated)

012602681.b3lyp_6-31g(d).gjf (generated)

012602681.b3lyp_6-31g(d).firefly.inp (generated)

012602681.b3lyp_6-31g(d).smash.inp (generated)

012602681.b3lyp_6-31g(d).nwchem.inp (generated) 012602681.b3lyp_6-31g(d).log.xz 012602681.td-b3lyp_6-31g+(d).inp 012602681.td-b3lyp_6-31g+(d).log.xz

012602681.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602681.td-b3lyp_6-31+g(d).gjf (generated)

012602681.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602681.mol 012602681.PUBCHEM 012602681.mol (via Jmol)
012602694.b3lyp_6-31g(d).inp

012602694.b3lyp_6-31g(d).qchem.inp (generated)

012602694.b3lyp_6-31g(d).gjf (generated)

012602694.b3lyp_6-31g(d).firefly.inp (generated)

012602694.b3lyp_6-31g(d).smash.inp (generated)

012602694.b3lyp_6-31g(d).nwchem.inp (generated) 012602694.b3lyp_6-31g(d).log.xz 012602694.td-b3lyp_6-31g+(d).inp 012602694.td-b3lyp_6-31g+(d).log.xz

012602694.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602694.td-b3lyp_6-31+g(d).gjf (generated)

012602694.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602694.mol 012602694.PUBCHEM 012602694.mol (via Jmol)
012602696.b3lyp_6-31g(d).inp

012602696.b3lyp_6-31g(d).qchem.inp (generated)

012602696.b3lyp_6-31g(d).gjf (generated)

012602696.b3lyp_6-31g(d).firefly.inp (generated)

012602696.b3lyp_6-31g(d).smash.inp (generated)

012602696.b3lyp_6-31g(d).nwchem.inp (generated) 012602696.b3lyp_6-31g(d).log.xz 012602696.td-b3lyp_6-31g+(d).inp 012602696.td-b3lyp_6-31g+(d).log.xz

012602696.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602696.td-b3lyp_6-31+g(d).gjf (generated)

012602696.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602696.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602696.mol 012602696.PUBCHEM 012602696.mol (via Jmol)
012602733.b3lyp_6-31g(d).inp

012602733.b3lyp_6-31g(d).qchem.inp (generated)

012602733.b3lyp_6-31g(d).gjf (generated)

012602733.b3lyp_6-31g(d).firefly.inp (generated)

012602733.b3lyp_6-31g(d).smash.inp (generated)

012602733.b3lyp_6-31g(d).nwchem.inp (generated) 012602733.b3lyp_6-31g(d).log.xz 012602733.td-b3lyp_6-31g+(d).inp 012602733.td-b3lyp_6-31g+(d).log.xz

012602733.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602733.td-b3lyp_6-31+g(d).gjf (generated)

012602733.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602733.mol 012602733.PUBCHEM 012602733.mol (via Jmol)
012602744.b3lyp_6-31g(d).inp

012602744.b3lyp_6-31g(d).qchem.inp (generated)

012602744.b3lyp_6-31g(d).gjf (generated)

012602744.b3lyp_6-31g(d).firefly.inp (generated)

012602744.b3lyp_6-31g(d).smash.inp (generated)

012602744.b3lyp_6-31g(d).nwchem.inp (generated) 012602744.b3lyp_6-31g(d).log.xz 012602744.td-b3lyp_6-31g+(d).inp 012602744.td-b3lyp_6-31g+(d).log.xz

012602744.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602744.td-b3lyp_6-31+g(d).gjf (generated)

012602744.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602744.mol 012602744.PUBCHEM 012602744.mol (via Jmol)
012602745.b3lyp_6-31g(d).inp

012602745.b3lyp_6-31g(d).qchem.inp (generated)

012602745.b3lyp_6-31g(d).gjf (generated)

012602745.b3lyp_6-31g(d).firefly.inp (generated)

012602745.b3lyp_6-31g(d).smash.inp (generated)

012602745.b3lyp_6-31g(d).nwchem.inp (generated) 012602745.b3lyp_6-31g(d).log.xz 012602745.td-b3lyp_6-31g+(d).inp 012602745.td-b3lyp_6-31g+(d).log.xz

012602745.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602745.td-b3lyp_6-31+g(d).gjf (generated)

012602745.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602745.mol 012602745.PUBCHEM 012602745.mol (via Jmol)
012602751.b3lyp_6-31g(d).inp

012602751.b3lyp_6-31g(d).qchem.inp (generated)

012602751.b3lyp_6-31g(d).gjf (generated)

012602751.b3lyp_6-31g(d).firefly.inp (generated)

012602751.b3lyp_6-31g(d).smash.inp (generated)

012602751.b3lyp_6-31g(d).nwchem.inp (generated) 012602751.b3lyp_6-31g(d).log.xz 012602751.td-b3lyp_6-31g+(d).inp 012602751.td-b3lyp_6-31g+(d).log.xz

012602751.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602751.td-b3lyp_6-31+g(d).gjf (generated)

012602751.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602751.mol 012602751.PUBCHEM 012602751.mol (via Jmol)
012602753.b3lyp_6-31g(d).inp

012602753.b3lyp_6-31g(d).qchem.inp (generated)

012602753.b3lyp_6-31g(d).gjf (generated)

012602753.b3lyp_6-31g(d).firefly.inp (generated)

012602753.b3lyp_6-31g(d).smash.inp (generated)

012602753.b3lyp_6-31g(d).nwchem.inp (generated) 012602753.b3lyp_6-31g(d).log.xz 012602753.mol 012602753.PUBCHEM 012602753.mol (via Jmol)
012602755.b3lyp_6-31g(d).inp

012602755.b3lyp_6-31g(d).qchem.inp (generated)

012602755.b3lyp_6-31g(d).gjf (generated)

012602755.b3lyp_6-31g(d).firefly.inp (generated)

012602755.b3lyp_6-31g(d).smash.inp (generated)

012602755.b3lyp_6-31g(d).nwchem.inp (generated) 012602755.b3lyp_6-31g(d).log.xz 012602755.td-b3lyp_6-31g+(d).inp 012602755.td-b3lyp_6-31g+(d).log.xz

012602755.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602755.td-b3lyp_6-31+g(d).gjf (generated)

012602755.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602755.mol 012602755.PUBCHEM 012602755.mol (via Jmol)
012602757.b3lyp_6-31g(d).inp

012602757.b3lyp_6-31g(d).qchem.inp (generated)

012602757.b3lyp_6-31g(d).gjf (generated)

012602757.b3lyp_6-31g(d).firefly.inp (generated)

012602757.b3lyp_6-31g(d).smash.inp (generated)

012602757.b3lyp_6-31g(d).nwchem.inp (generated) 012602757.b3lyp_6-31g(d).log.xz 012602757.td-b3lyp_6-31g+(d).inp 012602757.td-b3lyp_6-31g+(d).log.xz

012602757.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602757.td-b3lyp_6-31+g(d).gjf (generated)

012602757.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602757.mol 012602757.PUBCHEM 012602757.mol (via Jmol)
012602784.b3lyp_6-31g(d).inp

012602784.b3lyp_6-31g(d).qchem.inp (generated)

012602784.b3lyp_6-31g(d).gjf (generated)

012602784.b3lyp_6-31g(d).firefly.inp (generated)

012602784.b3lyp_6-31g(d).smash.inp (generated)

012602784.b3lyp_6-31g(d).nwchem.inp (generated) 012602784.b3lyp_6-31g(d).log.xz 012602784.td-b3lyp_6-31g+(d).inp 012602784.td-b3lyp_6-31g+(d).log.xz

012602784.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602784.td-b3lyp_6-31+g(d).gjf (generated)

012602784.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602784.mol 012602784.PUBCHEM 012602784.mol (via Jmol)
012602786.b3lyp_6-31g(d).inp

012602786.b3lyp_6-31g(d).qchem.inp (generated)

012602786.b3lyp_6-31g(d).gjf (generated)

012602786.b3lyp_6-31g(d).firefly.inp (generated)

012602786.b3lyp_6-31g(d).smash.inp (generated)

012602786.b3lyp_6-31g(d).nwchem.inp (generated) 012602786.b3lyp_6-31g(d).log.xz 012602786.td-b3lyp_6-31g+(d).inp 012602786.td-b3lyp_6-31g+(d).log.xz

012602786.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602786.td-b3lyp_6-31+g(d).gjf (generated)

012602786.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602786.mol 012602786.PUBCHEM 012602786.mol (via Jmol)
012602788.b3lyp_6-31g(d).inp

012602788.b3lyp_6-31g(d).qchem.inp (generated)

012602788.b3lyp_6-31g(d).gjf (generated)

012602788.b3lyp_6-31g(d).firefly.inp (generated)

012602788.b3lyp_6-31g(d).smash.inp (generated)

012602788.b3lyp_6-31g(d).nwchem.inp (generated) 012602788.b3lyp_6-31g(d).log.xz 012602788.td-b3lyp_6-31g+(d).inp 012602788.td-b3lyp_6-31g+(d).log.xz

012602788.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602788.td-b3lyp_6-31+g(d).gjf (generated)

012602788.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602788.mol 012602788.PUBCHEM 012602788.mol (via Jmol)
012602800.b3lyp_6-31g(d).inp

012602800.b3lyp_6-31g(d).qchem.inp (generated)

012602800.b3lyp_6-31g(d).gjf (generated)

012602800.b3lyp_6-31g(d).firefly.inp (generated)

012602800.b3lyp_6-31g(d).smash.inp (generated)

012602800.b3lyp_6-31g(d).nwchem.inp (generated) 012602800.b3lyp_6-31g(d).log.xz 012602800.td-b3lyp_6-31g+(d).inp 012602800.td-b3lyp_6-31g+(d).log.xz

012602800.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602800.td-b3lyp_6-31+g(d).gjf (generated)

012602800.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602800.mol 012602800.PUBCHEM 012602800.mol (via Jmol)
012602801.b3lyp_6-31g(d).inp

012602801.b3lyp_6-31g(d).qchem.inp (generated)

012602801.b3lyp_6-31g(d).gjf (generated)

012602801.b3lyp_6-31g(d).firefly.inp (generated)

012602801.b3lyp_6-31g(d).smash.inp (generated)

012602801.b3lyp_6-31g(d).nwchem.inp (generated) 012602801.b3lyp_6-31g(d).log.xz 012602801.td-b3lyp_6-31g+(d).inp 012602801.td-b3lyp_6-31g+(d).log.xz

012602801.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602801.td-b3lyp_6-31+g(d).gjf (generated)

012602801.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602801.mol 012602801.PUBCHEM 012602801.mol (via Jmol)
012602803.b3lyp_6-31g(d).inp

012602803.b3lyp_6-31g(d).qchem.inp (generated)

012602803.b3lyp_6-31g(d).gjf (generated)

012602803.b3lyp_6-31g(d).firefly.inp (generated)

012602803.b3lyp_6-31g(d).smash.inp (generated)

012602803.b3lyp_6-31g(d).nwchem.inp (generated) 012602803.b3lyp_6-31g(d).log.xz 012602803.td-b3lyp_6-31g+(d).inp 012602803.td-b3lyp_6-31g+(d).log.xz

012602803.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602803.td-b3lyp_6-31+g(d).gjf (generated)

012602803.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602803.mol 012602803.PUBCHEM 012602803.mol (via Jmol)
012602830.b3lyp_6-31g(d).inp

012602830.b3lyp_6-31g(d).qchem.inp (generated)

012602830.b3lyp_6-31g(d).gjf (generated)

012602830.b3lyp_6-31g(d).firefly.inp (generated)

012602830.b3lyp_6-31g(d).smash.inp (generated)

012602830.b3lyp_6-31g(d).nwchem.inp (generated) 012602830.b3lyp_6-31g(d).log.xz 012602830.td-b3lyp_6-31g+(d).inp 012602830.td-b3lyp_6-31g+(d).log.xz

012602830.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602830.td-b3lyp_6-31+g(d).gjf (generated)

012602830.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602830.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602830.mol 012602830.PUBCHEM 012602830.mol (via Jmol)
012602831.b3lyp_6-31g(d).inp

012602831.b3lyp_6-31g(d).qchem.inp (generated)

012602831.b3lyp_6-31g(d).gjf (generated)

012602831.b3lyp_6-31g(d).firefly.inp (generated)

012602831.b3lyp_6-31g(d).smash.inp (generated)

012602831.b3lyp_6-31g(d).nwchem.inp (generated) 012602831.b3lyp_6-31g(d).log.xz 012602831.td-b3lyp_6-31g+(d).inp 012602831.td-b3lyp_6-31g+(d).log.xz

012602831.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602831.td-b3lyp_6-31+g(d).gjf (generated)

012602831.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602831.mol 012602831.PUBCHEM 012602831.mol (via Jmol)
012602833.b3lyp_6-31g(d).inp

012602833.b3lyp_6-31g(d).qchem.inp (generated)

012602833.b3lyp_6-31g(d).gjf (generated)

012602833.b3lyp_6-31g(d).firefly.inp (generated)

012602833.b3lyp_6-31g(d).smash.inp (generated)

012602833.b3lyp_6-31g(d).nwchem.inp (generated) 012602833.b3lyp_6-31g(d).log.xz 012602833.td-b3lyp_6-31g+(d).inp 012602833.td-b3lyp_6-31g+(d).log.xz

012602833.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602833.td-b3lyp_6-31+g(d).gjf (generated)

012602833.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602833.mol 012602833.PUBCHEM 012602833.mol (via Jmol)
012602834.b3lyp_6-31g(d).inp

012602834.b3lyp_6-31g(d).qchem.inp (generated)

012602834.b3lyp_6-31g(d).gjf (generated)

012602834.b3lyp_6-31g(d).firefly.inp (generated)

012602834.b3lyp_6-31g(d).smash.inp (generated)

012602834.b3lyp_6-31g(d).nwchem.inp (generated) 012602834.b3lyp_6-31g(d).log.xz 012602834.td-b3lyp_6-31g+(d).inp 012602834.td-b3lyp_6-31g+(d).log.xz

012602834.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602834.td-b3lyp_6-31+g(d).gjf (generated)

012602834.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602834.mol 012602834.PUBCHEM 012602834.mol (via Jmol)
012602836.b3lyp_6-31g(d).inp

012602836.b3lyp_6-31g(d).qchem.inp (generated)

012602836.b3lyp_6-31g(d).gjf (generated)

012602836.b3lyp_6-31g(d).firefly.inp (generated)

012602836.b3lyp_6-31g(d).smash.inp (generated)

012602836.b3lyp_6-31g(d).nwchem.inp (generated) 012602836.b3lyp_6-31g(d).log.xz 012602836.td-b3lyp_6-31g+(d).inp 012602836.td-b3lyp_6-31g+(d).log.xz

012602836.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602836.td-b3lyp_6-31+g(d).gjf (generated)

012602836.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602836.mol 012602836.PUBCHEM 012602836.mol (via Jmol)
012602837.b3lyp_6-31g(d).inp

012602837.b3lyp_6-31g(d).qchem.inp (generated)

012602837.b3lyp_6-31g(d).gjf (generated)

012602837.b3lyp_6-31g(d).firefly.inp (generated)

012602837.b3lyp_6-31g(d).smash.inp (generated)

012602837.b3lyp_6-31g(d).nwchem.inp (generated) 012602837.b3lyp_6-31g(d).log.xz 012602837.td-b3lyp_6-31g+(d).inp 012602837.td-b3lyp_6-31g+(d).log.xz

012602837.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602837.td-b3lyp_6-31+g(d).gjf (generated)

012602837.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602837.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602837.mol 012602837.PUBCHEM 012602837.mol (via Jmol)
012602839.b3lyp_6-31g(d).inp

012602839.b3lyp_6-31g(d).qchem.inp (generated)

012602839.b3lyp_6-31g(d).gjf (generated)

012602839.b3lyp_6-31g(d).firefly.inp (generated)

012602839.b3lyp_6-31g(d).smash.inp (generated)

012602839.b3lyp_6-31g(d).nwchem.inp (generated) 012602839.b3lyp_6-31g(d).log.xz 012602839.td-b3lyp_6-31g+(d).inp 012602839.td-b3lyp_6-31g+(d).log.xz

012602839.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602839.td-b3lyp_6-31+g(d).gjf (generated)

012602839.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602839.mol 012602839.PUBCHEM 012602839.mol (via Jmol)
012602840.b3lyp_6-31g(d).inp

012602840.b3lyp_6-31g(d).qchem.inp (generated)

012602840.b3lyp_6-31g(d).gjf (generated)

012602840.b3lyp_6-31g(d).firefly.inp (generated)

012602840.b3lyp_6-31g(d).smash.inp (generated)

012602840.b3lyp_6-31g(d).nwchem.inp (generated) 012602840.b3lyp_6-31g(d).log.xz 012602840.td-b3lyp_6-31g+(d).inp 012602840.td-b3lyp_6-31g+(d).log.xz

012602840.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602840.td-b3lyp_6-31+g(d).gjf (generated)

012602840.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602840.mol 012602840.PUBCHEM 012602840.mol (via Jmol)
012602842.b3lyp_6-31g(d).inp

012602842.b3lyp_6-31g(d).qchem.inp (generated)

012602842.b3lyp_6-31g(d).gjf (generated)

012602842.b3lyp_6-31g(d).firefly.inp (generated)

012602842.b3lyp_6-31g(d).smash.inp (generated)

012602842.b3lyp_6-31g(d).nwchem.inp (generated) 012602842.b3lyp_6-31g(d).log.xz 012602842.td-b3lyp_6-31g+(d).inp 012602842.td-b3lyp_6-31g+(d).log.xz

012602842.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602842.td-b3lyp_6-31+g(d).gjf (generated)

012602842.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602842.mol 012602842.PUBCHEM 012602842.mol (via Jmol)
012602850.b3lyp_6-31g(d).inp

012602850.b3lyp_6-31g(d).qchem.inp (generated)

012602850.b3lyp_6-31g(d).gjf (generated)

012602850.b3lyp_6-31g(d).firefly.inp (generated)

012602850.b3lyp_6-31g(d).smash.inp (generated)

012602850.b3lyp_6-31g(d).nwchem.inp (generated) 012602850.b3lyp_6-31g(d).log.xz 012602850.td-b3lyp_6-31g+(d).inp 012602850.td-b3lyp_6-31g+(d).log.xz

012602850.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602850.td-b3lyp_6-31+g(d).gjf (generated)

012602850.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602850.mol 012602850.PUBCHEM 012602850.mol (via Jmol)
012602851.b3lyp_6-31g(d).inp

012602851.b3lyp_6-31g(d).qchem.inp (generated)

012602851.b3lyp_6-31g(d).gjf (generated)

012602851.b3lyp_6-31g(d).firefly.inp (generated)

012602851.b3lyp_6-31g(d).smash.inp (generated)

012602851.b3lyp_6-31g(d).nwchem.inp (generated) 012602851.b3lyp_6-31g(d).log.xz 012602851.td-b3lyp_6-31g+(d).inp 012602851.td-b3lyp_6-31g+(d).log.xz

012602851.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602851.td-b3lyp_6-31+g(d).gjf (generated)

012602851.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602851.mol 012602851.PUBCHEM 012602851.mol (via Jmol)
012602857.b3lyp_6-31g(d).inp

012602857.b3lyp_6-31g(d).qchem.inp (generated)

012602857.b3lyp_6-31g(d).gjf (generated)

012602857.b3lyp_6-31g(d).firefly.inp (generated)

012602857.b3lyp_6-31g(d).smash.inp (generated)

012602857.b3lyp_6-31g(d).nwchem.inp (generated) 012602857.b3lyp_6-31g(d).log.xz 012602857.td-b3lyp_6-31g+(d).inp 012602857.td-b3lyp_6-31g+(d).log.xz

012602857.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602857.td-b3lyp_6-31+g(d).gjf (generated)

012602857.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602857.mol 012602857.PUBCHEM 012602857.mol (via Jmol)
012602863.b3lyp_6-31g(d).inp

012602863.b3lyp_6-31g(d).qchem.inp (generated)

012602863.b3lyp_6-31g(d).gjf (generated)

012602863.b3lyp_6-31g(d).firefly.inp (generated)

012602863.b3lyp_6-31g(d).smash.inp (generated)

012602863.b3lyp_6-31g(d).nwchem.inp (generated) 012602863.b3lyp_6-31g(d).log.xz 012602863.td-b3lyp_6-31g+(d).inp 012602863.td-b3lyp_6-31g+(d).log.xz

012602863.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602863.td-b3lyp_6-31+g(d).gjf (generated)

012602863.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602863.mol 012602863.PUBCHEM 012602863.mol (via Jmol)
012602865.b3lyp_6-31g(d).inp

012602865.b3lyp_6-31g(d).qchem.inp (generated)

012602865.b3lyp_6-31g(d).gjf (generated)

012602865.b3lyp_6-31g(d).firefly.inp (generated)

012602865.b3lyp_6-31g(d).smash.inp (generated)

012602865.b3lyp_6-31g(d).nwchem.inp (generated) 012602865.b3lyp_6-31g(d).log.xz 012602865.td-b3lyp_6-31g+(d).inp 012602865.td-b3lyp_6-31g+(d).log.xz

012602865.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602865.td-b3lyp_6-31+g(d).gjf (generated)

012602865.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602865.mol 012602865.PUBCHEM 012602865.mol (via Jmol)
012602866.b3lyp_6-31g(d).inp

012602866.b3lyp_6-31g(d).qchem.inp (generated)

012602866.b3lyp_6-31g(d).gjf (generated)

012602866.b3lyp_6-31g(d).firefly.inp (generated)

012602866.b3lyp_6-31g(d).smash.inp (generated)

012602866.b3lyp_6-31g(d).nwchem.inp (generated) 012602866.b3lyp_6-31g(d).log.xz 012602866.td-b3lyp_6-31g+(d).inp 012602866.td-b3lyp_6-31g+(d).log.xz

012602866.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602866.td-b3lyp_6-31+g(d).gjf (generated)

012602866.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602866.mol 012602866.PUBCHEM 012602866.mol (via Jmol)
012602867.b3lyp_6-31g(d).inp

012602867.b3lyp_6-31g(d).qchem.inp (generated)

012602867.b3lyp_6-31g(d).gjf (generated)

012602867.b3lyp_6-31g(d).firefly.inp (generated)

012602867.b3lyp_6-31g(d).smash.inp (generated)

012602867.b3lyp_6-31g(d).nwchem.inp (generated) 012602867.b3lyp_6-31g(d).log.xz 012602867.td-b3lyp_6-31g+(d).inp 012602867.td-b3lyp_6-31g+(d).log.xz

012602867.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602867.td-b3lyp_6-31+g(d).gjf (generated)

012602867.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602867.mol 012602867.PUBCHEM 012602867.mol (via Jmol)
012602868.b3lyp_6-31g(d).inp

012602868.b3lyp_6-31g(d).qchem.inp (generated)

012602868.b3lyp_6-31g(d).gjf (generated)

012602868.b3lyp_6-31g(d).firefly.inp (generated)

012602868.b3lyp_6-31g(d).smash.inp (generated)

012602868.b3lyp_6-31g(d).nwchem.inp (generated) 012602868.b3lyp_6-31g(d).log.xz 012602868.td-b3lyp_6-31g+(d).inp 012602868.td-b3lyp_6-31g+(d).log.xz

012602868.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602868.td-b3lyp_6-31+g(d).gjf (generated)

012602868.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602868.mol 012602868.PUBCHEM 012602868.mol (via Jmol)
012602871.b3lyp_6-31g(d).inp

012602871.b3lyp_6-31g(d).qchem.inp (generated)

012602871.b3lyp_6-31g(d).gjf (generated)

012602871.b3lyp_6-31g(d).firefly.inp (generated)

012602871.b3lyp_6-31g(d).smash.inp (generated)

012602871.b3lyp_6-31g(d).nwchem.inp (generated) 012602871.b3lyp_6-31g(d).log.xz 012602871.td-b3lyp_6-31g+(d).inp 012602871.td-b3lyp_6-31g+(d).log.xz

012602871.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602871.td-b3lyp_6-31+g(d).gjf (generated)

012602871.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602871.mol 012602871.PUBCHEM 012602871.mol (via Jmol)
012602876.b3lyp_6-31g(d).inp

012602876.b3lyp_6-31g(d).qchem.inp (generated)

012602876.b3lyp_6-31g(d).gjf (generated)

012602876.b3lyp_6-31g(d).firefly.inp (generated)

012602876.b3lyp_6-31g(d).smash.inp (generated)

012602876.b3lyp_6-31g(d).nwchem.inp (generated) 012602876.b3lyp_6-31g(d).log.xz 012602876.td-b3lyp_6-31g+(d).inp 012602876.td-b3lyp_6-31g+(d).log.xz

012602876.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602876.td-b3lyp_6-31+g(d).gjf (generated)

012602876.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602876.mol 012602876.PUBCHEM 012602876.mol (via Jmol)
012602894.b3lyp_6-31g(d).inp

012602894.b3lyp_6-31g(d).qchem.inp (generated)

012602894.b3lyp_6-31g(d).gjf (generated)

012602894.b3lyp_6-31g(d).firefly.inp (generated)

012602894.b3lyp_6-31g(d).smash.inp (generated)

012602894.b3lyp_6-31g(d).nwchem.inp (generated) 012602894.b3lyp_6-31g(d).log.xz 012602894.mol 012602894.PUBCHEM 012602894.mol (via Jmol)
012602895.b3lyp_6-31g(d).inp

012602895.b3lyp_6-31g(d).qchem.inp (generated)

012602895.b3lyp_6-31g(d).gjf (generated)

012602895.b3lyp_6-31g(d).firefly.inp (generated)

012602895.b3lyp_6-31g(d).smash.inp (generated)

012602895.b3lyp_6-31g(d).nwchem.inp (generated) 012602895.b3lyp_6-31g(d).log.xz 012602895.td-b3lyp_6-31g+(d).inp 012602895.td-b3lyp_6-31g+(d).log.xz

012602895.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602895.td-b3lyp_6-31+g(d).gjf (generated)

012602895.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602895.mol 012602895.PUBCHEM 012602895.mol (via Jmol)
012602897.b3lyp_6-31g(d).inp

012602897.b3lyp_6-31g(d).qchem.inp (generated)

012602897.b3lyp_6-31g(d).gjf (generated)

012602897.b3lyp_6-31g(d).firefly.inp (generated)

012602897.b3lyp_6-31g(d).smash.inp (generated)

012602897.b3lyp_6-31g(d).nwchem.inp (generated) 012602897.b3lyp_6-31g(d).log.xz 012602897.td-b3lyp_6-31g+(d).inp 012602897.td-b3lyp_6-31g+(d).log.xz

012602897.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602897.td-b3lyp_6-31+g(d).gjf (generated)

012602897.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602897.mol 012602897.PUBCHEM 012602897.mol (via Jmol)
012602914.b3lyp_6-31g(d).inp

012602914.b3lyp_6-31g(d).qchem.inp (generated)

012602914.b3lyp_6-31g(d).gjf (generated)

012602914.b3lyp_6-31g(d).firefly.inp (generated)

012602914.b3lyp_6-31g(d).smash.inp (generated)

012602914.b3lyp_6-31g(d).nwchem.inp (generated) 012602914.b3lyp_6-31g(d).log.xz 012602914.td-b3lyp_6-31g+(d).inp 012602914.td-b3lyp_6-31g+(d).log.xz

012602914.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602914.td-b3lyp_6-31+g(d).gjf (generated)

012602914.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602914.mol 012602914.PUBCHEM 012602914.mol (via Jmol)
012602917.b3lyp_6-31g(d).inp

012602917.b3lyp_6-31g(d).qchem.inp (generated)

012602917.b3lyp_6-31g(d).gjf (generated)

012602917.b3lyp_6-31g(d).firefly.inp (generated)

012602917.b3lyp_6-31g(d).smash.inp (generated)

012602917.b3lyp_6-31g(d).nwchem.inp (generated) 012602917.b3lyp_6-31g(d).log.xz 012602917.td-b3lyp_6-31g+(d).inp 012602917.td-b3lyp_6-31g+(d).log.xz

012602917.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602917.td-b3lyp_6-31+g(d).gjf (generated)

012602917.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602917.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602917.mol 012602917.PUBCHEM 012602917.mol (via Jmol)
012602921.b3lyp_6-31g(d).inp

012602921.b3lyp_6-31g(d).qchem.inp (generated)

012602921.b3lyp_6-31g(d).gjf (generated)

012602921.b3lyp_6-31g(d).firefly.inp (generated)

012602921.b3lyp_6-31g(d).smash.inp (generated)

012602921.b3lyp_6-31g(d).nwchem.inp (generated) 012602921.b3lyp_6-31g(d).log.xz 012602921.td-b3lyp_6-31g+(d).inp 012602921.td-b3lyp_6-31g+(d).log.xz

012602921.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602921.td-b3lyp_6-31+g(d).gjf (generated)

012602921.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602921.mol 012602921.PUBCHEM 012602921.mol (via Jmol)
012602922.b3lyp_6-31g(d).inp

012602922.b3lyp_6-31g(d).qchem.inp (generated)

012602922.b3lyp_6-31g(d).gjf (generated)

012602922.b3lyp_6-31g(d).firefly.inp (generated)

012602922.b3lyp_6-31g(d).smash.inp (generated)

012602922.b3lyp_6-31g(d).nwchem.inp (generated) 012602922.b3lyp_6-31g(d).log.xz 012602922.td-b3lyp_6-31g+(d).inp 012602922.td-b3lyp_6-31g+(d).log.xz

012602922.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602922.td-b3lyp_6-31+g(d).gjf (generated)

012602922.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602922.mol 012602922.PUBCHEM 012602922.mol (via Jmol)
012602923.b3lyp_6-31g(d).inp

012602923.b3lyp_6-31g(d).qchem.inp (generated)

012602923.b3lyp_6-31g(d).gjf (generated)

012602923.b3lyp_6-31g(d).firefly.inp (generated)

012602923.b3lyp_6-31g(d).smash.inp (generated)

012602923.b3lyp_6-31g(d).nwchem.inp (generated) 012602923.b3lyp_6-31g(d).log.xz 012602923.td-b3lyp_6-31g+(d).inp 012602923.td-b3lyp_6-31g+(d).log.xz

012602923.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602923.td-b3lyp_6-31+g(d).gjf (generated)

012602923.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602923.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602923.mol 012602923.PUBCHEM 012602923.mol (via Jmol)
012602925.b3lyp_6-31g(d).inp

012602925.b3lyp_6-31g(d).qchem.inp (generated)

012602925.b3lyp_6-31g(d).gjf (generated)

012602925.b3lyp_6-31g(d).firefly.inp (generated)

012602925.b3lyp_6-31g(d).smash.inp (generated)

012602925.b3lyp_6-31g(d).nwchem.inp (generated) 012602925.b3lyp_6-31g(d).log.xz 012602925.td-b3lyp_6-31g+(d).inp 012602925.td-b3lyp_6-31g+(d).log.xz

012602925.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602925.td-b3lyp_6-31+g(d).gjf (generated)

012602925.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602925.mol 012602925.PUBCHEM 012602925.mol (via Jmol)
012602926.b3lyp_6-31g(d).inp

012602926.b3lyp_6-31g(d).qchem.inp (generated)

012602926.b3lyp_6-31g(d).gjf (generated)

012602926.b3lyp_6-31g(d).firefly.inp (generated)

012602926.b3lyp_6-31g(d).smash.inp (generated)

012602926.b3lyp_6-31g(d).nwchem.inp (generated) 012602926.b3lyp_6-31g(d).log.xz 012602926.td-b3lyp_6-31g+(d).inp 012602926.td-b3lyp_6-31g+(d).log.xz

012602926.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602926.td-b3lyp_6-31+g(d).gjf (generated)

012602926.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602926.mol 012602926.PUBCHEM 012602926.mol (via Jmol)
012602930.b3lyp_6-31g(d).inp

012602930.b3lyp_6-31g(d).qchem.inp (generated)

012602930.b3lyp_6-31g(d).gjf (generated)

012602930.b3lyp_6-31g(d).firefly.inp (generated)

012602930.b3lyp_6-31g(d).smash.inp (generated)

012602930.b3lyp_6-31g(d).nwchem.inp (generated) 012602930.b3lyp_6-31g(d).log.xz 012602930.td-b3lyp_6-31g+(d).inp 012602930.td-b3lyp_6-31g+(d).log.xz

012602930.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602930.td-b3lyp_6-31+g(d).gjf (generated)

012602930.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602930.mol 012602930.PUBCHEM 012602930.mol (via Jmol)
012602942.b3lyp_6-31g(d).inp

012602942.b3lyp_6-31g(d).qchem.inp (generated)

012602942.b3lyp_6-31g(d).gjf (generated)

012602942.b3lyp_6-31g(d).firefly.inp (generated)

012602942.b3lyp_6-31g(d).smash.inp (generated)

012602942.b3lyp_6-31g(d).nwchem.inp (generated) 012602942.b3lyp_6-31g(d).log.xz 012602942.td-b3lyp_6-31g+(d).inp 012602942.td-b3lyp_6-31g+(d).log.xz

012602942.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602942.td-b3lyp_6-31+g(d).gjf (generated)

012602942.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602942.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602942.mol 012602942.PUBCHEM 012602942.mol (via Jmol)
012602951.b3lyp_6-31g(d).inp

012602951.b3lyp_6-31g(d).qchem.inp (generated)

012602951.b3lyp_6-31g(d).gjf (generated)

012602951.b3lyp_6-31g(d).firefly.inp (generated)

012602951.b3lyp_6-31g(d).smash.inp (generated)

012602951.b3lyp_6-31g(d).nwchem.inp (generated) 012602951.b3lyp_6-31g(d).log.xz 012602951.td-b3lyp_6-31g+(d).inp 012602951.td-b3lyp_6-31g+(d).log.xz

012602951.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602951.td-b3lyp_6-31+g(d).gjf (generated)

012602951.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602951.mol 012602951.PUBCHEM 012602951.mol (via Jmol)
012602953.b3lyp_6-31g(d).inp

012602953.b3lyp_6-31g(d).qchem.inp (generated)

012602953.b3lyp_6-31g(d).gjf (generated)

012602953.b3lyp_6-31g(d).firefly.inp (generated)

012602953.b3lyp_6-31g(d).smash.inp (generated)

012602953.b3lyp_6-31g(d).nwchem.inp (generated) 012602953.b3lyp_6-31g(d).log.xz 012602953.td-b3lyp_6-31g+(d).inp 012602953.td-b3lyp_6-31g+(d).log.xz

012602953.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602953.td-b3lyp_6-31+g(d).gjf (generated)

012602953.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602953.mol 012602953.PUBCHEM 012602953.mol (via Jmol)
012602974.b3lyp_6-31g(d).inp

012602974.b3lyp_6-31g(d).qchem.inp (generated)

012602974.b3lyp_6-31g(d).gjf (generated)

012602974.b3lyp_6-31g(d).firefly.inp (generated)

012602974.b3lyp_6-31g(d).smash.inp (generated)

012602974.b3lyp_6-31g(d).nwchem.inp (generated) 012602974.b3lyp_6-31g(d).log.xz 012602974.td-b3lyp_6-31g+(d).inp 012602974.td-b3lyp_6-31g+(d).log.xz

012602974.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602974.td-b3lyp_6-31+g(d).gjf (generated)

012602974.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602974.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602974.mol 012602974.PUBCHEM 012602974.mol (via Jmol)
012602975.b3lyp_6-31g(d).inp

012602975.b3lyp_6-31g(d).qchem.inp (generated)

012602975.b3lyp_6-31g(d).gjf (generated)

012602975.b3lyp_6-31g(d).firefly.inp (generated)

012602975.b3lyp_6-31g(d).smash.inp (generated)

012602975.b3lyp_6-31g(d).nwchem.inp (generated) 012602975.b3lyp_6-31g(d).log.xz 012602975.td-b3lyp_6-31g+(d).inp 012602975.td-b3lyp_6-31g+(d).log.xz

012602975.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602975.td-b3lyp_6-31+g(d).gjf (generated)

012602975.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602975.mol 012602975.PUBCHEM 012602975.mol (via Jmol)
012602977.b3lyp_6-31g(d).inp

012602977.b3lyp_6-31g(d).qchem.inp (generated)

012602977.b3lyp_6-31g(d).gjf (generated)

012602977.b3lyp_6-31g(d).firefly.inp (generated)

012602977.b3lyp_6-31g(d).smash.inp (generated)

012602977.b3lyp_6-31g(d).nwchem.inp (generated) 012602977.b3lyp_6-31g(d).log.xz 012602977.mol 012602977.PUBCHEM 012602977.mol (via Jmol)
012602978.b3lyp_6-31g(d).inp

012602978.b3lyp_6-31g(d).qchem.inp (generated)

012602978.b3lyp_6-31g(d).gjf (generated)

012602978.b3lyp_6-31g(d).firefly.inp (generated)

012602978.b3lyp_6-31g(d).smash.inp (generated)

012602978.b3lyp_6-31g(d).nwchem.inp (generated) 012602978.b3lyp_6-31g(d).log.xz 012602978.td-b3lyp_6-31g+(d).inp 012602978.td-b3lyp_6-31g+(d).log.xz

012602978.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602978.td-b3lyp_6-31+g(d).gjf (generated)

012602978.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602978.mol 012602978.PUBCHEM 012602978.mol (via Jmol)
012602979.b3lyp_6-31g(d).inp

012602979.b3lyp_6-31g(d).qchem.inp (generated)

012602979.b3lyp_6-31g(d).gjf (generated)

012602979.b3lyp_6-31g(d).firefly.inp (generated)

012602979.b3lyp_6-31g(d).smash.inp (generated)

012602979.b3lyp_6-31g(d).nwchem.inp (generated) 012602979.b3lyp_6-31g(d).log.xz 012602979.td-b3lyp_6-31g+(d).inp 012602979.td-b3lyp_6-31g+(d).log.xz

012602979.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602979.td-b3lyp_6-31+g(d).gjf (generated)

012602979.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602979.mol 012602979.PUBCHEM 012602979.mol (via Jmol)
012602980.b3lyp_6-31g(d).inp

012602980.b3lyp_6-31g(d).qchem.inp (generated)

012602980.b3lyp_6-31g(d).gjf (generated)

012602980.b3lyp_6-31g(d).firefly.inp (generated)

012602980.b3lyp_6-31g(d).smash.inp (generated)

012602980.b3lyp_6-31g(d).nwchem.inp (generated) 012602980.b3lyp_6-31g(d).log.xz 012602980.td-b3lyp_6-31g+(d).inp 012602980.td-b3lyp_6-31g+(d).log.xz

012602980.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602980.td-b3lyp_6-31+g(d).gjf (generated)

012602980.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602980.mol 012602980.PUBCHEM 012602980.mol (via Jmol)
012602981.b3lyp_6-31g(d).inp

012602981.b3lyp_6-31g(d).qchem.inp (generated)

012602981.b3lyp_6-31g(d).gjf (generated)

012602981.b3lyp_6-31g(d).firefly.inp (generated)

012602981.b3lyp_6-31g(d).smash.inp (generated)

012602981.b3lyp_6-31g(d).nwchem.inp (generated) 012602981.b3lyp_6-31g(d).log.xz 012602981.td-b3lyp_6-31g+(d).inp 012602981.td-b3lyp_6-31g+(d).log.xz

012602981.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602981.td-b3lyp_6-31+g(d).gjf (generated)

012602981.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602981.mol 012602981.PUBCHEM 012602981.mol (via Jmol)
012602982.b3lyp_6-31g(d).inp

012602982.b3lyp_6-31g(d).qchem.inp (generated)

012602982.b3lyp_6-31g(d).gjf (generated)

012602982.b3lyp_6-31g(d).firefly.inp (generated)

012602982.b3lyp_6-31g(d).smash.inp (generated)

012602982.b3lyp_6-31g(d).nwchem.inp (generated) 012602982.b3lyp_6-31g(d).log.xz 012602982.td-b3lyp_6-31g+(d).inp 012602982.td-b3lyp_6-31g+(d).log.xz

012602982.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602982.td-b3lyp_6-31+g(d).gjf (generated)

012602982.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602982.mol 012602982.PUBCHEM 012602982.mol (via Jmol)
012602984.b3lyp_6-31g(d).inp

012602984.b3lyp_6-31g(d).qchem.inp (generated)

012602984.b3lyp_6-31g(d).gjf (generated)

012602984.b3lyp_6-31g(d).firefly.inp (generated)

012602984.b3lyp_6-31g(d).smash.inp (generated)

012602984.b3lyp_6-31g(d).nwchem.inp (generated) 012602984.b3lyp_6-31g(d).log.xz 012602984.td-b3lyp_6-31g+(d).inp 012602984.td-b3lyp_6-31g+(d).log.xz

012602984.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602984.td-b3lyp_6-31+g(d).gjf (generated)

012602984.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602984.mol 012602984.PUBCHEM 012602984.mol (via Jmol)
012602985.b3lyp_6-31g(d).inp

012602985.b3lyp_6-31g(d).qchem.inp (generated)

012602985.b3lyp_6-31g(d).gjf (generated)

012602985.b3lyp_6-31g(d).firefly.inp (generated)

012602985.b3lyp_6-31g(d).smash.inp (generated)

012602985.b3lyp_6-31g(d).nwchem.inp (generated) 012602985.b3lyp_6-31g(d).log.xz 012602985.mol 012602985.PUBCHEM 012602985.mol (via Jmol)
012602986.b3lyp_6-31g(d).inp

012602986.b3lyp_6-31g(d).qchem.inp (generated)

012602986.b3lyp_6-31g(d).gjf (generated)

012602986.b3lyp_6-31g(d).firefly.inp (generated)

012602986.b3lyp_6-31g(d).smash.inp (generated)

012602986.b3lyp_6-31g(d).nwchem.inp (generated) 012602986.b3lyp_6-31g(d).log.xz 012602986.td-b3lyp_6-31g+(d).inp 012602986.td-b3lyp_6-31g+(d).log.xz

012602986.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602986.td-b3lyp_6-31+g(d).gjf (generated)

012602986.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602986.mol 012602986.PUBCHEM 012602986.mol (via Jmol)
012602987.b3lyp_6-31g(d).inp

012602987.b3lyp_6-31g(d).qchem.inp (generated)

012602987.b3lyp_6-31g(d).gjf (generated)

012602987.b3lyp_6-31g(d).firefly.inp (generated)

012602987.b3lyp_6-31g(d).smash.inp (generated)

012602987.b3lyp_6-31g(d).nwchem.inp (generated) 012602987.b3lyp_6-31g(d).log.xz 012602987.td-b3lyp_6-31g+(d).inp 012602987.td-b3lyp_6-31g+(d).log.xz

012602987.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602987.td-b3lyp_6-31+g(d).gjf (generated)

012602987.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602987.mol 012602987.PUBCHEM 012602987.mol (via Jmol)
012602992.b3lyp_6-31g(d).inp

012602992.b3lyp_6-31g(d).qchem.inp (generated)

012602992.b3lyp_6-31g(d).gjf (generated)

012602992.b3lyp_6-31g(d).firefly.inp (generated)

012602992.b3lyp_6-31g(d).smash.inp (generated)

012602992.b3lyp_6-31g(d).nwchem.inp (generated) 012602992.b3lyp_6-31g(d).log.xz 012602992.td-b3lyp_6-31g+(d).inp 012602992.td-b3lyp_6-31g+(d).log.xz

012602992.td-b3lyp_6-31+g(d).qchem.inp (generated)

012602992.td-b3lyp_6-31+g(d).gjf (generated)

012602992.td-b3lyp_6-31+g(d).firefly.inp (generated)

012602992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012602992.mol 012602992.PUBCHEM 012602992.mol (via Jmol)
012603000.b3lyp_6-31g(d).inp

012603000.b3lyp_6-31g(d).qchem.inp (generated)

012603000.b3lyp_6-31g(d).gjf (generated)

012603000.b3lyp_6-31g(d).firefly.inp (generated)

012603000.b3lyp_6-31g(d).smash.inp (generated)

012603000.b3lyp_6-31g(d).nwchem.inp (generated) 012603000.b3lyp_6-31g(d).log.xz 012603000.td-b3lyp_6-31g+(d).inp 012603000.td-b3lyp_6-31g+(d).log.xz

012603000.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603000.td-b3lyp_6-31+g(d).gjf (generated)

012603000.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603000.mol 012603000.PUBCHEM 012603000.mol (via Jmol)
012603001.b3lyp_6-31g(d).inp

012603001.b3lyp_6-31g(d).qchem.inp (generated)

012603001.b3lyp_6-31g(d).gjf (generated)

012603001.b3lyp_6-31g(d).firefly.inp (generated)

012603001.b3lyp_6-31g(d).smash.inp (generated)

012603001.b3lyp_6-31g(d).nwchem.inp (generated) 012603001.b3lyp_6-31g(d).log.xz 012603001.td-b3lyp_6-31g+(d).inp 012603001.td-b3lyp_6-31g+(d).log.xz

012603001.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603001.td-b3lyp_6-31+g(d).gjf (generated)

012603001.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603001.mol 012603001.PUBCHEM 012603001.mol (via Jmol)
012603002.b3lyp_6-31g(d).inp

012603002.b3lyp_6-31g(d).qchem.inp (generated)

012603002.b3lyp_6-31g(d).gjf (generated)

012603002.b3lyp_6-31g(d).firefly.inp (generated)

012603002.b3lyp_6-31g(d).smash.inp (generated)

012603002.b3lyp_6-31g(d).nwchem.inp (generated) 012603002.b3lyp_6-31g(d).log.xz 012603002.td-b3lyp_6-31g+(d).inp 012603002.td-b3lyp_6-31g+(d).log.xz

012603002.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603002.td-b3lyp_6-31+g(d).gjf (generated)

012603002.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603002.mol 012603002.PUBCHEM 012603002.mol (via Jmol)
012603003.b3lyp_6-31g(d).inp

012603003.b3lyp_6-31g(d).qchem.inp (generated)

012603003.b3lyp_6-31g(d).gjf (generated)

012603003.b3lyp_6-31g(d).firefly.inp (generated)

012603003.b3lyp_6-31g(d).smash.inp (generated)

012603003.b3lyp_6-31g(d).nwchem.inp (generated) 012603003.b3lyp_6-31g(d).log.xz 012603003.td-b3lyp_6-31g+(d).inp 012603003.td-b3lyp_6-31g+(d).log.xz

012603003.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603003.td-b3lyp_6-31+g(d).gjf (generated)

012603003.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603003.mol 012603003.PUBCHEM 012603003.mol (via Jmol)
012603004.b3lyp_6-31g(d).inp

012603004.b3lyp_6-31g(d).qchem.inp (generated)

012603004.b3lyp_6-31g(d).gjf (generated)

012603004.b3lyp_6-31g(d).firefly.inp (generated)

012603004.b3lyp_6-31g(d).smash.inp (generated)

012603004.b3lyp_6-31g(d).nwchem.inp (generated) 012603004.b3lyp_6-31g(d).log.xz 012603004.td-b3lyp_6-31g+(d).inp 012603004.td-b3lyp_6-31g+(d).log.xz

012603004.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603004.td-b3lyp_6-31+g(d).gjf (generated)

012603004.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603004.mol 012603004.PUBCHEM 012603004.mol (via Jmol)
012603005.b3lyp_6-31g(d).inp

012603005.b3lyp_6-31g(d).qchem.inp (generated)

012603005.b3lyp_6-31g(d).gjf (generated)

012603005.b3lyp_6-31g(d).firefly.inp (generated)

012603005.b3lyp_6-31g(d).smash.inp (generated)

012603005.b3lyp_6-31g(d).nwchem.inp (generated) 012603005.b3lyp_6-31g(d).log.xz 012603005.td-b3lyp_6-31g+(d).inp 012603005.td-b3lyp_6-31g+(d).log.xz

012603005.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603005.td-b3lyp_6-31+g(d).gjf (generated)

012603005.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603005.mol 012603005.PUBCHEM 012603005.mol (via Jmol)
012603027.b3lyp_6-31g(d).inp

012603027.b3lyp_6-31g(d).qchem.inp (generated)

012603027.b3lyp_6-31g(d).gjf (generated)

012603027.b3lyp_6-31g(d).firefly.inp (generated)

012603027.b3lyp_6-31g(d).smash.inp (generated)

012603027.b3lyp_6-31g(d).nwchem.inp (generated) 012603027.b3lyp_6-31g(d).log.xz 012603027.td-b3lyp_6-31g+(d).inp 012603027.td-b3lyp_6-31g+(d).log.xz

012603027.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603027.td-b3lyp_6-31+g(d).gjf (generated)

012603027.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603027.mol 012603027.PUBCHEM 012603027.mol (via Jmol)
012603029.b3lyp_6-31g(d).inp

012603029.b3lyp_6-31g(d).qchem.inp (generated)

012603029.b3lyp_6-31g(d).gjf (generated)

012603029.b3lyp_6-31g(d).firefly.inp (generated)

012603029.b3lyp_6-31g(d).smash.inp (generated)

012603029.b3lyp_6-31g(d).nwchem.inp (generated) 012603029.b3lyp_6-31g(d).log.xz 012603029.td-b3lyp_6-31g+(d).inp 012603029.td-b3lyp_6-31g+(d).log.xz

012603029.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603029.td-b3lyp_6-31+g(d).gjf (generated)

012603029.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603029.mol 012603029.PUBCHEM 012603029.mol (via Jmol)
012603031.b3lyp_6-31g(d).inp

012603031.b3lyp_6-31g(d).qchem.inp (generated)

012603031.b3lyp_6-31g(d).gjf (generated)

012603031.b3lyp_6-31g(d).firefly.inp (generated)

012603031.b3lyp_6-31g(d).smash.inp (generated)

012603031.b3lyp_6-31g(d).nwchem.inp (generated) 012603031.b3lyp_6-31g(d).log.xz 012603031.td-b3lyp_6-31g+(d).inp 012603031.td-b3lyp_6-31g+(d).log.xz

012603031.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603031.td-b3lyp_6-31+g(d).gjf (generated)

012603031.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603031.mol 012603031.PUBCHEM 012603031.mol (via Jmol)
012603038.b3lyp_6-31g(d).inp

012603038.b3lyp_6-31g(d).qchem.inp (generated)

012603038.b3lyp_6-31g(d).gjf (generated)

012603038.b3lyp_6-31g(d).firefly.inp (generated)

012603038.b3lyp_6-31g(d).smash.inp (generated)

012603038.b3lyp_6-31g(d).nwchem.inp (generated) 012603038.b3lyp_6-31g(d).log.xz 012603038.td-b3lyp_6-31g+(d).inp 012603038.td-b3lyp_6-31g+(d).log.xz

012603038.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603038.td-b3lyp_6-31+g(d).gjf (generated)

012603038.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603038.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603038.mol 012603038.PUBCHEM 012603038.mol (via Jmol)
012603040.b3lyp_6-31g(d).inp

012603040.b3lyp_6-31g(d).qchem.inp (generated)

012603040.b3lyp_6-31g(d).gjf (generated)

012603040.b3lyp_6-31g(d).firefly.inp (generated)

012603040.b3lyp_6-31g(d).smash.inp (generated)

012603040.b3lyp_6-31g(d).nwchem.inp (generated) 012603040.b3lyp_6-31g(d).log.xz 012603040.td-b3lyp_6-31g+(d).inp 012603040.td-b3lyp_6-31g+(d).log.xz

012603040.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603040.td-b3lyp_6-31+g(d).gjf (generated)

012603040.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603040.mol 012603040.PUBCHEM 012603040.mol (via Jmol)
012603056.b3lyp_6-31g(d).inp

012603056.b3lyp_6-31g(d).qchem.inp (generated)

012603056.b3lyp_6-31g(d).gjf (generated)

012603056.b3lyp_6-31g(d).firefly.inp (generated)

012603056.b3lyp_6-31g(d).smash.inp (generated)

012603056.b3lyp_6-31g(d).nwchem.inp (generated) 012603056.b3lyp_6-31g(d).log.xz 012603056.td-b3lyp_6-31g+(d).inp 012603056.td-b3lyp_6-31g+(d).log.xz

012603056.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603056.td-b3lyp_6-31+g(d).gjf (generated)

012603056.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603056.mol 012603056.PUBCHEM 012603056.mol (via Jmol)
012603057.b3lyp_6-31g(d).inp

012603057.b3lyp_6-31g(d).qchem.inp (generated)

012603057.b3lyp_6-31g(d).gjf (generated)

012603057.b3lyp_6-31g(d).firefly.inp (generated)

012603057.b3lyp_6-31g(d).smash.inp (generated)

012603057.b3lyp_6-31g(d).nwchem.inp (generated) 012603057.b3lyp_6-31g(d).log.xz 012603057.td-b3lyp_6-31g+(d).inp 012603057.td-b3lyp_6-31g+(d).log.xz

012603057.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603057.td-b3lyp_6-31+g(d).gjf (generated)

012603057.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603057.mol 012603057.PUBCHEM 012603057.mol (via Jmol)
012603058.b3lyp_6-31g(d).inp

012603058.b3lyp_6-31g(d).qchem.inp (generated)

012603058.b3lyp_6-31g(d).gjf (generated)

012603058.b3lyp_6-31g(d).firefly.inp (generated)

012603058.b3lyp_6-31g(d).smash.inp (generated)

012603058.b3lyp_6-31g(d).nwchem.inp (generated) 012603058.b3lyp_6-31g(d).log.xz 012603058.td-b3lyp_6-31g+(d).inp 012603058.td-b3lyp_6-31g+(d).log.xz

012603058.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603058.td-b3lyp_6-31+g(d).gjf (generated)

012603058.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603058.mol 012603058.PUBCHEM 012603058.mol (via Jmol)
012603059.b3lyp_6-31g(d).inp

012603059.b3lyp_6-31g(d).qchem.inp (generated)

012603059.b3lyp_6-31g(d).gjf (generated)

012603059.b3lyp_6-31g(d).firefly.inp (generated)

012603059.b3lyp_6-31g(d).smash.inp (generated)

012603059.b3lyp_6-31g(d).nwchem.inp (generated) 012603059.b3lyp_6-31g(d).log.xz 012603059.td-b3lyp_6-31g+(d).inp 012603059.td-b3lyp_6-31g+(d).log.xz

012603059.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603059.td-b3lyp_6-31+g(d).gjf (generated)

012603059.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603059.mol 012603059.PUBCHEM 012603059.mol (via Jmol)
012603062.b3lyp_6-31g(d).inp

012603062.b3lyp_6-31g(d).qchem.inp (generated)

012603062.b3lyp_6-31g(d).gjf (generated)

012603062.b3lyp_6-31g(d).firefly.inp (generated)

012603062.b3lyp_6-31g(d).smash.inp (generated)

012603062.b3lyp_6-31g(d).nwchem.inp (generated) 012603062.b3lyp_6-31g(d).log.xz 012603062.td-b3lyp_6-31g+(d).inp 012603062.td-b3lyp_6-31g+(d).log.xz

012603062.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603062.td-b3lyp_6-31+g(d).gjf (generated)

012603062.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603062.mol 012603062.PUBCHEM 012603062.mol (via Jmol)
012603064.b3lyp_6-31g(d).inp

012603064.b3lyp_6-31g(d).qchem.inp (generated)

012603064.b3lyp_6-31g(d).gjf (generated)

012603064.b3lyp_6-31g(d).firefly.inp (generated)

012603064.b3lyp_6-31g(d).smash.inp (generated)

012603064.b3lyp_6-31g(d).nwchem.inp (generated) 012603064.b3lyp_6-31g(d).log.xz 012603064.td-b3lyp_6-31g+(d).inp 012603064.td-b3lyp_6-31g+(d).log.xz

012603064.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603064.td-b3lyp_6-31+g(d).gjf (generated)

012603064.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603064.mol 012603064.PUBCHEM 012603064.mol (via Jmol)
012603065.b3lyp_6-31g(d).inp

012603065.b3lyp_6-31g(d).qchem.inp (generated)

012603065.b3lyp_6-31g(d).gjf (generated)

012603065.b3lyp_6-31g(d).firefly.inp (generated)

012603065.b3lyp_6-31g(d).smash.inp (generated)

012603065.b3lyp_6-31g(d).nwchem.inp (generated) 012603065.b3lyp_6-31g(d).log.xz 012603065.td-b3lyp_6-31g+(d).inp 012603065.td-b3lyp_6-31g+(d).log.xz

012603065.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603065.td-b3lyp_6-31+g(d).gjf (generated)

012603065.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603065.mol 012603065.PUBCHEM 012603065.mol (via Jmol)
012603069.b3lyp_6-31g(d).inp

012603069.b3lyp_6-31g(d).qchem.inp (generated)

012603069.b3lyp_6-31g(d).gjf (generated)

012603069.b3lyp_6-31g(d).firefly.inp (generated)

012603069.b3lyp_6-31g(d).smash.inp (generated)

012603069.b3lyp_6-31g(d).nwchem.inp (generated) 012603069.b3lyp_6-31g(d).log.xz 012603069.td-b3lyp_6-31g+(d).inp 012603069.td-b3lyp_6-31g+(d).log.xz

012603069.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603069.td-b3lyp_6-31+g(d).gjf (generated)

012603069.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603069.mol 012603069.PUBCHEM 012603069.mol (via Jmol)
012603089.b3lyp_6-31g(d).inp

012603089.b3lyp_6-31g(d).qchem.inp (generated)

012603089.b3lyp_6-31g(d).gjf (generated)

012603089.b3lyp_6-31g(d).firefly.inp (generated)

012603089.b3lyp_6-31g(d).smash.inp (generated)

012603089.b3lyp_6-31g(d).nwchem.inp (generated) 012603089.b3lyp_6-31g(d).log.xz 012603089.td-b3lyp_6-31g+(d).inp 012603089.td-b3lyp_6-31g+(d).log.xz

012603089.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603089.td-b3lyp_6-31+g(d).gjf (generated)

012603089.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603089.mol 012603089.PUBCHEM 012603089.mol (via Jmol)
012603154.b3lyp_6-31g(d).inp

012603154.b3lyp_6-31g(d).qchem.inp (generated)

012603154.b3lyp_6-31g(d).gjf (generated)

012603154.b3lyp_6-31g(d).firefly.inp (generated)

012603154.b3lyp_6-31g(d).smash.inp (generated)

012603154.b3lyp_6-31g(d).nwchem.inp (generated) 012603154.b3lyp_6-31g(d).log.xz 012603154.td-b3lyp_6-31g+(d).inp 012603154.td-b3lyp_6-31g+(d).log.xz

012603154.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603154.td-b3lyp_6-31+g(d).gjf (generated)

012603154.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603154.mol 012603154.PUBCHEM 012603154.mol (via Jmol)
012603155.b3lyp_6-31g(d).inp

012603155.b3lyp_6-31g(d).qchem.inp (generated)

012603155.b3lyp_6-31g(d).gjf (generated)

012603155.b3lyp_6-31g(d).firefly.inp (generated)

012603155.b3lyp_6-31g(d).smash.inp (generated)

012603155.b3lyp_6-31g(d).nwchem.inp (generated) 012603155.b3lyp_6-31g(d).log.xz 012603155.td-b3lyp_6-31g+(d).inp 012603155.td-b3lyp_6-31g+(d).log.xz

012603155.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603155.td-b3lyp_6-31+g(d).gjf (generated)

012603155.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603155.mol 012603155.PUBCHEM 012603155.mol (via Jmol)
012603180.b3lyp_6-31g(d).inp

012603180.b3lyp_6-31g(d).qchem.inp (generated)

012603180.b3lyp_6-31g(d).gjf (generated)

012603180.b3lyp_6-31g(d).firefly.inp (generated)

012603180.b3lyp_6-31g(d).smash.inp (generated)

012603180.b3lyp_6-31g(d).nwchem.inp (generated) 012603180.b3lyp_6-31g(d).log.xz 012603180.td-b3lyp_6-31g+(d).inp 012603180.td-b3lyp_6-31g+(d).log.xz

012603180.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603180.td-b3lyp_6-31+g(d).gjf (generated)

012603180.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603180.mol 012603180.PUBCHEM 012603180.mol (via Jmol)
012603184.b3lyp_6-31g(d).inp

012603184.b3lyp_6-31g(d).qchem.inp (generated)

012603184.b3lyp_6-31g(d).gjf (generated)

012603184.b3lyp_6-31g(d).firefly.inp (generated)

012603184.b3lyp_6-31g(d).smash.inp (generated)

012603184.b3lyp_6-31g(d).nwchem.inp (generated) 012603184.b3lyp_6-31g(d).log.xz 012603184.td-b3lyp_6-31g+(d).inp 012603184.td-b3lyp_6-31g+(d).log.xz

012603184.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603184.td-b3lyp_6-31+g(d).gjf (generated)

012603184.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603184.mol 012603184.PUBCHEM 012603184.mol (via Jmol)
012603201.b3lyp_6-31g(d).inp

012603201.b3lyp_6-31g(d).qchem.inp (generated)

012603201.b3lyp_6-31g(d).gjf (generated)

012603201.b3lyp_6-31g(d).firefly.inp (generated)

012603201.b3lyp_6-31g(d).smash.inp (generated)

012603201.b3lyp_6-31g(d).nwchem.inp (generated) 012603201.b3lyp_6-31g(d).log.xz 012603201.td-b3lyp_6-31g+(d).inp 012603201.td-b3lyp_6-31g+(d).log.xz

012603201.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603201.td-b3lyp_6-31+g(d).gjf (generated)

012603201.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603201.mol 012603201.PUBCHEM 012603201.mol (via Jmol)
012603203.b3lyp_6-31g(d).inp

012603203.b3lyp_6-31g(d).qchem.inp (generated)

012603203.b3lyp_6-31g(d).gjf (generated)

012603203.b3lyp_6-31g(d).firefly.inp (generated)

012603203.b3lyp_6-31g(d).smash.inp (generated)

012603203.b3lyp_6-31g(d).nwchem.inp (generated) 012603203.b3lyp_6-31g(d).log.xz 012603203.td-b3lyp_6-31g+(d).inp 012603203.td-b3lyp_6-31g+(d).log.xz

012603203.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603203.td-b3lyp_6-31+g(d).gjf (generated)

012603203.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603203.mol 012603203.PUBCHEM 012603203.mol (via Jmol)
012603204.b3lyp_6-31g(d).inp

012603204.b3lyp_6-31g(d).qchem.inp (generated)

012603204.b3lyp_6-31g(d).gjf (generated)

012603204.b3lyp_6-31g(d).firefly.inp (generated)

012603204.b3lyp_6-31g(d).smash.inp (generated)

012603204.b3lyp_6-31g(d).nwchem.inp (generated) 012603204.b3lyp_6-31g(d).log.xz 012603204.td-b3lyp_6-31g+(d).inp 012603204.td-b3lyp_6-31g+(d).log.xz

012603204.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603204.td-b3lyp_6-31+g(d).gjf (generated)

012603204.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603204.mol 012603204.PUBCHEM 012603204.mol (via Jmol)
012603205.b3lyp_6-31g(d).inp

012603205.b3lyp_6-31g(d).qchem.inp (generated)

012603205.b3lyp_6-31g(d).gjf (generated)

012603205.b3lyp_6-31g(d).firefly.inp (generated)

012603205.b3lyp_6-31g(d).smash.inp (generated)

012603205.b3lyp_6-31g(d).nwchem.inp (generated) 012603205.b3lyp_6-31g(d).log.xz 012603205.td-b3lyp_6-31g+(d).inp 012603205.td-b3lyp_6-31g+(d).log.xz

012603205.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603205.td-b3lyp_6-31+g(d).gjf (generated)

012603205.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603205.mol 012603205.PUBCHEM 012603205.mol (via Jmol)
012603213.b3lyp_6-31g(d).inp

012603213.b3lyp_6-31g(d).qchem.inp (generated)

012603213.b3lyp_6-31g(d).gjf (generated)

012603213.b3lyp_6-31g(d).firefly.inp (generated)

012603213.b3lyp_6-31g(d).smash.inp (generated)

012603213.b3lyp_6-31g(d).nwchem.inp (generated) 012603213.b3lyp_6-31g(d).log.xz 012603213.td-b3lyp_6-31g+(d).inp 012603213.td-b3lyp_6-31g+(d).log.xz

012603213.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603213.td-b3lyp_6-31+g(d).gjf (generated)

012603213.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603213.mol 012603213.PUBCHEM 012603213.mol (via Jmol)
012603214.b3lyp_6-31g(d).inp

012603214.b3lyp_6-31g(d).qchem.inp (generated)

012603214.b3lyp_6-31g(d).gjf (generated)

012603214.b3lyp_6-31g(d).firefly.inp (generated)

012603214.b3lyp_6-31g(d).smash.inp (generated)

012603214.b3lyp_6-31g(d).nwchem.inp (generated) 012603214.b3lyp_6-31g(d).log.xz 012603214.td-b3lyp_6-31g+(d).inp 012603214.td-b3lyp_6-31g+(d).log.xz

012603214.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603214.td-b3lyp_6-31+g(d).gjf (generated)

012603214.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603214.mol 012603214.PUBCHEM 012603214.mol (via Jmol)
012603252.b3lyp_6-31g(d).inp

012603252.b3lyp_6-31g(d).qchem.inp (generated)

012603252.b3lyp_6-31g(d).gjf (generated)

012603252.b3lyp_6-31g(d).firefly.inp (generated)

012603252.b3lyp_6-31g(d).smash.inp (generated)

012603252.b3lyp_6-31g(d).nwchem.inp (generated) 012603252.b3lyp_6-31g(d).log.xz 012603252.td-b3lyp_6-31g+(d).inp 012603252.td-b3lyp_6-31g+(d).log.xz

012603252.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603252.td-b3lyp_6-31+g(d).gjf (generated)

012603252.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603252.mol 012603252.PUBCHEM 012603252.mol (via Jmol)
012603253.b3lyp_6-31g(d).inp

012603253.b3lyp_6-31g(d).qchem.inp (generated)

012603253.b3lyp_6-31g(d).gjf (generated)

012603253.b3lyp_6-31g(d).firefly.inp (generated)

012603253.b3lyp_6-31g(d).smash.inp (generated)

012603253.b3lyp_6-31g(d).nwchem.inp (generated) 012603253.b3lyp_6-31g(d).log.xz 012603253.td-b3lyp_6-31g+(d).inp 012603253.td-b3lyp_6-31g+(d).log.xz

012603253.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603253.td-b3lyp_6-31+g(d).gjf (generated)

012603253.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603253.mol 012603253.PUBCHEM 012603253.mol (via Jmol)
012603254.b3lyp_6-31g(d).inp

012603254.b3lyp_6-31g(d).qchem.inp (generated)

012603254.b3lyp_6-31g(d).gjf (generated)

012603254.b3lyp_6-31g(d).firefly.inp (generated)

012603254.b3lyp_6-31g(d).smash.inp (generated)

012603254.b3lyp_6-31g(d).nwchem.inp (generated) 012603254.b3lyp_6-31g(d).log.xz 012603254.td-b3lyp_6-31g+(d).inp 012603254.td-b3lyp_6-31g+(d).log.xz

012603254.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603254.td-b3lyp_6-31+g(d).gjf (generated)

012603254.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603254.mol 012603254.PUBCHEM 012603254.mol (via Jmol)
012603257.b3lyp_6-31g(d).inp

012603257.b3lyp_6-31g(d).qchem.inp (generated)

012603257.b3lyp_6-31g(d).gjf (generated)

012603257.b3lyp_6-31g(d).firefly.inp (generated)

012603257.b3lyp_6-31g(d).smash.inp (generated)

012603257.b3lyp_6-31g(d).nwchem.inp (generated) 012603257.b3lyp_6-31g(d).log.xz 012603257.mol 012603257.PUBCHEM 012603257.mol (via Jmol)
012603258.b3lyp_6-31g(d).inp

012603258.b3lyp_6-31g(d).qchem.inp (generated)

012603258.b3lyp_6-31g(d).gjf (generated)

012603258.b3lyp_6-31g(d).firefly.inp (generated)

012603258.b3lyp_6-31g(d).smash.inp (generated)

012603258.b3lyp_6-31g(d).nwchem.inp (generated) 012603258.b3lyp_6-31g(d).log.xz 012603258.td-b3lyp_6-31g+(d).inp 012603258.td-b3lyp_6-31g+(d).log.xz

012603258.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603258.td-b3lyp_6-31+g(d).gjf (generated)

012603258.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603258.mol 012603258.PUBCHEM 012603258.mol (via Jmol)
012603259.b3lyp_6-31g(d).inp

012603259.b3lyp_6-31g(d).qchem.inp (generated)

012603259.b3lyp_6-31g(d).gjf (generated)

012603259.b3lyp_6-31g(d).firefly.inp (generated)

012603259.b3lyp_6-31g(d).smash.inp (generated)

012603259.b3lyp_6-31g(d).nwchem.inp (generated) 012603259.b3lyp_6-31g(d).log.xz 012603259.td-b3lyp_6-31g+(d).inp 012603259.td-b3lyp_6-31g+(d).log.xz

012603259.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603259.td-b3lyp_6-31+g(d).gjf (generated)

012603259.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603259.mol 012603259.PUBCHEM 012603259.mol (via Jmol)
012603269.b3lyp_6-31g(d).inp

012603269.b3lyp_6-31g(d).qchem.inp (generated)

012603269.b3lyp_6-31g(d).gjf (generated)

012603269.b3lyp_6-31g(d).firefly.inp (generated)

012603269.b3lyp_6-31g(d).smash.inp (generated)

012603269.b3lyp_6-31g(d).nwchem.inp (generated) 012603269.b3lyp_6-31g(d).log.xz 012603269.td-b3lyp_6-31g+(d).inp 012603269.td-b3lyp_6-31g+(d).log.xz

012603269.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603269.td-b3lyp_6-31+g(d).gjf (generated)

012603269.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603269.mol 012603269.PUBCHEM 012603269.mol (via Jmol)
012603276.b3lyp_6-31g(d).inp

012603276.b3lyp_6-31g(d).qchem.inp (generated)

012603276.b3lyp_6-31g(d).gjf (generated)

012603276.b3lyp_6-31g(d).firefly.inp (generated)

012603276.b3lyp_6-31g(d).smash.inp (generated)

012603276.b3lyp_6-31g(d).nwchem.inp (generated) 012603276.b3lyp_6-31g(d).log.xz 012603276.td-b3lyp_6-31g+(d).inp 012603276.td-b3lyp_6-31g+(d).log.xz

012603276.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603276.td-b3lyp_6-31+g(d).gjf (generated)

012603276.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603276.mol 012603276.PUBCHEM 012603276.mol (via Jmol)
012603277.b3lyp_6-31g(d).inp

012603277.b3lyp_6-31g(d).qchem.inp (generated)

012603277.b3lyp_6-31g(d).gjf (generated)

012603277.b3lyp_6-31g(d).firefly.inp (generated)

012603277.b3lyp_6-31g(d).smash.inp (generated)

012603277.b3lyp_6-31g(d).nwchem.inp (generated) 012603277.b3lyp_6-31g(d).log.xz 012603277.td-b3lyp_6-31g+(d).inp 012603277.td-b3lyp_6-31g+(d).log.xz

012603277.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603277.td-b3lyp_6-31+g(d).gjf (generated)

012603277.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603277.mol 012603277.PUBCHEM 012603277.mol (via Jmol)
012603284.b3lyp_6-31g(d).inp

012603284.b3lyp_6-31g(d).qchem.inp (generated)

012603284.b3lyp_6-31g(d).gjf (generated)

012603284.b3lyp_6-31g(d).firefly.inp (generated)

012603284.b3lyp_6-31g(d).smash.inp (generated)

012603284.b3lyp_6-31g(d).nwchem.inp (generated) 012603284.b3lyp_6-31g(d).log.xz 012603284.td-b3lyp_6-31g+(d).inp 012603284.td-b3lyp_6-31g+(d).log.xz

012603284.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603284.td-b3lyp_6-31+g(d).gjf (generated)

012603284.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603284.mol 012603284.PUBCHEM 012603284.mol (via Jmol)
012603288.b3lyp_6-31g(d).inp

012603288.b3lyp_6-31g(d).qchem.inp (generated)

012603288.b3lyp_6-31g(d).gjf (generated)

012603288.b3lyp_6-31g(d).firefly.inp (generated)

012603288.b3lyp_6-31g(d).smash.inp (generated)

012603288.b3lyp_6-31g(d).nwchem.inp (generated) 012603288.b3lyp_6-31g(d).log.xz 012603288.td-b3lyp_6-31g+(d).inp 012603288.td-b3lyp_6-31g+(d).log.xz

012603288.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603288.td-b3lyp_6-31+g(d).gjf (generated)

012603288.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603288.mol 012603288.PUBCHEM 012603288.mol (via Jmol)
012603296.b3lyp_6-31g(d).inp

012603296.b3lyp_6-31g(d).qchem.inp (generated)

012603296.b3lyp_6-31g(d).gjf (generated)

012603296.b3lyp_6-31g(d).firefly.inp (generated)

012603296.b3lyp_6-31g(d).smash.inp (generated)

012603296.b3lyp_6-31g(d).nwchem.inp (generated) 012603296.b3lyp_6-31g(d).log.xz 012603296.td-b3lyp_6-31g+(d).inp 012603296.td-b3lyp_6-31g+(d).log.xz

012603296.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603296.td-b3lyp_6-31+g(d).gjf (generated)

012603296.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603296.mol 012603296.PUBCHEM 012603296.mol (via Jmol)
012603303.b3lyp_6-31g(d).inp

012603303.b3lyp_6-31g(d).qchem.inp (generated)

012603303.b3lyp_6-31g(d).gjf (generated)

012603303.b3lyp_6-31g(d).firefly.inp (generated)

012603303.b3lyp_6-31g(d).smash.inp (generated)

012603303.b3lyp_6-31g(d).nwchem.inp (generated) 012603303.b3lyp_6-31g(d).log.xz 012603303.td-b3lyp_6-31g+(d).inp 012603303.td-b3lyp_6-31g+(d).log.xz

012603303.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603303.td-b3lyp_6-31+g(d).gjf (generated)

012603303.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603303.mol 012603303.PUBCHEM 012603303.mol (via Jmol)
012603304.b3lyp_6-31g(d).inp

012603304.b3lyp_6-31g(d).qchem.inp (generated)

012603304.b3lyp_6-31g(d).gjf (generated)

012603304.b3lyp_6-31g(d).firefly.inp (generated)

012603304.b3lyp_6-31g(d).smash.inp (generated)

012603304.b3lyp_6-31g(d).nwchem.inp (generated) 012603304.b3lyp_6-31g(d).log.xz 012603304.td-b3lyp_6-31g+(d).inp 012603304.td-b3lyp_6-31g+(d).log.xz

012603304.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603304.td-b3lyp_6-31+g(d).gjf (generated)

012603304.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603304.mol 012603304.PUBCHEM 012603304.mol (via Jmol)
012603315.b3lyp_6-31g(d).inp

012603315.b3lyp_6-31g(d).qchem.inp (generated)

012603315.b3lyp_6-31g(d).gjf (generated)

012603315.b3lyp_6-31g(d).firefly.inp (generated)

012603315.b3lyp_6-31g(d).smash.inp (generated)

012603315.b3lyp_6-31g(d).nwchem.inp (generated) 012603315.b3lyp_6-31g(d).log.xz 012603315.td-b3lyp_6-31g+(d).inp 012603315.td-b3lyp_6-31g+(d).log.xz

012603315.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603315.td-b3lyp_6-31+g(d).gjf (generated)

012603315.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603315.mol 012603315.PUBCHEM 012603315.mol (via Jmol)
012603338.b3lyp_6-31g(d).inp

012603338.b3lyp_6-31g(d).qchem.inp (generated)

012603338.b3lyp_6-31g(d).gjf (generated)

012603338.b3lyp_6-31g(d).firefly.inp (generated)

012603338.b3lyp_6-31g(d).smash.inp (generated)

012603338.b3lyp_6-31g(d).nwchem.inp (generated) 012603338.b3lyp_6-31g(d).log.xz 012603338.td-b3lyp_6-31g+(d).inp 012603338.td-b3lyp_6-31g+(d).log.xz

012603338.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603338.td-b3lyp_6-31+g(d).gjf (generated)

012603338.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603338.mol 012603338.PUBCHEM 012603338.mol (via Jmol)
012603341.b3lyp_6-31g(d).inp

012603341.b3lyp_6-31g(d).qchem.inp (generated)

012603341.b3lyp_6-31g(d).gjf (generated)

012603341.b3lyp_6-31g(d).firefly.inp (generated)

012603341.b3lyp_6-31g(d).smash.inp (generated)

012603341.b3lyp_6-31g(d).nwchem.inp (generated) 012603341.b3lyp_6-31g(d).log.xz 012603341.td-b3lyp_6-31g+(d).inp 012603341.td-b3lyp_6-31g+(d).log.xz

012603341.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603341.td-b3lyp_6-31+g(d).gjf (generated)

012603341.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603341.mol 012603341.PUBCHEM 012603341.mol (via Jmol)
012603343.b3lyp_6-31g(d).inp

012603343.b3lyp_6-31g(d).qchem.inp (generated)

012603343.b3lyp_6-31g(d).gjf (generated)

012603343.b3lyp_6-31g(d).firefly.inp (generated)

012603343.b3lyp_6-31g(d).smash.inp (generated)

012603343.b3lyp_6-31g(d).nwchem.inp (generated) 012603343.b3lyp_6-31g(d).log.xz 012603343.td-b3lyp_6-31g+(d).inp 012603343.td-b3lyp_6-31g+(d).log.xz

012603343.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603343.td-b3lyp_6-31+g(d).gjf (generated)

012603343.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603343.mol 012603343.PUBCHEM 012603343.mol (via Jmol)
012603359.b3lyp_6-31g(d).inp

012603359.b3lyp_6-31g(d).qchem.inp (generated)

012603359.b3lyp_6-31g(d).gjf (generated)

012603359.b3lyp_6-31g(d).firefly.inp (generated)

012603359.b3lyp_6-31g(d).smash.inp (generated)

012603359.b3lyp_6-31g(d).nwchem.inp (generated) 012603359.b3lyp_6-31g(d).log.xz 012603359.mol 012603359.PUBCHEM 012603359.mol (via Jmol)
012603368.b3lyp_6-31g(d).inp

012603368.b3lyp_6-31g(d).qchem.inp (generated)

012603368.b3lyp_6-31g(d).gjf (generated)

012603368.b3lyp_6-31g(d).firefly.inp (generated)

012603368.b3lyp_6-31g(d).smash.inp (generated)

012603368.b3lyp_6-31g(d).nwchem.inp (generated) 012603368.b3lyp_6-31g(d).log.xz 012603368.td-b3lyp_6-31g+(d).inp 012603368.td-b3lyp_6-31g+(d).log.xz

012603368.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603368.td-b3lyp_6-31+g(d).gjf (generated)

012603368.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603368.mol 012603368.PUBCHEM 012603368.mol (via Jmol)
012603377.b3lyp_6-31g(d).inp

012603377.b3lyp_6-31g(d).qchem.inp (generated)

012603377.b3lyp_6-31g(d).gjf (generated)

012603377.b3lyp_6-31g(d).firefly.inp (generated)

012603377.b3lyp_6-31g(d).smash.inp (generated)

012603377.b3lyp_6-31g(d).nwchem.inp (generated) 012603377.b3lyp_6-31g(d).log.xz 012603377.td-b3lyp_6-31g+(d).inp 012603377.td-b3lyp_6-31g+(d).log.xz

012603377.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603377.td-b3lyp_6-31+g(d).gjf (generated)

012603377.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603377.mol 012603377.PUBCHEM 012603377.mol (via Jmol)
012603388.b3lyp_6-31g(d).inp

012603388.b3lyp_6-31g(d).qchem.inp (generated)

012603388.b3lyp_6-31g(d).gjf (generated)

012603388.b3lyp_6-31g(d).firefly.inp (generated)

012603388.b3lyp_6-31g(d).smash.inp (generated)

012603388.b3lyp_6-31g(d).nwchem.inp (generated) 012603388.b3lyp_6-31g(d).log.xz 012603388.td-b3lyp_6-31g+(d).inp 012603388.td-b3lyp_6-31g+(d).log.xz

012603388.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603388.td-b3lyp_6-31+g(d).gjf (generated)

012603388.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603388.mol 012603388.PUBCHEM 012603388.mol (via Jmol)
012603392.b3lyp_6-31g(d).inp

012603392.b3lyp_6-31g(d).qchem.inp (generated)

012603392.b3lyp_6-31g(d).gjf (generated)

012603392.b3lyp_6-31g(d).firefly.inp (generated)

012603392.b3lyp_6-31g(d).smash.inp (generated)

012603392.b3lyp_6-31g(d).nwchem.inp (generated) 012603392.b3lyp_6-31g(d).log.xz 012603392.td-b3lyp_6-31g+(d).inp 012603392.td-b3lyp_6-31g+(d).log.xz

012603392.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603392.td-b3lyp_6-31+g(d).gjf (generated)

012603392.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603392.mol 012603392.PUBCHEM 012603392.mol (via Jmol)
012603404.b3lyp_6-31g(d).inp

012603404.b3lyp_6-31g(d).qchem.inp (generated)

012603404.b3lyp_6-31g(d).gjf (generated)

012603404.b3lyp_6-31g(d).firefly.inp (generated)

012603404.b3lyp_6-31g(d).smash.inp (generated)

012603404.b3lyp_6-31g(d).nwchem.inp (generated) 012603404.b3lyp_6-31g(d).log.xz 012603404.td-b3lyp_6-31g+(d).inp 012603404.td-b3lyp_6-31g+(d).log.xz

012603404.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603404.td-b3lyp_6-31+g(d).gjf (generated)

012603404.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603404.mol 012603404.PUBCHEM 012603404.mol (via Jmol)
012603407.b3lyp_6-31g(d).inp

012603407.b3lyp_6-31g(d).qchem.inp (generated)

012603407.b3lyp_6-31g(d).gjf (generated)

012603407.b3lyp_6-31g(d).firefly.inp (generated)

012603407.b3lyp_6-31g(d).smash.inp (generated)

012603407.b3lyp_6-31g(d).nwchem.inp (generated) 012603407.b3lyp_6-31g(d).log.xz 012603407.td-b3lyp_6-31g+(d).inp 012603407.td-b3lyp_6-31g+(d).log.xz

012603407.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603407.td-b3lyp_6-31+g(d).gjf (generated)

012603407.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603407.mol 012603407.PUBCHEM 012603407.mol (via Jmol)
012603408.b3lyp_6-31g(d).inp

012603408.b3lyp_6-31g(d).qchem.inp (generated)

012603408.b3lyp_6-31g(d).gjf (generated)

012603408.b3lyp_6-31g(d).firefly.inp (generated)

012603408.b3lyp_6-31g(d).smash.inp (generated)

012603408.b3lyp_6-31g(d).nwchem.inp (generated) 012603408.b3lyp_6-31g(d).log.xz 012603408.td-b3lyp_6-31g+(d).inp 012603408.td-b3lyp_6-31g+(d).log.xz

012603408.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603408.td-b3lyp_6-31+g(d).gjf (generated)

012603408.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603408.mol 012603408.PUBCHEM 012603408.mol (via Jmol)
012603439.b3lyp_6-31g(d).inp

012603439.b3lyp_6-31g(d).qchem.inp (generated)

012603439.b3lyp_6-31g(d).gjf (generated)

012603439.b3lyp_6-31g(d).firefly.inp (generated)

012603439.b3lyp_6-31g(d).smash.inp (generated)

012603439.b3lyp_6-31g(d).nwchem.inp (generated) 012603439.b3lyp_6-31g(d).log.xz 012603439.td-b3lyp_6-31g+(d).inp 012603439.td-b3lyp_6-31g+(d).log.xz

012603439.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603439.td-b3lyp_6-31+g(d).gjf (generated)

012603439.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603439.mol 012603439.PUBCHEM 012603439.mol (via Jmol)
012603442.b3lyp_6-31g(d).inp

012603442.b3lyp_6-31g(d).qchem.inp (generated)

012603442.b3lyp_6-31g(d).gjf (generated)

012603442.b3lyp_6-31g(d).firefly.inp (generated)

012603442.b3lyp_6-31g(d).smash.inp (generated)

012603442.b3lyp_6-31g(d).nwchem.inp (generated) 012603442.b3lyp_6-31g(d).log.xz 012603442.td-b3lyp_6-31g+(d).inp 012603442.td-b3lyp_6-31g+(d).log.xz

012603442.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603442.td-b3lyp_6-31+g(d).gjf (generated)

012603442.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603442.mol 012603442.PUBCHEM 012603442.mol (via Jmol)
012603446.b3lyp_6-31g(d).inp

012603446.b3lyp_6-31g(d).qchem.inp (generated)

012603446.b3lyp_6-31g(d).gjf (generated)

012603446.b3lyp_6-31g(d).firefly.inp (generated)

012603446.b3lyp_6-31g(d).smash.inp (generated)

012603446.b3lyp_6-31g(d).nwchem.inp (generated) 012603446.b3lyp_6-31g(d).log.xz 012603446.td-b3lyp_6-31g+(d).inp 012603446.td-b3lyp_6-31g+(d).log.xz

012603446.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603446.td-b3lyp_6-31+g(d).gjf (generated)

012603446.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603446.mol 012603446.PUBCHEM 012603446.mol (via Jmol)
012603461.b3lyp_6-31g(d).inp

012603461.b3lyp_6-31g(d).qchem.inp (generated)

012603461.b3lyp_6-31g(d).gjf (generated)

012603461.b3lyp_6-31g(d).firefly.inp (generated)

012603461.b3lyp_6-31g(d).smash.inp (generated)

012603461.b3lyp_6-31g(d).nwchem.inp (generated) 012603461.b3lyp_6-31g(d).log.xz 012603461.td-b3lyp_6-31g+(d).inp 012603461.td-b3lyp_6-31g+(d).log.xz

012603461.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603461.td-b3lyp_6-31+g(d).gjf (generated)

012603461.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603461.mol 012603461.PUBCHEM 012603461.mol (via Jmol)
012603462.b3lyp_6-31g(d).inp

012603462.b3lyp_6-31g(d).qchem.inp (generated)

012603462.b3lyp_6-31g(d).gjf (generated)

012603462.b3lyp_6-31g(d).firefly.inp (generated)

012603462.b3lyp_6-31g(d).smash.inp (generated)

012603462.b3lyp_6-31g(d).nwchem.inp (generated) 012603462.b3lyp_6-31g(d).log.xz 012603462.td-b3lyp_6-31g+(d).inp 012603462.td-b3lyp_6-31g+(d).log.xz

012603462.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603462.td-b3lyp_6-31+g(d).gjf (generated)

012603462.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603462.mol 012603462.PUBCHEM 012603462.mol (via Jmol)
012603463.b3lyp_6-31g(d).inp

012603463.b3lyp_6-31g(d).qchem.inp (generated)

012603463.b3lyp_6-31g(d).gjf (generated)

012603463.b3lyp_6-31g(d).firefly.inp (generated)

012603463.b3lyp_6-31g(d).smash.inp (generated)

012603463.b3lyp_6-31g(d).nwchem.inp (generated) 012603463.b3lyp_6-31g(d).log.xz 012603463.td-b3lyp_6-31g+(d).inp 012603463.td-b3lyp_6-31g+(d).log.xz

012603463.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603463.td-b3lyp_6-31+g(d).gjf (generated)

012603463.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603463.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603463.mol 012603463.PUBCHEM 012603463.mol (via Jmol)
012603464.b3lyp_6-31g(d).inp

012603464.b3lyp_6-31g(d).qchem.inp (generated)

012603464.b3lyp_6-31g(d).gjf (generated)

012603464.b3lyp_6-31g(d).firefly.inp (generated)

012603464.b3lyp_6-31g(d).smash.inp (generated)

012603464.b3lyp_6-31g(d).nwchem.inp (generated) 012603464.b3lyp_6-31g(d).log.xz 012603464.td-b3lyp_6-31g+(d).inp 012603464.td-b3lyp_6-31g+(d).log.xz

012603464.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603464.td-b3lyp_6-31+g(d).gjf (generated)

012603464.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603464.mol 012603464.PUBCHEM 012603464.mol (via Jmol)
012603465.b3lyp_6-31g(d).inp

012603465.b3lyp_6-31g(d).qchem.inp (generated)

012603465.b3lyp_6-31g(d).gjf (generated)

012603465.b3lyp_6-31g(d).firefly.inp (generated)

012603465.b3lyp_6-31g(d).smash.inp (generated)

012603465.b3lyp_6-31g(d).nwchem.inp (generated) 012603465.b3lyp_6-31g(d).log.xz 012603465.td-b3lyp_6-31g+(d).inp 012603465.td-b3lyp_6-31g+(d).log.xz

012603465.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603465.td-b3lyp_6-31+g(d).gjf (generated)

012603465.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603465.mol 012603465.PUBCHEM 012603465.mol (via Jmol)
012603471.b3lyp_6-31g(d).inp

012603471.b3lyp_6-31g(d).qchem.inp (generated)

012603471.b3lyp_6-31g(d).gjf (generated)

012603471.b3lyp_6-31g(d).firefly.inp (generated)

012603471.b3lyp_6-31g(d).smash.inp (generated)

012603471.b3lyp_6-31g(d).nwchem.inp (generated) 012603471.b3lyp_6-31g(d).log.xz 012603471.td-b3lyp_6-31g+(d).inp 012603471.td-b3lyp_6-31g+(d).log.xz

012603471.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603471.td-b3lyp_6-31+g(d).gjf (generated)

012603471.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603471.mol 012603471.PUBCHEM 012603471.mol (via Jmol)
012603472.b3lyp_6-31g(d).inp

012603472.b3lyp_6-31g(d).qchem.inp (generated)

012603472.b3lyp_6-31g(d).gjf (generated)

012603472.b3lyp_6-31g(d).firefly.inp (generated)

012603472.b3lyp_6-31g(d).smash.inp (generated)

012603472.b3lyp_6-31g(d).nwchem.inp (generated) 012603472.b3lyp_6-31g(d).log.xz 012603472.td-b3lyp_6-31g+(d).inp 012603472.td-b3lyp_6-31g+(d).log.xz

012603472.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603472.td-b3lyp_6-31+g(d).gjf (generated)

012603472.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603472.mol 012603472.PUBCHEM 012603472.mol (via Jmol)
012603475.b3lyp_6-31g(d).inp

012603475.b3lyp_6-31g(d).qchem.inp (generated)

012603475.b3lyp_6-31g(d).gjf (generated)

012603475.b3lyp_6-31g(d).firefly.inp (generated)

012603475.b3lyp_6-31g(d).smash.inp (generated)

012603475.b3lyp_6-31g(d).nwchem.inp (generated) 012603475.b3lyp_6-31g(d).log.xz 012603475.td-b3lyp_6-31g+(d).inp 012603475.td-b3lyp_6-31g+(d).log.xz

012603475.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603475.td-b3lyp_6-31+g(d).gjf (generated)

012603475.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603475.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603475.mol 012603475.PUBCHEM 012603475.mol (via Jmol)
012603478.b3lyp_6-31g(d).inp

012603478.b3lyp_6-31g(d).qchem.inp (generated)

012603478.b3lyp_6-31g(d).gjf (generated)

012603478.b3lyp_6-31g(d).firefly.inp (generated)

012603478.b3lyp_6-31g(d).smash.inp (generated)

012603478.b3lyp_6-31g(d).nwchem.inp (generated) 012603478.b3lyp_6-31g(d).log.xz 012603478.td-b3lyp_6-31g+(d).inp 012603478.td-b3lyp_6-31g+(d).log.xz

012603478.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603478.td-b3lyp_6-31+g(d).gjf (generated)

012603478.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603478.mol 012603478.PUBCHEM 012603478.mol (via Jmol)
012603479.b3lyp_6-31g(d).inp

012603479.b3lyp_6-31g(d).qchem.inp (generated)

012603479.b3lyp_6-31g(d).gjf (generated)

012603479.b3lyp_6-31g(d).firefly.inp (generated)

012603479.b3lyp_6-31g(d).smash.inp (generated)

012603479.b3lyp_6-31g(d).nwchem.inp (generated) 012603479.b3lyp_6-31g(d).log.xz 012603479.td-b3lyp_6-31g+(d).inp 012603479.td-b3lyp_6-31g+(d).log.xz

012603479.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603479.td-b3lyp_6-31+g(d).gjf (generated)

012603479.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603479.mol 012603479.PUBCHEM 012603479.mol (via Jmol)
012603480.b3lyp_6-31g(d).inp

012603480.b3lyp_6-31g(d).qchem.inp (generated)

012603480.b3lyp_6-31g(d).gjf (generated)

012603480.b3lyp_6-31g(d).firefly.inp (generated)

012603480.b3lyp_6-31g(d).smash.inp (generated)

012603480.b3lyp_6-31g(d).nwchem.inp (generated) 012603480.b3lyp_6-31g(d).log.xz 012603480.td-b3lyp_6-31g+(d).inp 012603480.td-b3lyp_6-31g+(d).log.xz

012603480.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603480.td-b3lyp_6-31+g(d).gjf (generated)

012603480.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603480.mol 012603480.PUBCHEM 012603480.mol (via Jmol)
012603482.b3lyp_6-31g(d).inp

012603482.b3lyp_6-31g(d).qchem.inp (generated)

012603482.b3lyp_6-31g(d).gjf (generated)

012603482.b3lyp_6-31g(d).firefly.inp (generated)

012603482.b3lyp_6-31g(d).smash.inp (generated)

012603482.b3lyp_6-31g(d).nwchem.inp (generated) 012603482.b3lyp_6-31g(d).log.xz 012603482.td-b3lyp_6-31g+(d).inp 012603482.td-b3lyp_6-31g+(d).log.xz

012603482.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603482.td-b3lyp_6-31+g(d).gjf (generated)

012603482.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603482.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603482.mol 012603482.PUBCHEM 012603482.mol (via Jmol)
012603487.b3lyp_6-31g(d).inp

012603487.b3lyp_6-31g(d).qchem.inp (generated)

012603487.b3lyp_6-31g(d).gjf (generated)

012603487.b3lyp_6-31g(d).firefly.inp (generated)

012603487.b3lyp_6-31g(d).smash.inp (generated)

012603487.b3lyp_6-31g(d).nwchem.inp (generated) 012603487.b3lyp_6-31g(d).log.xz 012603487.td-b3lyp_6-31g+(d).inp 012603487.td-b3lyp_6-31g+(d).log.xz

012603487.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603487.td-b3lyp_6-31+g(d).gjf (generated)

012603487.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603487.mol 012603487.PUBCHEM 012603487.mol (via Jmol)
012603491.b3lyp_6-31g(d).inp

012603491.b3lyp_6-31g(d).qchem.inp (generated)

012603491.b3lyp_6-31g(d).gjf (generated)

012603491.b3lyp_6-31g(d).firefly.inp (generated)

012603491.b3lyp_6-31g(d).smash.inp (generated)

012603491.b3lyp_6-31g(d).nwchem.inp (generated) 012603491.b3lyp_6-31g(d).log.xz 012603491.td-b3lyp_6-31g+(d).inp 012603491.td-b3lyp_6-31g+(d).log.xz

012603491.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603491.td-b3lyp_6-31+g(d).gjf (generated)

012603491.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603491.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603491.mol 012603491.PUBCHEM 012603491.mol (via Jmol)
012603538.b3lyp_6-31g(d).inp

012603538.b3lyp_6-31g(d).qchem.inp (generated)

012603538.b3lyp_6-31g(d).gjf (generated)

012603538.b3lyp_6-31g(d).firefly.inp (generated)

012603538.b3lyp_6-31g(d).smash.inp (generated)

012603538.b3lyp_6-31g(d).nwchem.inp (generated) 012603538.b3lyp_6-31g(d).log.xz 012603538.td-b3lyp_6-31g+(d).inp 012603538.td-b3lyp_6-31g+(d).log.xz

012603538.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603538.td-b3lyp_6-31+g(d).gjf (generated)

012603538.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603538.mol 012603538.PUBCHEM 012603538.mol (via Jmol)
012603539.b3lyp_6-31g(d).inp

012603539.b3lyp_6-31g(d).qchem.inp (generated)

012603539.b3lyp_6-31g(d).gjf (generated)

012603539.b3lyp_6-31g(d).firefly.inp (generated)

012603539.b3lyp_6-31g(d).smash.inp (generated)

012603539.b3lyp_6-31g(d).nwchem.inp (generated) 012603539.b3lyp_6-31g(d).log.xz 012603539.td-b3lyp_6-31g+(d).inp 012603539.td-b3lyp_6-31g+(d).log.xz

012603539.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603539.td-b3lyp_6-31+g(d).gjf (generated)

012603539.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603539.mol 012603539.PUBCHEM 012603539.mol (via Jmol)
012603546.b3lyp_6-31g(d).inp

012603546.b3lyp_6-31g(d).qchem.inp (generated)

012603546.b3lyp_6-31g(d).gjf (generated)

012603546.b3lyp_6-31g(d).firefly.inp (generated)

012603546.b3lyp_6-31g(d).smash.inp (generated)

012603546.b3lyp_6-31g(d).nwchem.inp (generated) 012603546.b3lyp_6-31g(d).log.xz 012603546.td-b3lyp_6-31g+(d).inp 012603546.td-b3lyp_6-31g+(d).log.xz

012603546.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603546.td-b3lyp_6-31+g(d).gjf (generated)

012603546.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603546.mol 012603546.PUBCHEM 012603546.mol (via Jmol)
012603548.b3lyp_6-31g(d).inp

012603548.b3lyp_6-31g(d).qchem.inp (generated)

012603548.b3lyp_6-31g(d).gjf (generated)

012603548.b3lyp_6-31g(d).firefly.inp (generated)

012603548.b3lyp_6-31g(d).smash.inp (generated)

012603548.b3lyp_6-31g(d).nwchem.inp (generated) 012603548.b3lyp_6-31g(d).log.xz 012603548.td-b3lyp_6-31g+(d).inp 012603548.td-b3lyp_6-31g+(d).log.xz

012603548.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603548.td-b3lyp_6-31+g(d).gjf (generated)

012603548.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603548.mol 012603548.PUBCHEM 012603548.mol (via Jmol)
012603552.b3lyp_6-31g(d).inp

012603552.b3lyp_6-31g(d).qchem.inp (generated)

012603552.b3lyp_6-31g(d).gjf (generated)

012603552.b3lyp_6-31g(d).firefly.inp (generated)

012603552.b3lyp_6-31g(d).smash.inp (generated)

012603552.b3lyp_6-31g(d).nwchem.inp (generated) 012603552.b3lyp_6-31g(d).log.xz 012603552.mol 012603552.PUBCHEM 012603552.mol (via Jmol)
012603566.b3lyp_6-31g(d).inp

012603566.b3lyp_6-31g(d).qchem.inp (generated)

012603566.b3lyp_6-31g(d).gjf (generated)

012603566.b3lyp_6-31g(d).firefly.inp (generated)

012603566.b3lyp_6-31g(d).smash.inp (generated)

012603566.b3lyp_6-31g(d).nwchem.inp (generated) 012603566.b3lyp_6-31g(d).log.xz 012603566.td-b3lyp_6-31g+(d).inp 012603566.td-b3lyp_6-31g+(d).log.xz

012603566.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603566.td-b3lyp_6-31+g(d).gjf (generated)

012603566.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603566.mol 012603566.PUBCHEM 012603566.mol (via Jmol)
012603567.b3lyp_6-31g(d).inp

012603567.b3lyp_6-31g(d).qchem.inp (generated)

012603567.b3lyp_6-31g(d).gjf (generated)

012603567.b3lyp_6-31g(d).firefly.inp (generated)

012603567.b3lyp_6-31g(d).smash.inp (generated)

012603567.b3lyp_6-31g(d).nwchem.inp (generated) 012603567.b3lyp_6-31g(d).log.xz 012603567.mol 012603567.PUBCHEM 012603567.mol (via Jmol)
012603568.b3lyp_6-31g(d).inp

012603568.b3lyp_6-31g(d).qchem.inp (generated)

012603568.b3lyp_6-31g(d).gjf (generated)

012603568.b3lyp_6-31g(d).firefly.inp (generated)

012603568.b3lyp_6-31g(d).smash.inp (generated)

012603568.b3lyp_6-31g(d).nwchem.inp (generated) 012603568.b3lyp_6-31g(d).log.xz 012603568.td-b3lyp_6-31g+(d).inp 012603568.td-b3lyp_6-31g+(d).log.xz

012603568.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603568.td-b3lyp_6-31+g(d).gjf (generated)

012603568.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603568.mol 012603568.PUBCHEM 012603568.mol (via Jmol)
012603569.b3lyp_6-31g(d).inp

012603569.b3lyp_6-31g(d).qchem.inp (generated)

012603569.b3lyp_6-31g(d).gjf (generated)

012603569.b3lyp_6-31g(d).firefly.inp (generated)

012603569.b3lyp_6-31g(d).smash.inp (generated)

012603569.b3lyp_6-31g(d).nwchem.inp (generated) 012603569.b3lyp_6-31g(d).log.xz 012603569.td-b3lyp_6-31g+(d).inp 012603569.td-b3lyp_6-31g+(d).log.xz

012603569.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603569.td-b3lyp_6-31+g(d).gjf (generated)

012603569.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603569.mol 012603569.PUBCHEM 012603569.mol (via Jmol)
012603571.b3lyp_6-31g(d).inp

012603571.b3lyp_6-31g(d).qchem.inp (generated)

012603571.b3lyp_6-31g(d).gjf (generated)

012603571.b3lyp_6-31g(d).firefly.inp (generated)

012603571.b3lyp_6-31g(d).smash.inp (generated)

012603571.b3lyp_6-31g(d).nwchem.inp (generated) 012603571.b3lyp_6-31g(d).log.xz 012603571.td-b3lyp_6-31g+(d).inp 012603571.td-b3lyp_6-31g+(d).log.xz

012603571.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603571.td-b3lyp_6-31+g(d).gjf (generated)

012603571.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603571.mol 012603571.PUBCHEM 012603571.mol (via Jmol)
012603573.b3lyp_6-31g(d).inp

012603573.b3lyp_6-31g(d).qchem.inp (generated)

012603573.b3lyp_6-31g(d).gjf (generated)

012603573.b3lyp_6-31g(d).firefly.inp (generated)

012603573.b3lyp_6-31g(d).smash.inp (generated)

012603573.b3lyp_6-31g(d).nwchem.inp (generated) 012603573.b3lyp_6-31g(d).log.xz 012603573.mol 012603573.PUBCHEM 012603573.mol (via Jmol)
012603575.b3lyp_6-31g(d).inp

012603575.b3lyp_6-31g(d).qchem.inp (generated)

012603575.b3lyp_6-31g(d).gjf (generated)

012603575.b3lyp_6-31g(d).firefly.inp (generated)

012603575.b3lyp_6-31g(d).smash.inp (generated)

012603575.b3lyp_6-31g(d).nwchem.inp (generated) 012603575.b3lyp_6-31g(d).log.xz 012603575.td-b3lyp_6-31g+(d).inp 012603575.td-b3lyp_6-31g+(d).log.xz

012603575.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603575.td-b3lyp_6-31+g(d).gjf (generated)

012603575.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603575.mol 012603575.PUBCHEM 012603575.mol (via Jmol)
012603576.b3lyp_6-31g(d).inp

012603576.b3lyp_6-31g(d).qchem.inp (generated)

012603576.b3lyp_6-31g(d).gjf (generated)

012603576.b3lyp_6-31g(d).firefly.inp (generated)

012603576.b3lyp_6-31g(d).smash.inp (generated)

012603576.b3lyp_6-31g(d).nwchem.inp (generated) 012603576.b3lyp_6-31g(d).log.xz 012603576.td-b3lyp_6-31g+(d).inp 012603576.td-b3lyp_6-31g+(d).log.xz

012603576.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603576.td-b3lyp_6-31+g(d).gjf (generated)

012603576.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603576.mol 012603576.PUBCHEM 012603576.mol (via Jmol)
012603588.b3lyp_6-31g(d).inp

012603588.b3lyp_6-31g(d).qchem.inp (generated)

012603588.b3lyp_6-31g(d).gjf (generated)

012603588.b3lyp_6-31g(d).firefly.inp (generated)

012603588.b3lyp_6-31g(d).smash.inp (generated)

012603588.b3lyp_6-31g(d).nwchem.inp (generated) 012603588.b3lyp_6-31g(d).log.xz 012603588.td-b3lyp_6-31g+(d).inp 012603588.td-b3lyp_6-31g+(d).log.xz

012603588.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603588.td-b3lyp_6-31+g(d).gjf (generated)

012603588.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603588.mol 012603588.PUBCHEM 012603588.mol (via Jmol)
012603589.b3lyp_6-31g(d).inp

012603589.b3lyp_6-31g(d).qchem.inp (generated)

012603589.b3lyp_6-31g(d).gjf (generated)

012603589.b3lyp_6-31g(d).firefly.inp (generated)

012603589.b3lyp_6-31g(d).smash.inp (generated)

012603589.b3lyp_6-31g(d).nwchem.inp (generated) 012603589.b3lyp_6-31g(d).log.xz 012603589.td-b3lyp_6-31g+(d).inp 012603589.td-b3lyp_6-31g+(d).log.xz

012603589.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603589.td-b3lyp_6-31+g(d).gjf (generated)

012603589.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603589.mol 012603589.PUBCHEM 012603589.mol (via Jmol)
012603591.b3lyp_6-31g(d).inp

012603591.b3lyp_6-31g(d).qchem.inp (generated)

012603591.b3lyp_6-31g(d).gjf (generated)

012603591.b3lyp_6-31g(d).firefly.inp (generated)

012603591.b3lyp_6-31g(d).smash.inp (generated)

012603591.b3lyp_6-31g(d).nwchem.inp (generated) 012603591.b3lyp_6-31g(d).log.xz 012603591.td-b3lyp_6-31g+(d).inp 012603591.td-b3lyp_6-31g+(d).log.xz

012603591.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603591.td-b3lyp_6-31+g(d).gjf (generated)

012603591.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603591.mol 012603591.PUBCHEM 012603591.mol (via Jmol)
012603593.b3lyp_6-31g(d).inp

012603593.b3lyp_6-31g(d).qchem.inp (generated)

012603593.b3lyp_6-31g(d).gjf (generated)

012603593.b3lyp_6-31g(d).firefly.inp (generated)

012603593.b3lyp_6-31g(d).smash.inp (generated)

012603593.b3lyp_6-31g(d).nwchem.inp (generated) 012603593.b3lyp_6-31g(d).log.xz 012603593.td-b3lyp_6-31g+(d).inp 012603593.td-b3lyp_6-31g+(d).log.xz

012603593.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603593.td-b3lyp_6-31+g(d).gjf (generated)

012603593.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603593.mol 012603593.PUBCHEM 012603593.mol (via Jmol)
012603636.b3lyp_6-31g(d).inp

012603636.b3lyp_6-31g(d).qchem.inp (generated)

012603636.b3lyp_6-31g(d).gjf (generated)

012603636.b3lyp_6-31g(d).firefly.inp (generated)

012603636.b3lyp_6-31g(d).smash.inp (generated)

012603636.b3lyp_6-31g(d).nwchem.inp (generated) 012603636.b3lyp_6-31g(d).log.xz 012603636.td-b3lyp_6-31g+(d).inp 012603636.td-b3lyp_6-31g+(d).log.xz

012603636.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603636.td-b3lyp_6-31+g(d).gjf (generated)

012603636.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603636.mol 012603636.PUBCHEM 012603636.mol (via Jmol)
012603637.b3lyp_6-31g(d).inp

012603637.b3lyp_6-31g(d).qchem.inp (generated)

012603637.b3lyp_6-31g(d).gjf (generated)

012603637.b3lyp_6-31g(d).firefly.inp (generated)

012603637.b3lyp_6-31g(d).smash.inp (generated)

012603637.b3lyp_6-31g(d).nwchem.inp (generated) 012603637.b3lyp_6-31g(d).log.xz 012603637.td-b3lyp_6-31g+(d).inp 012603637.td-b3lyp_6-31g+(d).log.xz

012603637.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603637.td-b3lyp_6-31+g(d).gjf (generated)

012603637.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603637.mol 012603637.PUBCHEM 012603637.mol (via Jmol)
012603649.b3lyp_6-31g(d).inp

012603649.b3lyp_6-31g(d).qchem.inp (generated)

012603649.b3lyp_6-31g(d).gjf (generated)

012603649.b3lyp_6-31g(d).firefly.inp (generated)

012603649.b3lyp_6-31g(d).smash.inp (generated)

012603649.b3lyp_6-31g(d).nwchem.inp (generated) 012603649.b3lyp_6-31g(d).log.xz 012603649.td-b3lyp_6-31g+(d).inp 012603649.td-b3lyp_6-31g+(d).log.xz

012603649.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603649.td-b3lyp_6-31+g(d).gjf (generated)

012603649.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603649.mol 012603649.PUBCHEM 012603649.mol (via Jmol)
012603653.b3lyp_6-31g(d).inp

012603653.b3lyp_6-31g(d).qchem.inp (generated)

012603653.b3lyp_6-31g(d).gjf (generated)

012603653.b3lyp_6-31g(d).firefly.inp (generated)

012603653.b3lyp_6-31g(d).smash.inp (generated)

012603653.b3lyp_6-31g(d).nwchem.inp (generated) 012603653.b3lyp_6-31g(d).log.xz 012603653.td-b3lyp_6-31g+(d).inp 012603653.td-b3lyp_6-31g+(d).log.xz

012603653.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603653.td-b3lyp_6-31+g(d).gjf (generated)

012603653.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603653.mol 012603653.PUBCHEM 012603653.mol (via Jmol)
012603655.b3lyp_6-31g(d).inp

012603655.b3lyp_6-31g(d).qchem.inp (generated)

012603655.b3lyp_6-31g(d).gjf (generated)

012603655.b3lyp_6-31g(d).firefly.inp (generated)

012603655.b3lyp_6-31g(d).smash.inp (generated)

012603655.b3lyp_6-31g(d).nwchem.inp (generated) 012603655.b3lyp_6-31g(d).log.xz 012603655.td-b3lyp_6-31g+(d).inp 012603655.td-b3lyp_6-31g+(d).log.xz

012603655.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603655.td-b3lyp_6-31+g(d).gjf (generated)

012603655.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603655.mol 012603655.PUBCHEM 012603655.mol (via Jmol)
012603657.b3lyp_6-31g(d).inp

012603657.b3lyp_6-31g(d).qchem.inp (generated)

012603657.b3lyp_6-31g(d).gjf (generated)

012603657.b3lyp_6-31g(d).firefly.inp (generated)

012603657.b3lyp_6-31g(d).smash.inp (generated)

012603657.b3lyp_6-31g(d).nwchem.inp (generated) 012603657.b3lyp_6-31g(d).log.xz 012603657.td-b3lyp_6-31g+(d).inp 012603657.td-b3lyp_6-31g+(d).log.xz

012603657.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603657.td-b3lyp_6-31+g(d).gjf (generated)

012603657.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603657.mol 012603657.PUBCHEM 012603657.mol (via Jmol)
012603659.b3lyp_6-31g(d).inp

012603659.b3lyp_6-31g(d).qchem.inp (generated)

012603659.b3lyp_6-31g(d).gjf (generated)

012603659.b3lyp_6-31g(d).firefly.inp (generated)

012603659.b3lyp_6-31g(d).smash.inp (generated)

012603659.b3lyp_6-31g(d).nwchem.inp (generated) 012603659.b3lyp_6-31g(d).log.xz 012603659.td-b3lyp_6-31g+(d).inp 012603659.td-b3lyp_6-31g+(d).log.xz

012603659.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603659.td-b3lyp_6-31+g(d).gjf (generated)

012603659.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603659.mol 012603659.PUBCHEM 012603659.mol (via Jmol)
012603675.b3lyp_6-31g(d).inp

012603675.b3lyp_6-31g(d).qchem.inp (generated)

012603675.b3lyp_6-31g(d).gjf (generated)

012603675.b3lyp_6-31g(d).firefly.inp (generated)

012603675.b3lyp_6-31g(d).smash.inp (generated)

012603675.b3lyp_6-31g(d).nwchem.inp (generated) 012603675.b3lyp_6-31g(d).log.xz 012603675.td-b3lyp_6-31g+(d).inp 012603675.td-b3lyp_6-31g+(d).log.xz

012603675.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603675.td-b3lyp_6-31+g(d).gjf (generated)

012603675.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603675.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603675.mol 012603675.PUBCHEM 012603675.mol (via Jmol)
012603679.b3lyp_6-31g(d).inp

012603679.b3lyp_6-31g(d).qchem.inp (generated)

012603679.b3lyp_6-31g(d).gjf (generated)

012603679.b3lyp_6-31g(d).firefly.inp (generated)

012603679.b3lyp_6-31g(d).smash.inp (generated)

012603679.b3lyp_6-31g(d).nwchem.inp (generated) 012603679.b3lyp_6-31g(d).log.xz 012603679.td-b3lyp_6-31g+(d).inp 012603679.td-b3lyp_6-31g+(d).log.xz

012603679.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603679.td-b3lyp_6-31+g(d).gjf (generated)

012603679.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603679.mol 012603679.PUBCHEM 012603679.mol (via Jmol)
012603681.b3lyp_6-31g(d).inp

012603681.b3lyp_6-31g(d).qchem.inp (generated)

012603681.b3lyp_6-31g(d).gjf (generated)

012603681.b3lyp_6-31g(d).firefly.inp (generated)

012603681.b3lyp_6-31g(d).smash.inp (generated)

012603681.b3lyp_6-31g(d).nwchem.inp (generated) 012603681.b3lyp_6-31g(d).log.xz 012603681.td-b3lyp_6-31g+(d).inp 012603681.td-b3lyp_6-31g+(d).log.xz

012603681.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603681.td-b3lyp_6-31+g(d).gjf (generated)

012603681.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603681.mol 012603681.PUBCHEM 012603681.mol (via Jmol)
012603682.b3lyp_6-31g(d).inp

012603682.b3lyp_6-31g(d).qchem.inp (generated)

012603682.b3lyp_6-31g(d).gjf (generated)

012603682.b3lyp_6-31g(d).firefly.inp (generated)

012603682.b3lyp_6-31g(d).smash.inp (generated)

012603682.b3lyp_6-31g(d).nwchem.inp (generated) 012603682.b3lyp_6-31g(d).log.xz 012603682.td-b3lyp_6-31g+(d).inp 012603682.td-b3lyp_6-31g+(d).log.xz

012603682.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603682.td-b3lyp_6-31+g(d).gjf (generated)

012603682.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603682.mol 012603682.PUBCHEM 012603682.mol (via Jmol)
012603683.b3lyp_6-31g(d).inp

012603683.b3lyp_6-31g(d).qchem.inp (generated)

012603683.b3lyp_6-31g(d).gjf (generated)

012603683.b3lyp_6-31g(d).firefly.inp (generated)

012603683.b3lyp_6-31g(d).smash.inp (generated)

012603683.b3lyp_6-31g(d).nwchem.inp (generated) 012603683.b3lyp_6-31g(d).log.xz 012603683.td-b3lyp_6-31g+(d).inp 012603683.td-b3lyp_6-31g+(d).log.xz

012603683.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603683.td-b3lyp_6-31+g(d).gjf (generated)

012603683.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603683.mol 012603683.PUBCHEM 012603683.mol (via Jmol)
012603684.b3lyp_6-31g(d).inp

012603684.b3lyp_6-31g(d).qchem.inp (generated)

012603684.b3lyp_6-31g(d).gjf (generated)

012603684.b3lyp_6-31g(d).firefly.inp (generated)

012603684.b3lyp_6-31g(d).smash.inp (generated)

012603684.b3lyp_6-31g(d).nwchem.inp (generated) 012603684.b3lyp_6-31g(d).log.xz 012603684.td-b3lyp_6-31g+(d).inp 012603684.td-b3lyp_6-31g+(d).log.xz

012603684.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603684.td-b3lyp_6-31+g(d).gjf (generated)

012603684.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603684.mol 012603684.PUBCHEM 012603684.mol (via Jmol)
012603690.b3lyp_6-31g(d).inp

012603690.b3lyp_6-31g(d).qchem.inp (generated)

012603690.b3lyp_6-31g(d).gjf (generated)

012603690.b3lyp_6-31g(d).firefly.inp (generated)

012603690.b3lyp_6-31g(d).smash.inp (generated)

012603690.b3lyp_6-31g(d).nwchem.inp (generated) 012603690.b3lyp_6-31g(d).log.xz 012603690.td-b3lyp_6-31g+(d).inp 012603690.td-b3lyp_6-31g+(d).log.xz

012603690.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603690.td-b3lyp_6-31+g(d).gjf (generated)

012603690.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 012603690.mol 012603690.PUBCHEM 012603690.mol (via Jmol)
012603691.b3lyp_6-31g(d).inp

012603691.b3lyp_6-31g(d).qchem.inp (generated)

012603691.b3lyp_6-31g(d).gjf (generated)

012603691.b3lyp_6-31g(d).firefly.inp (generated)

012603691.b3lyp_6-31g(d).smash.inp (generated)

012603691.b3lyp_6-31g(d).nwchem.inp (generated) 012603691.b3lyp_6-31g(d).log.xz 012603691.td-b3lyp_6-31g+(d).inp 012603691.td-b3lyp_6-31g+(d).log.xz

012603691.td-b3lyp_6-31+g(d).qchem.inp (generated)

012603691.td-b3lyp_6-31+g(d).gjf (generated)

012603691.td-b3lyp_6-31+g(d).firefly.inp (generated)

012603691.td-b3lyp_6-31+