Index of

Last updated : Thu Mar 30 02:04:20 JST 2017
Total : 918 (779) in this page
004150007.b3lyp_6-31g(d).inp

004150007.b3lyp_6-31g(d).qchem.inp (generated)

004150007.b3lyp_6-31g(d).gjf (generated)

004150007.b3lyp_6-31g(d).firefly.inp (generated)

004150007.b3lyp_6-31g(d).smash.inp (generated)

004150007.b3lyp_6-31g(d).nwchem.inp (generated) 004150007.b3lyp_6-31g(d).log.xz 004150007.td-b3lyp_6-31g+(d).inp 004150007.td-b3lyp_6-31g+(d).log.xz

004150007.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150007.td-b3lyp_6-31+g(d).gjf (generated)

004150007.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150007.mol 004150007.PUBCHEM 004150007.mol (via Jmol)
004150013.b3lyp_6-31g(d).inp

004150013.b3lyp_6-31g(d).qchem.inp (generated)

004150013.b3lyp_6-31g(d).gjf (generated)

004150013.b3lyp_6-31g(d).firefly.inp (generated)

004150013.b3lyp_6-31g(d).smash.inp (generated)

004150013.b3lyp_6-31g(d).nwchem.inp (generated) 004150013.b3lyp_6-31g(d).log.xz 004150013.td-b3lyp_6-31g+(d).inp 004150013.td-b3lyp_6-31g+(d).log.xz

004150013.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150013.td-b3lyp_6-31+g(d).gjf (generated)

004150013.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150013.mol 004150013.PUBCHEM 004150013.mol (via Jmol)
004150079.b3lyp_6-31g(d).inp

004150079.b3lyp_6-31g(d).qchem.inp (generated)

004150079.b3lyp_6-31g(d).gjf (generated)

004150079.b3lyp_6-31g(d).firefly.inp (generated)

004150079.b3lyp_6-31g(d).smash.inp (generated)

004150079.b3lyp_6-31g(d).nwchem.inp (generated) 004150079.b3lyp_6-31g(d).log.xz 004150079.td-b3lyp_6-31g+(d).inp 004150079.td-b3lyp_6-31g+(d).log.xz

004150079.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150079.td-b3lyp_6-31+g(d).gjf (generated)

004150079.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150079.mol 004150079.PUBCHEM 004150079.mol (via Jmol)
004150117.b3lyp_6-31g(d).inp

004150117.b3lyp_6-31g(d).qchem.inp (generated)

004150117.b3lyp_6-31g(d).gjf (generated)

004150117.b3lyp_6-31g(d).firefly.inp (generated)

004150117.b3lyp_6-31g(d).smash.inp (generated)

004150117.b3lyp_6-31g(d).nwchem.inp (generated) 004150117.b3lyp_6-31g(d).log.xz 004150117.td-b3lyp_6-31g+(d).inp 004150117.td-b3lyp_6-31g+(d).log.xz

004150117.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150117.td-b3lyp_6-31+g(d).gjf (generated)

004150117.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150117.mol 004150117.PUBCHEM 004150117.mol (via Jmol)
004150149.b3lyp_6-31g(d).inp

004150149.b3lyp_6-31g(d).qchem.inp (generated)

004150149.b3lyp_6-31g(d).gjf (generated)

004150149.b3lyp_6-31g(d).firefly.inp (generated)

004150149.b3lyp_6-31g(d).smash.inp (generated)

004150149.b3lyp_6-31g(d).nwchem.inp (generated) 004150149.b3lyp_6-31g(d).log.xz 004150149.mol 004150149.PUBCHEM 004150149.mol (via Jmol)
004150155.b3lyp_6-31g(d).inp

004150155.b3lyp_6-31g(d).qchem.inp (generated)

004150155.b3lyp_6-31g(d).gjf (generated)

004150155.b3lyp_6-31g(d).firefly.inp (generated)

004150155.b3lyp_6-31g(d).smash.inp (generated)

004150155.b3lyp_6-31g(d).nwchem.inp (generated) 004150155.b3lyp_6-31g(d).log.xz 004150155.td-b3lyp_6-31g+(d).inp 004150155.td-b3lyp_6-31g+(d).log.xz

004150155.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150155.td-b3lyp_6-31+g(d).gjf (generated)

004150155.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150155.mol 004150155.PUBCHEM 004150155.mol (via Jmol)
004150162.b3lyp_6-31g(d).inp

004150162.b3lyp_6-31g(d).qchem.inp (generated)

004150162.b3lyp_6-31g(d).gjf (generated)

004150162.b3lyp_6-31g(d).firefly.inp (generated)

004150162.b3lyp_6-31g(d).smash.inp (generated)

004150162.b3lyp_6-31g(d).nwchem.inp (generated) 004150162.b3lyp_6-31g(d).log.xz 004150162.td-b3lyp_6-31g+(d).inp 004150162.td-b3lyp_6-31g+(d).log.xz

004150162.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150162.td-b3lyp_6-31+g(d).gjf (generated)

004150162.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150162.mol 004150162.PUBCHEM 004150162.mol (via Jmol)
004150165.b3lyp_6-31g(d).inp

004150165.b3lyp_6-31g(d).qchem.inp (generated)

004150165.b3lyp_6-31g(d).gjf (generated)

004150165.b3lyp_6-31g(d).firefly.inp (generated)

004150165.b3lyp_6-31g(d).smash.inp (generated)

004150165.b3lyp_6-31g(d).nwchem.inp (generated) 004150165.b3lyp_6-31g(d).log.xz 004150165.td-b3lyp_6-31g+(d).inp 004150165.td-b3lyp_6-31g+(d).log.xz

004150165.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150165.td-b3lyp_6-31+g(d).gjf (generated)

004150165.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150165.mol 004150165.PUBCHEM 004150165.mol (via Jmol)
004150178.b3lyp_6-31g(d).inp

004150178.b3lyp_6-31g(d).qchem.inp (generated)

004150178.b3lyp_6-31g(d).gjf (generated)

004150178.b3lyp_6-31g(d).firefly.inp (generated)

004150178.b3lyp_6-31g(d).smash.inp (generated)

004150178.b3lyp_6-31g(d).nwchem.inp (generated) 004150178.b3lyp_6-31g(d).log.xz 004150178.mol 004150178.PUBCHEM 004150178.mol (via Jmol)
004150220.b3lyp_6-31g(d).inp

004150220.b3lyp_6-31g(d).qchem.inp (generated)

004150220.b3lyp_6-31g(d).gjf (generated)

004150220.b3lyp_6-31g(d).firefly.inp (generated)

004150220.b3lyp_6-31g(d).smash.inp (generated)

004150220.b3lyp_6-31g(d).nwchem.inp (generated) 004150220.b3lyp_6-31g(d).log.xz 004150220.td-b3lyp_6-31g+(d).inp 004150220.td-b3lyp_6-31g+(d).log.xz

004150220.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150220.td-b3lyp_6-31+g(d).gjf (generated)

004150220.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150220.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150220.mol 004150220.PUBCHEM 004150220.mol (via Jmol)
004150224.b3lyp_6-31g(d).inp

004150224.b3lyp_6-31g(d).qchem.inp (generated)

004150224.b3lyp_6-31g(d).gjf (generated)

004150224.b3lyp_6-31g(d).firefly.inp (generated)

004150224.b3lyp_6-31g(d).smash.inp (generated)

004150224.b3lyp_6-31g(d).nwchem.inp (generated) 004150224.b3lyp_6-31g(d).log.xz 004150224.td-b3lyp_6-31g+(d).inp 004150224.td-b3lyp_6-31g+(d).log.xz

004150224.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150224.td-b3lyp_6-31+g(d).gjf (generated)

004150224.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150224.mol 004150224.PUBCHEM 004150224.mol (via Jmol)
004150282.b3lyp_6-31g(d).inp

004150282.b3lyp_6-31g(d).qchem.inp (generated)

004150282.b3lyp_6-31g(d).gjf (generated)

004150282.b3lyp_6-31g(d).firefly.inp (generated)

004150282.b3lyp_6-31g(d).smash.inp (generated)

004150282.b3lyp_6-31g(d).nwchem.inp (generated) 004150282.b3lyp_6-31g(d).log.xz 004150282.td-b3lyp_6-31g+(d).inp 004150282.td-b3lyp_6-31g+(d).log.xz

004150282.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150282.td-b3lyp_6-31+g(d).gjf (generated)

004150282.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150282.mol 004150282.PUBCHEM 004150282.mol (via Jmol)
004150341.b3lyp_6-31g(d).inp

004150341.b3lyp_6-31g(d).qchem.inp (generated)

004150341.b3lyp_6-31g(d).gjf (generated)

004150341.b3lyp_6-31g(d).firefly.inp (generated)

004150341.b3lyp_6-31g(d).smash.inp (generated)

004150341.b3lyp_6-31g(d).nwchem.inp (generated) 004150341.b3lyp_6-31g(d).log.xz 004150341.td-b3lyp_6-31g+(d).inp 004150341.td-b3lyp_6-31g+(d).log.xz

004150341.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150341.td-b3lyp_6-31+g(d).gjf (generated)

004150341.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150341.mol 004150341.PUBCHEM 004150341.mol (via Jmol)
004150398.b3lyp_6-31g(d).inp

004150398.b3lyp_6-31g(d).qchem.inp (generated)

004150398.b3lyp_6-31g(d).gjf (generated)

004150398.b3lyp_6-31g(d).firefly.inp (generated)

004150398.b3lyp_6-31g(d).smash.inp (generated)

004150398.b3lyp_6-31g(d).nwchem.inp (generated) 004150398.b3lyp_6-31g(d).log.xz 004150398.td-b3lyp_6-31g+(d).inp 004150398.td-b3lyp_6-31g+(d).log.xz

004150398.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150398.td-b3lyp_6-31+g(d).gjf (generated)

004150398.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150398.mol 004150398.PUBCHEM 004150398.mol (via Jmol)
004150402.b3lyp_6-31g(d).inp

004150402.b3lyp_6-31g(d).qchem.inp (generated)

004150402.b3lyp_6-31g(d).gjf (generated)

004150402.b3lyp_6-31g(d).firefly.inp (generated)

004150402.b3lyp_6-31g(d).smash.inp (generated)

004150402.b3lyp_6-31g(d).nwchem.inp (generated) 004150402.b3lyp_6-31g(d).log.xz 004150402.mol 004150402.PUBCHEM 004150402.mol (via Jmol)
004150415.b3lyp_6-31g(d).inp

004150415.b3lyp_6-31g(d).qchem.inp (generated)

004150415.b3lyp_6-31g(d).gjf (generated)

004150415.b3lyp_6-31g(d).firefly.inp (generated)

004150415.b3lyp_6-31g(d).smash.inp (generated)

004150415.b3lyp_6-31g(d).nwchem.inp (generated) 004150415.b3lyp_6-31g(d).log.xz 004150415.td-b3lyp_6-31g+(d).inp 004150415.td-b3lyp_6-31g+(d).log.xz

004150415.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150415.td-b3lyp_6-31+g(d).gjf (generated)

004150415.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150415.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150415.mol 004150415.PUBCHEM 004150415.mol (via Jmol)
004150417.b3lyp_6-31g(d).inp

004150417.b3lyp_6-31g(d).qchem.inp (generated)

004150417.b3lyp_6-31g(d).gjf (generated)

004150417.b3lyp_6-31g(d).firefly.inp (generated)

004150417.b3lyp_6-31g(d).smash.inp (generated)

004150417.b3lyp_6-31g(d).nwchem.inp (generated) 004150417.b3lyp_6-31g(d).log.xz 004150417.mol 004150417.PUBCHEM 004150417.mol (via Jmol)
004150420.b3lyp_6-31g(d).inp

004150420.b3lyp_6-31g(d).qchem.inp (generated)

004150420.b3lyp_6-31g(d).gjf (generated)

004150420.b3lyp_6-31g(d).firefly.inp (generated)

004150420.b3lyp_6-31g(d).smash.inp (generated)

004150420.b3lyp_6-31g(d).nwchem.inp (generated) 004150420.b3lyp_6-31g(d).log.xz 004150420.td-b3lyp_6-31g+(d).inp 004150420.td-b3lyp_6-31g+(d).log.xz

004150420.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150420.td-b3lyp_6-31+g(d).gjf (generated)

004150420.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150420.mol 004150420.PUBCHEM 004150420.mol (via Jmol)
004150426.b3lyp_6-31g(d).inp

004150426.b3lyp_6-31g(d).qchem.inp (generated)

004150426.b3lyp_6-31g(d).gjf (generated)

004150426.b3lyp_6-31g(d).firefly.inp (generated)

004150426.b3lyp_6-31g(d).smash.inp (generated)

004150426.b3lyp_6-31g(d).nwchem.inp (generated) 004150426.b3lyp_6-31g(d).log.xz 004150426.td-b3lyp_6-31g+(d).inp 004150426.td-b3lyp_6-31g+(d).log.xz

004150426.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150426.td-b3lyp_6-31+g(d).gjf (generated)

004150426.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150426.mol 004150426.PUBCHEM 004150426.mol (via Jmol)
004150434.b3lyp_6-31g(d).inp

004150434.b3lyp_6-31g(d).qchem.inp (generated)

004150434.b3lyp_6-31g(d).gjf (generated)

004150434.b3lyp_6-31g(d).firefly.inp (generated)

004150434.b3lyp_6-31g(d).smash.inp (generated)

004150434.b3lyp_6-31g(d).nwchem.inp (generated) 004150434.b3lyp_6-31g(d).log.xz 004150434.td-b3lyp_6-31g+(d).inp 004150434.td-b3lyp_6-31g+(d).log.xz

004150434.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150434.td-b3lyp_6-31+g(d).gjf (generated)

004150434.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150434.mol 004150434.PUBCHEM 004150434.mol (via Jmol)
004150438.b3lyp_6-31g(d).inp

004150438.b3lyp_6-31g(d).qchem.inp (generated)

004150438.b3lyp_6-31g(d).gjf (generated)

004150438.b3lyp_6-31g(d).firefly.inp (generated)

004150438.b3lyp_6-31g(d).smash.inp (generated)

004150438.b3lyp_6-31g(d).nwchem.inp (generated) 004150438.b3lyp_6-31g(d).log.xz 004150438.mol 004150438.PUBCHEM 004150438.mol (via Jmol)
004150457.b3lyp_6-31g(d).inp

004150457.b3lyp_6-31g(d).qchem.inp (generated)

004150457.b3lyp_6-31g(d).gjf (generated)

004150457.b3lyp_6-31g(d).firefly.inp (generated)

004150457.b3lyp_6-31g(d).smash.inp (generated)

004150457.b3lyp_6-31g(d).nwchem.inp (generated) 004150457.b3lyp_6-31g(d).log.xz 004150457.td-b3lyp_6-31g+(d).inp 004150457.td-b3lyp_6-31g+(d).log.xz

004150457.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150457.td-b3lyp_6-31+g(d).gjf (generated)

004150457.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150457.mol 004150457.PUBCHEM 004150457.mol (via Jmol)
004150464.b3lyp_6-31g(d).inp

004150464.b3lyp_6-31g(d).qchem.inp (generated)

004150464.b3lyp_6-31g(d).gjf (generated)

004150464.b3lyp_6-31g(d).firefly.inp (generated)

004150464.b3lyp_6-31g(d).smash.inp (generated)

004150464.b3lyp_6-31g(d).nwchem.inp (generated) 004150464.b3lyp_6-31g(d).log.xz 004150464.td-b3lyp_6-31g+(d).inp 004150464.td-b3lyp_6-31g+(d).log.xz

004150464.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150464.td-b3lyp_6-31+g(d).gjf (generated)

004150464.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150464.mol 004150464.PUBCHEM 004150464.mol (via Jmol)
004150499.b3lyp_6-31g(d).inp

004150499.b3lyp_6-31g(d).qchem.inp (generated)

004150499.b3lyp_6-31g(d).gjf (generated)

004150499.b3lyp_6-31g(d).firefly.inp (generated)

004150499.b3lyp_6-31g(d).smash.inp (generated)

004150499.b3lyp_6-31g(d).nwchem.inp (generated) 004150499.b3lyp_6-31g(d).log.xz 004150499.td-b3lyp_6-31g+(d).inp 004150499.td-b3lyp_6-31g+(d).log.xz

004150499.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150499.td-b3lyp_6-31+g(d).gjf (generated)

004150499.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150499.mol 004150499.PUBCHEM 004150499.mol (via Jmol)
004150569.b3lyp_6-31g(d).inp

004150569.b3lyp_6-31g(d).qchem.inp (generated)

004150569.b3lyp_6-31g(d).gjf (generated)

004150569.b3lyp_6-31g(d).firefly.inp (generated)

004150569.b3lyp_6-31g(d).smash.inp (generated)

004150569.b3lyp_6-31g(d).nwchem.inp (generated) 004150569.b3lyp_6-31g(d).log.xz 004150569.td-b3lyp_6-31g+(d).inp 004150569.td-b3lyp_6-31g+(d).log.xz

004150569.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150569.td-b3lyp_6-31+g(d).gjf (generated)

004150569.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150569.mol 004150569.PUBCHEM 004150569.mol (via Jmol)
004150570.b3lyp_6-31g(d).inp

004150570.b3lyp_6-31g(d).qchem.inp (generated)

004150570.b3lyp_6-31g(d).gjf (generated)

004150570.b3lyp_6-31g(d).firefly.inp (generated)

004150570.b3lyp_6-31g(d).smash.inp (generated)

004150570.b3lyp_6-31g(d).nwchem.inp (generated) 004150570.b3lyp_6-31g(d).log.xz 004150570.td-b3lyp_6-31g+(d).inp 004150570.td-b3lyp_6-31g+(d).log.xz

004150570.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150570.td-b3lyp_6-31+g(d).gjf (generated)

004150570.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150570.mol 004150570.PUBCHEM 004150570.mol (via Jmol)
004150576.b3lyp_6-31g(d).inp

004150576.b3lyp_6-31g(d).qchem.inp (generated)

004150576.b3lyp_6-31g(d).gjf (generated)

004150576.b3lyp_6-31g(d).firefly.inp (generated)

004150576.b3lyp_6-31g(d).smash.inp (generated)

004150576.b3lyp_6-31g(d).nwchem.inp (generated) 004150576.b3lyp_6-31g(d).log.xz 004150576.mol 004150576.PUBCHEM 004150576.mol (via Jmol)
004150649.b3lyp_6-31g(d).inp

004150649.b3lyp_6-31g(d).qchem.inp (generated)

004150649.b3lyp_6-31g(d).gjf (generated)

004150649.b3lyp_6-31g(d).firefly.inp (generated)

004150649.b3lyp_6-31g(d).smash.inp (generated)

004150649.b3lyp_6-31g(d).nwchem.inp (generated) 004150649.b3lyp_6-31g(d).log.xz 004150649.mol 004150649.PUBCHEM 004150649.mol (via Jmol)
004150688.b3lyp_6-31g(d).inp

004150688.b3lyp_6-31g(d).qchem.inp (generated)

004150688.b3lyp_6-31g(d).gjf (generated)

004150688.b3lyp_6-31g(d).firefly.inp (generated)

004150688.b3lyp_6-31g(d).smash.inp (generated)

004150688.b3lyp_6-31g(d).nwchem.inp (generated) 004150688.b3lyp_6-31g(d).log.xz 004150688.td-b3lyp_6-31g+(d).inp 004150688.td-b3lyp_6-31g+(d).log.xz

004150688.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150688.td-b3lyp_6-31+g(d).gjf (generated)

004150688.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150688.mol 004150688.PUBCHEM 004150688.mol (via Jmol)
004150720.b3lyp_6-31g(d).inp

004150720.b3lyp_6-31g(d).qchem.inp (generated)

004150720.b3lyp_6-31g(d).gjf (generated)

004150720.b3lyp_6-31g(d).firefly.inp (generated)

004150720.b3lyp_6-31g(d).smash.inp (generated)

004150720.b3lyp_6-31g(d).nwchem.inp (generated) 004150720.b3lyp_6-31g(d).log.xz 004150720.td-b3lyp_6-31g+(d).inp 004150720.td-b3lyp_6-31g+(d).log.xz

004150720.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150720.td-b3lyp_6-31+g(d).gjf (generated)

004150720.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150720.mol 004150720.PUBCHEM 004150720.mol (via Jmol)
004150736.b3lyp_6-31g(d).inp

004150736.b3lyp_6-31g(d).qchem.inp (generated)

004150736.b3lyp_6-31g(d).gjf (generated)

004150736.b3lyp_6-31g(d).firefly.inp (generated)

004150736.b3lyp_6-31g(d).smash.inp (generated)

004150736.b3lyp_6-31g(d).nwchem.inp (generated) 004150736.b3lyp_6-31g(d).log.xz 004150736.td-b3lyp_6-31g+(d).inp 004150736.td-b3lyp_6-31g+(d).log.xz

004150736.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150736.td-b3lyp_6-31+g(d).gjf (generated)

004150736.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150736.mol 004150736.PUBCHEM 004150736.mol (via Jmol)
004150745.b3lyp_6-31g(d).inp

004150745.b3lyp_6-31g(d).qchem.inp (generated)

004150745.b3lyp_6-31g(d).gjf (generated)

004150745.b3lyp_6-31g(d).firefly.inp (generated)

004150745.b3lyp_6-31g(d).smash.inp (generated)

004150745.b3lyp_6-31g(d).nwchem.inp (generated) 004150745.b3lyp_6-31g(d).log.xz 004150745.td-b3lyp_6-31g+(d).inp 004150745.td-b3lyp_6-31g+(d).log.xz

004150745.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150745.td-b3lyp_6-31+g(d).gjf (generated)

004150745.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150745.mol 004150745.PUBCHEM 004150745.mol (via Jmol)
004150751.b3lyp_6-31g(d).inp

004150751.b3lyp_6-31g(d).qchem.inp (generated)

004150751.b3lyp_6-31g(d).gjf (generated)

004150751.b3lyp_6-31g(d).firefly.inp (generated)

004150751.b3lyp_6-31g(d).smash.inp (generated)

004150751.b3lyp_6-31g(d).nwchem.inp (generated) 004150751.b3lyp_6-31g(d).log.xz 004150751.td-b3lyp_6-31g+(d).inp 004150751.td-b3lyp_6-31g+(d).log.xz

004150751.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150751.td-b3lyp_6-31+g(d).gjf (generated)

004150751.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150751.mol 004150751.PUBCHEM 004150751.mol (via Jmol)
004150766.b3lyp_6-31g(d).inp

004150766.b3lyp_6-31g(d).qchem.inp (generated)

004150766.b3lyp_6-31g(d).gjf (generated)

004150766.b3lyp_6-31g(d).firefly.inp (generated)

004150766.b3lyp_6-31g(d).smash.inp (generated)

004150766.b3lyp_6-31g(d).nwchem.inp (generated) 004150766.b3lyp_6-31g(d).log.xz 004150766.td-b3lyp_6-31g+(d).inp 004150766.td-b3lyp_6-31g+(d).log.xz

004150766.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150766.td-b3lyp_6-31+g(d).gjf (generated)

004150766.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150766.mol 004150766.PUBCHEM 004150766.mol (via Jmol)
004150792.b3lyp_6-31g(d).inp

004150792.b3lyp_6-31g(d).qchem.inp (generated)

004150792.b3lyp_6-31g(d).gjf (generated)

004150792.b3lyp_6-31g(d).firefly.inp (generated)

004150792.b3lyp_6-31g(d).smash.inp (generated)

004150792.b3lyp_6-31g(d).nwchem.inp (generated) 004150792.b3lyp_6-31g(d).log.xz 004150792.td-b3lyp_6-31g+(d).inp 004150792.td-b3lyp_6-31g+(d).log.xz

004150792.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150792.td-b3lyp_6-31+g(d).gjf (generated)

004150792.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150792.mol 004150792.PUBCHEM 004150792.mol (via Jmol)
004150859.b3lyp_6-31g(d).inp

004150859.b3lyp_6-31g(d).qchem.inp (generated)

004150859.b3lyp_6-31g(d).gjf (generated)

004150859.b3lyp_6-31g(d).firefly.inp (generated)

004150859.b3lyp_6-31g(d).smash.inp (generated)

004150859.b3lyp_6-31g(d).nwchem.inp (generated) 004150859.b3lyp_6-31g(d).log.xz 004150859.td-b3lyp_6-31g+(d).inp 004150859.td-b3lyp_6-31g+(d).log.xz

004150859.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150859.td-b3lyp_6-31+g(d).gjf (generated)

004150859.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150859.mol 004150859.PUBCHEM 004150859.mol (via Jmol)
004150874.b3lyp_6-31g(d).inp

004150874.b3lyp_6-31g(d).qchem.inp (generated)

004150874.b3lyp_6-31g(d).gjf (generated)

004150874.b3lyp_6-31g(d).firefly.inp (generated)

004150874.b3lyp_6-31g(d).smash.inp (generated)

004150874.b3lyp_6-31g(d).nwchem.inp (generated) 004150874.b3lyp_6-31g(d).log.xz 004150874.td-b3lyp_6-31g+(d).inp 004150874.td-b3lyp_6-31g+(d).log.xz

004150874.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150874.td-b3lyp_6-31+g(d).gjf (generated)

004150874.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150874.mol 004150874.PUBCHEM 004150874.mol (via Jmol)
004150878.b3lyp_6-31g(d).inp

004150878.b3lyp_6-31g(d).qchem.inp (generated)

004150878.b3lyp_6-31g(d).gjf (generated)

004150878.b3lyp_6-31g(d).firefly.inp (generated)

004150878.b3lyp_6-31g(d).smash.inp (generated)

004150878.b3lyp_6-31g(d).nwchem.inp (generated) 004150878.b3lyp_6-31g(d).log.xz 004150878.td-b3lyp_6-31g+(d).inp 004150878.td-b3lyp_6-31g+(d).log.xz

004150878.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150878.td-b3lyp_6-31+g(d).gjf (generated)

004150878.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150878.mol 004150878.PUBCHEM 004150878.mol (via Jmol)
004150895.b3lyp_6-31g(d).inp

004150895.b3lyp_6-31g(d).qchem.inp (generated)

004150895.b3lyp_6-31g(d).gjf (generated)

004150895.b3lyp_6-31g(d).firefly.inp (generated)

004150895.b3lyp_6-31g(d).smash.inp (generated)

004150895.b3lyp_6-31g(d).nwchem.inp (generated) 004150895.b3lyp_6-31g(d).log.xz 004150895.td-b3lyp_6-31g+(d).inp 004150895.td-b3lyp_6-31g+(d).log.xz

004150895.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150895.td-b3lyp_6-31+g(d).gjf (generated)

004150895.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150895.mol 004150895.PUBCHEM 004150895.mol (via Jmol)
004150924.b3lyp_6-31g(d).inp

004150924.b3lyp_6-31g(d).qchem.inp (generated)

004150924.b3lyp_6-31g(d).gjf (generated)

004150924.b3lyp_6-31g(d).firefly.inp (generated)

004150924.b3lyp_6-31g(d).smash.inp (generated)

004150924.b3lyp_6-31g(d).nwchem.inp (generated) 004150924.b3lyp_6-31g(d).log.xz 004150924.td-b3lyp_6-31g+(d).inp 004150924.td-b3lyp_6-31g+(d).log.xz

004150924.td-b3lyp_6-31+g(d).qchem.inp (generated)

004150924.td-b3lyp_6-31+g(d).gjf (generated)

004150924.td-b3lyp_6-31+g(d).firefly.inp (generated)

004150924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004150924.mol 004150924.PUBCHEM 004150924.mol (via Jmol)
004150962.b3lyp_6-31g(d).inp

004150962.b3lyp_6-31g(d).qchem.inp (generated)

004150962.b3lyp_6-31g(d).gjf (generated)

004150962.b3lyp_6-31g(d).firefly.inp (generated)

004150962.b3lyp_6-31g(d).smash.inp (generated)

004150962.b3lyp_6-31g(d).nwchem.inp (generated) 004150962.b3lyp_6-31g(d).log.xz 004150962.mol 004150962.PUBCHEM 004150962.mol (via Jmol)
004151160.b3lyp_6-31g(d).inp

004151160.b3lyp_6-31g(d).qchem.inp (generated)

004151160.b3lyp_6-31g(d).gjf (generated)

004151160.b3lyp_6-31g(d).firefly.inp (generated)

004151160.b3lyp_6-31g(d).smash.inp (generated)

004151160.b3lyp_6-31g(d).nwchem.inp (generated) 004151160.b3lyp_6-31g(d).log.xz 004151160.td-b3lyp_6-31g+(d).inp 004151160.td-b3lyp_6-31g+(d).log.xz

004151160.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151160.td-b3lyp_6-31+g(d).gjf (generated)

004151160.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151160.mol 004151160.PUBCHEM 004151160.mol (via Jmol)
004151170.b3lyp_6-31g(d).inp

004151170.b3lyp_6-31g(d).qchem.inp (generated)

004151170.b3lyp_6-31g(d).gjf (generated)

004151170.b3lyp_6-31g(d).firefly.inp (generated)

004151170.b3lyp_6-31g(d).smash.inp (generated)

004151170.b3lyp_6-31g(d).nwchem.inp (generated) 004151170.b3lyp_6-31g(d).log.xz 004151170.td-b3lyp_6-31g+(d).inp 004151170.td-b3lyp_6-31g+(d).log.xz

004151170.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151170.td-b3lyp_6-31+g(d).gjf (generated)

004151170.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151170.mol 004151170.PUBCHEM 004151170.mol (via Jmol)
004151308.b3lyp_6-31g(d).inp

004151308.b3lyp_6-31g(d).qchem.inp (generated)

004151308.b3lyp_6-31g(d).gjf (generated)

004151308.b3lyp_6-31g(d).firefly.inp (generated)

004151308.b3lyp_6-31g(d).smash.inp (generated)

004151308.b3lyp_6-31g(d).nwchem.inp (generated) 004151308.b3lyp_6-31g(d).log.xz 004151308.td-b3lyp_6-31g+(d).inp 004151308.td-b3lyp_6-31g+(d).log.xz

004151308.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151308.td-b3lyp_6-31+g(d).gjf (generated)

004151308.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151308.mol 004151308.PUBCHEM 004151308.mol (via Jmol)
004151374.b3lyp_6-31g(d).inp

004151374.b3lyp_6-31g(d).qchem.inp (generated)

004151374.b3lyp_6-31g(d).gjf (generated)

004151374.b3lyp_6-31g(d).firefly.inp (generated)

004151374.b3lyp_6-31g(d).smash.inp (generated)

004151374.b3lyp_6-31g(d).nwchem.inp (generated) 004151374.b3lyp_6-31g(d).log.xz 004151374.td-b3lyp_6-31g+(d).inp 004151374.td-b3lyp_6-31g+(d).log.xz

004151374.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151374.td-b3lyp_6-31+g(d).gjf (generated)

004151374.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151374.mol 004151374.PUBCHEM 004151374.mol (via Jmol)
004151425.b3lyp_6-31g(d).inp

004151425.b3lyp_6-31g(d).qchem.inp (generated)

004151425.b3lyp_6-31g(d).gjf (generated)

004151425.b3lyp_6-31g(d).firefly.inp (generated)

004151425.b3lyp_6-31g(d).smash.inp (generated)

004151425.b3lyp_6-31g(d).nwchem.inp (generated) 004151425.b3lyp_6-31g(d).log.xz 004151425.td-b3lyp_6-31g+(d).inp 004151425.td-b3lyp_6-31g+(d).log.xz

004151425.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151425.td-b3lyp_6-31+g(d).gjf (generated)

004151425.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151425.mol 004151425.PUBCHEM 004151425.mol (via Jmol)
004151427.b3lyp_6-31g(d).inp

004151427.b3lyp_6-31g(d).qchem.inp (generated)

004151427.b3lyp_6-31g(d).gjf (generated)

004151427.b3lyp_6-31g(d).firefly.inp (generated)

004151427.b3lyp_6-31g(d).smash.inp (generated)

004151427.b3lyp_6-31g(d).nwchem.inp (generated) 004151427.b3lyp_6-31g(d).log.xz 004151427.td-b3lyp_6-31g+(d).inp 004151427.td-b3lyp_6-31g+(d).log.xz

004151427.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151427.td-b3lyp_6-31+g(d).gjf (generated)

004151427.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151427.mol 004151427.PUBCHEM 004151427.mol (via Jmol)
004151444.b3lyp_6-31g(d).inp

004151444.b3lyp_6-31g(d).qchem.inp (generated)

004151444.b3lyp_6-31g(d).gjf (generated)

004151444.b3lyp_6-31g(d).firefly.inp (generated)

004151444.b3lyp_6-31g(d).smash.inp (generated)

004151444.b3lyp_6-31g(d).nwchem.inp (generated) 004151444.b3lyp_6-31g(d).log.xz 004151444.td-b3lyp_6-31g+(d).inp 004151444.td-b3lyp_6-31g+(d).log.xz

004151444.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151444.td-b3lyp_6-31+g(d).gjf (generated)

004151444.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151444.mol 004151444.PUBCHEM 004151444.mol (via Jmol)
004151473.b3lyp_6-31g(d).inp

004151473.b3lyp_6-31g(d).qchem.inp (generated)

004151473.b3lyp_6-31g(d).gjf (generated)

004151473.b3lyp_6-31g(d).firefly.inp (generated)

004151473.b3lyp_6-31g(d).smash.inp (generated)

004151473.b3lyp_6-31g(d).nwchem.inp (generated) 004151473.b3lyp_6-31g(d).log.xz 004151473.mol 004151473.PUBCHEM 004151473.mol (via Jmol)
004151596.b3lyp_6-31g(d).inp

004151596.b3lyp_6-31g(d).qchem.inp (generated)

004151596.b3lyp_6-31g(d).gjf (generated)

004151596.b3lyp_6-31g(d).firefly.inp (generated)

004151596.b3lyp_6-31g(d).smash.inp (generated)

004151596.b3lyp_6-31g(d).nwchem.inp (generated) 004151596.b3lyp_6-31g(d).log.xz 004151596.td-b3lyp_6-31g+(d).inp 004151596.td-b3lyp_6-31g+(d).log.xz

004151596.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151596.td-b3lyp_6-31+g(d).gjf (generated)

004151596.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151596.mol 004151596.PUBCHEM 004151596.mol (via Jmol)
004151676.b3lyp_6-31g(d).inp

004151676.b3lyp_6-31g(d).qchem.inp (generated)

004151676.b3lyp_6-31g(d).gjf (generated)

004151676.b3lyp_6-31g(d).firefly.inp (generated)

004151676.b3lyp_6-31g(d).smash.inp (generated)

004151676.b3lyp_6-31g(d).nwchem.inp (generated) 004151676.b3lyp_6-31g(d).log.xz 004151676.td-b3lyp_6-31g+(d).inp 004151676.td-b3lyp_6-31g+(d).log.xz

004151676.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151676.td-b3lyp_6-31+g(d).gjf (generated)

004151676.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151676.mol 004151676.PUBCHEM 004151676.mol (via Jmol)
004151677.b3lyp_6-31g(d).inp

004151677.b3lyp_6-31g(d).qchem.inp (generated)

004151677.b3lyp_6-31g(d).gjf (generated)

004151677.b3lyp_6-31g(d).firefly.inp (generated)

004151677.b3lyp_6-31g(d).smash.inp (generated)

004151677.b3lyp_6-31g(d).nwchem.inp (generated) 004151677.b3lyp_6-31g(d).log.xz 004151677.mol 004151677.PUBCHEM 004151677.mol (via Jmol)
004151682.b3lyp_6-31g(d).inp

004151682.b3lyp_6-31g(d).qchem.inp (generated)

004151682.b3lyp_6-31g(d).gjf (generated)

004151682.b3lyp_6-31g(d).firefly.inp (generated)

004151682.b3lyp_6-31g(d).smash.inp (generated)

004151682.b3lyp_6-31g(d).nwchem.inp (generated) 004151682.b3lyp_6-31g(d).log.xz 004151682.td-b3lyp_6-31g+(d).inp 004151682.td-b3lyp_6-31g+(d).log.xz

004151682.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151682.td-b3lyp_6-31+g(d).gjf (generated)

004151682.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151682.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151682.mol 004151682.PUBCHEM 004151682.mol (via Jmol)
004151762.b3lyp_6-31g(d).inp

004151762.b3lyp_6-31g(d).qchem.inp (generated)

004151762.b3lyp_6-31g(d).gjf (generated)

004151762.b3lyp_6-31g(d).firefly.inp (generated)

004151762.b3lyp_6-31g(d).smash.inp (generated)

004151762.b3lyp_6-31g(d).nwchem.inp (generated) 004151762.b3lyp_6-31g(d).log.xz 004151762.td-b3lyp_6-31g+(d).inp 004151762.td-b3lyp_6-31g+(d).log.xz

004151762.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151762.td-b3lyp_6-31+g(d).gjf (generated)

004151762.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151762.mol 004151762.PUBCHEM 004151762.mol (via Jmol)
004151778.b3lyp_6-31g(d).inp

004151778.b3lyp_6-31g(d).qchem.inp (generated)

004151778.b3lyp_6-31g(d).gjf (generated)

004151778.b3lyp_6-31g(d).firefly.inp (generated)

004151778.b3lyp_6-31g(d).smash.inp (generated)

004151778.b3lyp_6-31g(d).nwchem.inp (generated) 004151778.b3lyp_6-31g(d).log.xz 004151778.td-b3lyp_6-31g+(d).inp 004151778.td-b3lyp_6-31g+(d).log.xz

004151778.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151778.td-b3lyp_6-31+g(d).gjf (generated)

004151778.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151778.mol 004151778.PUBCHEM 004151778.mol (via Jmol)
004151872.b3lyp_6-31g(d).inp

004151872.b3lyp_6-31g(d).qchem.inp (generated)

004151872.b3lyp_6-31g(d).gjf (generated)

004151872.b3lyp_6-31g(d).firefly.inp (generated)

004151872.b3lyp_6-31g(d).smash.inp (generated)

004151872.b3lyp_6-31g(d).nwchem.inp (generated) 004151872.b3lyp_6-31g(d).log.xz 004151872.td-b3lyp_6-31g+(d).inp 004151872.td-b3lyp_6-31g+(d).log.xz

004151872.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151872.td-b3lyp_6-31+g(d).gjf (generated)

004151872.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151872.mol 004151872.PUBCHEM 004151872.mol (via Jmol)
004151894.b3lyp_6-31g(d).inp

004151894.b3lyp_6-31g(d).qchem.inp (generated)

004151894.b3lyp_6-31g(d).gjf (generated)

004151894.b3lyp_6-31g(d).firefly.inp (generated)

004151894.b3lyp_6-31g(d).smash.inp (generated)

004151894.b3lyp_6-31g(d).nwchem.inp (generated) 004151894.b3lyp_6-31g(d).log.xz 004151894.td-b3lyp_6-31g+(d).inp 004151894.td-b3lyp_6-31g+(d).log.xz

004151894.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151894.td-b3lyp_6-31+g(d).gjf (generated)

004151894.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151894.mol 004151894.PUBCHEM 004151894.mol (via Jmol)
004151898.b3lyp_6-31g(d).inp

004151898.b3lyp_6-31g(d).qchem.inp (generated)

004151898.b3lyp_6-31g(d).gjf (generated)

004151898.b3lyp_6-31g(d).firefly.inp (generated)

004151898.b3lyp_6-31g(d).smash.inp (generated)

004151898.b3lyp_6-31g(d).nwchem.inp (generated) 004151898.b3lyp_6-31g(d).log.xz 004151898.td-b3lyp_6-31g+(d).inp 004151898.td-b3lyp_6-31g+(d).log.xz

004151898.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151898.td-b3lyp_6-31+g(d).gjf (generated)

004151898.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151898.mol 004151898.PUBCHEM 004151898.mol (via Jmol)
004151984.b3lyp_6-31g(d).inp

004151984.b3lyp_6-31g(d).qchem.inp (generated)

004151984.b3lyp_6-31g(d).gjf (generated)

004151984.b3lyp_6-31g(d).firefly.inp (generated)

004151984.b3lyp_6-31g(d).smash.inp (generated)

004151984.b3lyp_6-31g(d).nwchem.inp (generated) 004151984.b3lyp_6-31g(d).log.xz 004151984.td-b3lyp_6-31g+(d).inp 004151984.td-b3lyp_6-31g+(d).log.xz

004151984.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151984.td-b3lyp_6-31+g(d).gjf (generated)

004151984.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151984.mol 004151984.PUBCHEM 004151984.mol (via Jmol)
004151995.b3lyp_6-31g(d).inp

004151995.b3lyp_6-31g(d).qchem.inp (generated)

004151995.b3lyp_6-31g(d).gjf (generated)

004151995.b3lyp_6-31g(d).firefly.inp (generated)

004151995.b3lyp_6-31g(d).smash.inp (generated)

004151995.b3lyp_6-31g(d).nwchem.inp (generated) 004151995.b3lyp_6-31g(d).log.xz 004151995.td-b3lyp_6-31g+(d).inp 004151995.td-b3lyp_6-31g+(d).log.xz

004151995.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151995.td-b3lyp_6-31+g(d).gjf (generated)

004151995.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151995.mol 004151995.PUBCHEM 004151995.mol (via Jmol)
004151998.b3lyp_6-31g(d).inp

004151998.b3lyp_6-31g(d).qchem.inp (generated)

004151998.b3lyp_6-31g(d).gjf (generated)

004151998.b3lyp_6-31g(d).firefly.inp (generated)

004151998.b3lyp_6-31g(d).smash.inp (generated)

004151998.b3lyp_6-31g(d).nwchem.inp (generated) 004151998.b3lyp_6-31g(d).log.xz 004151998.td-b3lyp_6-31g+(d).inp 004151998.td-b3lyp_6-31g+(d).log.xz

004151998.td-b3lyp_6-31+g(d).qchem.inp (generated)

004151998.td-b3lyp_6-31+g(d).gjf (generated)

004151998.td-b3lyp_6-31+g(d).firefly.inp (generated)

004151998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004151998.mol 004151998.PUBCHEM 004151998.mol (via Jmol)
004152000.b3lyp_6-31g(d).inp

004152000.b3lyp_6-31g(d).qchem.inp (generated)

004152000.b3lyp_6-31g(d).gjf (generated)

004152000.b3lyp_6-31g(d).firefly.inp (generated)

004152000.b3lyp_6-31g(d).smash.inp (generated)

004152000.b3lyp_6-31g(d).nwchem.inp (generated) 004152000.b3lyp_6-31g(d).log.xz 004152000.td-b3lyp_6-31g+(d).inp 004152000.td-b3lyp_6-31g+(d).log.xz

004152000.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152000.td-b3lyp_6-31+g(d).gjf (generated)

004152000.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152000.mol 004152000.PUBCHEM 004152000.mol (via Jmol)
004152008.b3lyp_6-31g(d).inp

004152008.b3lyp_6-31g(d).qchem.inp (generated)

004152008.b3lyp_6-31g(d).gjf (generated)

004152008.b3lyp_6-31g(d).firefly.inp (generated)

004152008.b3lyp_6-31g(d).smash.inp (generated)

004152008.b3lyp_6-31g(d).nwchem.inp (generated) 004152008.b3lyp_6-31g(d).log.xz 004152008.td-b3lyp_6-31g+(d).inp 004152008.td-b3lyp_6-31g+(d).log.xz

004152008.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152008.td-b3lyp_6-31+g(d).gjf (generated)

004152008.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152008.mol 004152008.PUBCHEM 004152008.mol (via Jmol)
004152009.b3lyp_6-31g(d).inp

004152009.b3lyp_6-31g(d).qchem.inp (generated)

004152009.b3lyp_6-31g(d).gjf (generated)

004152009.b3lyp_6-31g(d).firefly.inp (generated)

004152009.b3lyp_6-31g(d).smash.inp (generated)

004152009.b3lyp_6-31g(d).nwchem.inp (generated) 004152009.b3lyp_6-31g(d).log.xz 004152009.td-b3lyp_6-31g+(d).inp 004152009.td-b3lyp_6-31g+(d).log.xz

004152009.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152009.td-b3lyp_6-31+g(d).gjf (generated)

004152009.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152009.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152009.mol 004152009.PUBCHEM 004152009.mol (via Jmol)
004152030.b3lyp_6-31g(d).inp

004152030.b3lyp_6-31g(d).qchem.inp (generated)

004152030.b3lyp_6-31g(d).gjf (generated)

004152030.b3lyp_6-31g(d).firefly.inp (generated)

004152030.b3lyp_6-31g(d).smash.inp (generated)

004152030.b3lyp_6-31g(d).nwchem.inp (generated) 004152030.b3lyp_6-31g(d).log.xz 004152030.td-b3lyp_6-31g+(d).inp 004152030.td-b3lyp_6-31g+(d).log.xz

004152030.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152030.td-b3lyp_6-31+g(d).gjf (generated)

004152030.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152030.mol 004152030.PUBCHEM 004152030.mol (via Jmol)
004152046.b3lyp_6-31g(d).inp

004152046.b3lyp_6-31g(d).qchem.inp (generated)

004152046.b3lyp_6-31g(d).gjf (generated)

004152046.b3lyp_6-31g(d).firefly.inp (generated)

004152046.b3lyp_6-31g(d).smash.inp (generated)

004152046.b3lyp_6-31g(d).nwchem.inp (generated) 004152046.b3lyp_6-31g(d).log.xz 004152046.mol 004152046.PUBCHEM 004152046.mol (via Jmol)
004152057.b3lyp_6-31g(d).inp

004152057.b3lyp_6-31g(d).qchem.inp (generated)

004152057.b3lyp_6-31g(d).gjf (generated)

004152057.b3lyp_6-31g(d).firefly.inp (generated)

004152057.b3lyp_6-31g(d).smash.inp (generated)

004152057.b3lyp_6-31g(d).nwchem.inp (generated) 004152057.b3lyp_6-31g(d).log.xz 004152057.td-b3lyp_6-31g+(d).inp 004152057.td-b3lyp_6-31g+(d).log.xz

004152057.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152057.td-b3lyp_6-31+g(d).gjf (generated)

004152057.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152057.mol 004152057.PUBCHEM 004152057.mol (via Jmol)
004152075.b3lyp_6-31g(d).inp

004152075.b3lyp_6-31g(d).qchem.inp (generated)

004152075.b3lyp_6-31g(d).gjf (generated)

004152075.b3lyp_6-31g(d).firefly.inp (generated)

004152075.b3lyp_6-31g(d).smash.inp (generated)

004152075.b3lyp_6-31g(d).nwchem.inp (generated) 004152075.b3lyp_6-31g(d).log.xz 004152075.td-b3lyp_6-31g+(d).inp 004152075.td-b3lyp_6-31g+(d).log.xz

004152075.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152075.td-b3lyp_6-31+g(d).gjf (generated)

004152075.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152075.mol 004152075.PUBCHEM 004152075.mol (via Jmol)
004152076.b3lyp_6-31g(d).inp

004152076.b3lyp_6-31g(d).qchem.inp (generated)

004152076.b3lyp_6-31g(d).gjf (generated)

004152076.b3lyp_6-31g(d).firefly.inp (generated)

004152076.b3lyp_6-31g(d).smash.inp (generated)

004152076.b3lyp_6-31g(d).nwchem.inp (generated) 004152076.b3lyp_6-31g(d).log.xz 004152076.mol 004152076.PUBCHEM 004152076.mol (via Jmol)
004152090.b3lyp_6-31g(d).inp

004152090.b3lyp_6-31g(d).qchem.inp (generated)

004152090.b3lyp_6-31g(d).gjf (generated)

004152090.b3lyp_6-31g(d).firefly.inp (generated)

004152090.b3lyp_6-31g(d).smash.inp (generated)

004152090.b3lyp_6-31g(d).nwchem.inp (generated) 004152090.b3lyp_6-31g(d).log.xz 004152090.td-b3lyp_6-31g+(d).inp 004152090.td-b3lyp_6-31g+(d).log.xz

004152090.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152090.td-b3lyp_6-31+g(d).gjf (generated)

004152090.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152090.mol 004152090.PUBCHEM 004152090.mol (via Jmol)
004152154.b3lyp_6-31g(d).inp

004152154.b3lyp_6-31g(d).qchem.inp (generated)

004152154.b3lyp_6-31g(d).gjf (generated)

004152154.b3lyp_6-31g(d).firefly.inp (generated)

004152154.b3lyp_6-31g(d).smash.inp (generated)

004152154.b3lyp_6-31g(d).nwchem.inp (generated) 004152154.b3lyp_6-31g(d).log.xz 004152154.td-b3lyp_6-31g+(d).inp 004152154.td-b3lyp_6-31g+(d).log.xz

004152154.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152154.td-b3lyp_6-31+g(d).gjf (generated)

004152154.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152154.mol 004152154.PUBCHEM 004152154.mol (via Jmol)
004152156.b3lyp_6-31g(d).inp

004152156.b3lyp_6-31g(d).qchem.inp (generated)

004152156.b3lyp_6-31g(d).gjf (generated)

004152156.b3lyp_6-31g(d).firefly.inp (generated)

004152156.b3lyp_6-31g(d).smash.inp (generated)

004152156.b3lyp_6-31g(d).nwchem.inp (generated) 004152156.b3lyp_6-31g(d).log.xz 004152156.td-b3lyp_6-31g+(d).inp 004152156.td-b3lyp_6-31g+(d).log.xz

004152156.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152156.td-b3lyp_6-31+g(d).gjf (generated)

004152156.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152156.mol 004152156.PUBCHEM 004152156.mol (via Jmol)
004152209.b3lyp_6-31g(d).inp

004152209.b3lyp_6-31g(d).qchem.inp (generated)

004152209.b3lyp_6-31g(d).gjf (generated)

004152209.b3lyp_6-31g(d).firefly.inp (generated)

004152209.b3lyp_6-31g(d).smash.inp (generated)

004152209.b3lyp_6-31g(d).nwchem.inp (generated) 004152209.b3lyp_6-31g(d).log.xz 004152209.td-b3lyp_6-31g+(d).inp 004152209.td-b3lyp_6-31g+(d).log.xz

004152209.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152209.td-b3lyp_6-31+g(d).gjf (generated)

004152209.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152209.mol 004152209.PUBCHEM 004152209.mol (via Jmol)
004152213.b3lyp_6-31g(d).inp

004152213.b3lyp_6-31g(d).qchem.inp (generated)

004152213.b3lyp_6-31g(d).gjf (generated)

004152213.b3lyp_6-31g(d).firefly.inp (generated)

004152213.b3lyp_6-31g(d).smash.inp (generated)

004152213.b3lyp_6-31g(d).nwchem.inp (generated) 004152213.b3lyp_6-31g(d).log.xz 004152213.td-b3lyp_6-31g+(d).inp 004152213.td-b3lyp_6-31g+(d).log.xz

004152213.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152213.td-b3lyp_6-31+g(d).gjf (generated)

004152213.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152213.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152213.mol 004152213.PUBCHEM 004152213.mol (via Jmol)
004152214.b3lyp_6-31g(d).inp

004152214.b3lyp_6-31g(d).qchem.inp (generated)

004152214.b3lyp_6-31g(d).gjf (generated)

004152214.b3lyp_6-31g(d).firefly.inp (generated)

004152214.b3lyp_6-31g(d).smash.inp (generated)

004152214.b3lyp_6-31g(d).nwchem.inp (generated) 004152214.b3lyp_6-31g(d).log.xz 004152214.td-b3lyp_6-31g+(d).inp 004152214.td-b3lyp_6-31g+(d).log.xz

004152214.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152214.td-b3lyp_6-31+g(d).gjf (generated)

004152214.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152214.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152214.mol 004152214.PUBCHEM 004152214.mol (via Jmol)
004152222.b3lyp_6-31g(d).inp

004152222.b3lyp_6-31g(d).qchem.inp (generated)

004152222.b3lyp_6-31g(d).gjf (generated)

004152222.b3lyp_6-31g(d).firefly.inp (generated)

004152222.b3lyp_6-31g(d).smash.inp (generated)

004152222.b3lyp_6-31g(d).nwchem.inp (generated) 004152222.b3lyp_6-31g(d).log.xz 004152222.td-b3lyp_6-31g+(d).inp 004152222.td-b3lyp_6-31g+(d).log.xz

004152222.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152222.td-b3lyp_6-31+g(d).gjf (generated)

004152222.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152222.mol 004152222.PUBCHEM 004152222.mol (via Jmol)
004152228.b3lyp_6-31g(d).inp

004152228.b3lyp_6-31g(d).qchem.inp (generated)

004152228.b3lyp_6-31g(d).gjf (generated)

004152228.b3lyp_6-31g(d).firefly.inp (generated)

004152228.b3lyp_6-31g(d).smash.inp (generated)

004152228.b3lyp_6-31g(d).nwchem.inp (generated) 004152228.b3lyp_6-31g(d).log.xz 004152228.td-b3lyp_6-31g+(d).inp 004152228.td-b3lyp_6-31g+(d).log.xz

004152228.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152228.td-b3lyp_6-31+g(d).gjf (generated)

004152228.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152228.mol 004152228.PUBCHEM 004152228.mol (via Jmol)
004152252.b3lyp_6-31g(d).inp

004152252.b3lyp_6-31g(d).qchem.inp (generated)

004152252.b3lyp_6-31g(d).gjf (generated)

004152252.b3lyp_6-31g(d).firefly.inp (generated)

004152252.b3lyp_6-31g(d).smash.inp (generated)

004152252.b3lyp_6-31g(d).nwchem.inp (generated) 004152252.b3lyp_6-31g(d).log.xz 004152252.td-b3lyp_6-31g+(d).inp 004152252.td-b3lyp_6-31g+(d).log.xz

004152252.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152252.td-b3lyp_6-31+g(d).gjf (generated)

004152252.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152252.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152252.mol 004152252.PUBCHEM 004152252.mol (via Jmol)
004152349.b3lyp_6-31g(d).inp

004152349.b3lyp_6-31g(d).qchem.inp (generated)

004152349.b3lyp_6-31g(d).gjf (generated)

004152349.b3lyp_6-31g(d).firefly.inp (generated)

004152349.b3lyp_6-31g(d).smash.inp (generated)

004152349.b3lyp_6-31g(d).nwchem.inp (generated) 004152349.b3lyp_6-31g(d).log.xz 004152349.td-b3lyp_6-31g+(d).inp 004152349.td-b3lyp_6-31g+(d).log.xz

004152349.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152349.td-b3lyp_6-31+g(d).gjf (generated)

004152349.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152349.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152349.mol 004152349.PUBCHEM 004152349.mol (via Jmol)
004152353.b3lyp_6-31g(d).inp

004152353.b3lyp_6-31g(d).qchem.inp (generated)

004152353.b3lyp_6-31g(d).gjf (generated)

004152353.b3lyp_6-31g(d).firefly.inp (generated)

004152353.b3lyp_6-31g(d).smash.inp (generated)

004152353.b3lyp_6-31g(d).nwchem.inp (generated) 004152353.b3lyp_6-31g(d).log.xz 004152353.td-b3lyp_6-31g+(d).inp 004152353.td-b3lyp_6-31g+(d).log.xz

004152353.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152353.td-b3lyp_6-31+g(d).gjf (generated)

004152353.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152353.mol 004152353.PUBCHEM 004152353.mol (via Jmol)
004152421.b3lyp_6-31g(d).inp

004152421.b3lyp_6-31g(d).qchem.inp (generated)

004152421.b3lyp_6-31g(d).gjf (generated)

004152421.b3lyp_6-31g(d).firefly.inp (generated)

004152421.b3lyp_6-31g(d).smash.inp (generated)

004152421.b3lyp_6-31g(d).nwchem.inp (generated) 004152421.b3lyp_6-31g(d).log.xz 004152421.td-b3lyp_6-31g+(d).inp 004152421.td-b3lyp_6-31g+(d).log.xz

004152421.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152421.td-b3lyp_6-31+g(d).gjf (generated)

004152421.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152421.mol 004152421.PUBCHEM 004152421.mol (via Jmol)
004152468.b3lyp_6-31g(d).inp

004152468.b3lyp_6-31g(d).qchem.inp (generated)

004152468.b3lyp_6-31g(d).gjf (generated)

004152468.b3lyp_6-31g(d).firefly.inp (generated)

004152468.b3lyp_6-31g(d).smash.inp (generated)

004152468.b3lyp_6-31g(d).nwchem.inp (generated) 004152468.b3lyp_6-31g(d).log.xz 004152468.td-b3lyp_6-31g+(d).inp 004152468.td-b3lyp_6-31g+(d).log.xz

004152468.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152468.td-b3lyp_6-31+g(d).gjf (generated)

004152468.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152468.mol 004152468.PUBCHEM 004152468.mol (via Jmol)
004152520.b3lyp_6-31g(d).inp

004152520.b3lyp_6-31g(d).qchem.inp (generated)

004152520.b3lyp_6-31g(d).gjf (generated)

004152520.b3lyp_6-31g(d).firefly.inp (generated)

004152520.b3lyp_6-31g(d).smash.inp (generated)

004152520.b3lyp_6-31g(d).nwchem.inp (generated) 004152520.b3lyp_6-31g(d).log.xz 004152520.td-b3lyp_6-31g+(d).inp 004152520.td-b3lyp_6-31g+(d).log.xz

004152520.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152520.td-b3lyp_6-31+g(d).gjf (generated)

004152520.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152520.mol 004152520.PUBCHEM 004152520.mol (via Jmol)
004152550.b3lyp_6-31g(d).inp

004152550.b3lyp_6-31g(d).qchem.inp (generated)

004152550.b3lyp_6-31g(d).gjf (generated)

004152550.b3lyp_6-31g(d).firefly.inp (generated)

004152550.b3lyp_6-31g(d).smash.inp (generated)

004152550.b3lyp_6-31g(d).nwchem.inp (generated) 004152550.b3lyp_6-31g(d).log.xz 004152550.td-b3lyp_6-31g+(d).inp 004152550.td-b3lyp_6-31g+(d).log.xz

004152550.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152550.td-b3lyp_6-31+g(d).gjf (generated)

004152550.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152550.mol 004152550.PUBCHEM 004152550.mol (via Jmol)
004152562.b3lyp_6-31g(d).inp

004152562.b3lyp_6-31g(d).qchem.inp (generated)

004152562.b3lyp_6-31g(d).gjf (generated)

004152562.b3lyp_6-31g(d).firefly.inp (generated)

004152562.b3lyp_6-31g(d).smash.inp (generated)

004152562.b3lyp_6-31g(d).nwchem.inp (generated) 004152562.b3lyp_6-31g(d).log.xz 004152562.mol 004152562.PUBCHEM 004152562.mol (via Jmol)
004152570.b3lyp_6-31g(d).inp

004152570.b3lyp_6-31g(d).qchem.inp (generated)

004152570.b3lyp_6-31g(d).gjf (generated)

004152570.b3lyp_6-31g(d).firefly.inp (generated)

004152570.b3lyp_6-31g(d).smash.inp (generated)

004152570.b3lyp_6-31g(d).nwchem.inp (generated) 004152570.b3lyp_6-31g(d).log.xz 004152570.td-b3lyp_6-31g+(d).inp 004152570.td-b3lyp_6-31g+(d).log.xz

004152570.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152570.td-b3lyp_6-31+g(d).gjf (generated)

004152570.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152570.mol 004152570.PUBCHEM 004152570.mol (via Jmol)
004152600.b3lyp_6-31g(d).inp

004152600.b3lyp_6-31g(d).qchem.inp (generated)

004152600.b3lyp_6-31g(d).gjf (generated)

004152600.b3lyp_6-31g(d).firefly.inp (generated)

004152600.b3lyp_6-31g(d).smash.inp (generated)

004152600.b3lyp_6-31g(d).nwchem.inp (generated) 004152600.b3lyp_6-31g(d).log.xz 004152600.mol 004152600.PUBCHEM 004152600.mol (via Jmol)
004152608.b3lyp_6-31g(d).inp

004152608.b3lyp_6-31g(d).qchem.inp (generated)

004152608.b3lyp_6-31g(d).gjf (generated)

004152608.b3lyp_6-31g(d).firefly.inp (generated)

004152608.b3lyp_6-31g(d).smash.inp (generated)

004152608.b3lyp_6-31g(d).nwchem.inp (generated) 004152608.b3lyp_6-31g(d).log.xz 004152608.td-b3lyp_6-31g+(d).inp 004152608.td-b3lyp_6-31g+(d).log.xz

004152608.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152608.td-b3lyp_6-31+g(d).gjf (generated)

004152608.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152608.mol 004152608.PUBCHEM 004152608.mol (via Jmol)
004152629.b3lyp_6-31g(d).inp

004152629.b3lyp_6-31g(d).qchem.inp (generated)

004152629.b3lyp_6-31g(d).gjf (generated)

004152629.b3lyp_6-31g(d).firefly.inp (generated)

004152629.b3lyp_6-31g(d).smash.inp (generated)

004152629.b3lyp_6-31g(d).nwchem.inp (generated) 004152629.b3lyp_6-31g(d).log.xz 004152629.mol 004152629.PUBCHEM 004152629.mol (via Jmol)
004152637.b3lyp_6-31g(d).inp

004152637.b3lyp_6-31g(d).qchem.inp (generated)

004152637.b3lyp_6-31g(d).gjf (generated)

004152637.b3lyp_6-31g(d).firefly.inp (generated)

004152637.b3lyp_6-31g(d).smash.inp (generated)

004152637.b3lyp_6-31g(d).nwchem.inp (generated) 004152637.b3lyp_6-31g(d).log.xz 004152637.td-b3lyp_6-31g+(d).inp 004152637.td-b3lyp_6-31g+(d).log.xz

004152637.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152637.td-b3lyp_6-31+g(d).gjf (generated)

004152637.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152637.mol 004152637.PUBCHEM 004152637.mol (via Jmol)
004152694.b3lyp_6-31g(d).inp

004152694.b3lyp_6-31g(d).qchem.inp (generated)

004152694.b3lyp_6-31g(d).gjf (generated)

004152694.b3lyp_6-31g(d).firefly.inp (generated)

004152694.b3lyp_6-31g(d).smash.inp (generated)

004152694.b3lyp_6-31g(d).nwchem.inp (generated) 004152694.b3lyp_6-31g(d).log.xz 004152694.td-b3lyp_6-31g+(d).inp 004152694.td-b3lyp_6-31g+(d).log.xz

004152694.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152694.td-b3lyp_6-31+g(d).gjf (generated)

004152694.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152694.mol 004152694.PUBCHEM 004152694.mol (via Jmol)
004152698.b3lyp_6-31g(d).inp

004152698.b3lyp_6-31g(d).qchem.inp (generated)

004152698.b3lyp_6-31g(d).gjf (generated)

004152698.b3lyp_6-31g(d).firefly.inp (generated)

004152698.b3lyp_6-31g(d).smash.inp (generated)

004152698.b3lyp_6-31g(d).nwchem.inp (generated) 004152698.b3lyp_6-31g(d).log.xz 004152698.mol 004152698.PUBCHEM 004152698.mol (via Jmol)
004152740.b3lyp_6-31g(d).inp

004152740.b3lyp_6-31g(d).qchem.inp (generated)

004152740.b3lyp_6-31g(d).gjf (generated)

004152740.b3lyp_6-31g(d).firefly.inp (generated)

004152740.b3lyp_6-31g(d).smash.inp (generated)

004152740.b3lyp_6-31g(d).nwchem.inp (generated) 004152740.b3lyp_6-31g(d).log.xz 004152740.td-b3lyp_6-31g+(d).inp 004152740.td-b3lyp_6-31g+(d).log.xz

004152740.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152740.td-b3lyp_6-31+g(d).gjf (generated)

004152740.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152740.mol 004152740.PUBCHEM 004152740.mol (via Jmol)
004152741.b3lyp_6-31g(d).inp

004152741.b3lyp_6-31g(d).qchem.inp (generated)

004152741.b3lyp_6-31g(d).gjf (generated)

004152741.b3lyp_6-31g(d).firefly.inp (generated)

004152741.b3lyp_6-31g(d).smash.inp (generated)

004152741.b3lyp_6-31g(d).nwchem.inp (generated) 004152741.b3lyp_6-31g(d).log.xz 004152741.td-b3lyp_6-31g+(d).inp 004152741.td-b3lyp_6-31g+(d).log.xz

004152741.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152741.td-b3lyp_6-31+g(d).gjf (generated)

004152741.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152741.mol 004152741.PUBCHEM 004152741.mol (via Jmol)
004152746.b3lyp_6-31g(d).inp

004152746.b3lyp_6-31g(d).qchem.inp (generated)

004152746.b3lyp_6-31g(d).gjf (generated)

004152746.b3lyp_6-31g(d).firefly.inp (generated)

004152746.b3lyp_6-31g(d).smash.inp (generated)

004152746.b3lyp_6-31g(d).nwchem.inp (generated) 004152746.b3lyp_6-31g(d).log.xz 004152746.td-b3lyp_6-31g+(d).inp 004152746.td-b3lyp_6-31g+(d).log.xz

004152746.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152746.td-b3lyp_6-31+g(d).gjf (generated)

004152746.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152746.mol 004152746.PUBCHEM 004152746.mol (via Jmol)
004152786.b3lyp_6-31g(d).inp

004152786.b3lyp_6-31g(d).qchem.inp (generated)

004152786.b3lyp_6-31g(d).gjf (generated)

004152786.b3lyp_6-31g(d).firefly.inp (generated)

004152786.b3lyp_6-31g(d).smash.inp (generated)

004152786.b3lyp_6-31g(d).nwchem.inp (generated) 004152786.b3lyp_6-31g(d).log.xz 004152786.td-b3lyp_6-31g+(d).inp 004152786.td-b3lyp_6-31g+(d).log.xz

004152786.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152786.td-b3lyp_6-31+g(d).gjf (generated)

004152786.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152786.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152786.mol 004152786.PUBCHEM 004152786.mol (via Jmol)
004152789.b3lyp_6-31g(d).inp

004152789.b3lyp_6-31g(d).qchem.inp (generated)

004152789.b3lyp_6-31g(d).gjf (generated)

004152789.b3lyp_6-31g(d).firefly.inp (generated)

004152789.b3lyp_6-31g(d).smash.inp (generated)

004152789.b3lyp_6-31g(d).nwchem.inp (generated) 004152789.b3lyp_6-31g(d).log.xz 004152789.td-b3lyp_6-31g+(d).inp 004152789.td-b3lyp_6-31g+(d).log.xz

004152789.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152789.td-b3lyp_6-31+g(d).gjf (generated)

004152789.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152789.mol 004152789.PUBCHEM 004152789.mol (via Jmol)
004152851.b3lyp_6-31g(d).inp

004152851.b3lyp_6-31g(d).qchem.inp (generated)

004152851.b3lyp_6-31g(d).gjf (generated)

004152851.b3lyp_6-31g(d).firefly.inp (generated)

004152851.b3lyp_6-31g(d).smash.inp (generated)

004152851.b3lyp_6-31g(d).nwchem.inp (generated) 004152851.b3lyp_6-31g(d).log.xz 004152851.td-b3lyp_6-31g+(d).inp 004152851.td-b3lyp_6-31g+(d).log.xz

004152851.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152851.td-b3lyp_6-31+g(d).gjf (generated)

004152851.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152851.mol 004152851.PUBCHEM 004152851.mol (via Jmol)
004152868.b3lyp_6-31g(d).inp

004152868.b3lyp_6-31g(d).qchem.inp (generated)

004152868.b3lyp_6-31g(d).gjf (generated)

004152868.b3lyp_6-31g(d).firefly.inp (generated)

004152868.b3lyp_6-31g(d).smash.inp (generated)

004152868.b3lyp_6-31g(d).nwchem.inp (generated) 004152868.b3lyp_6-31g(d).log.xz 004152868.td-b3lyp_6-31g+(d).inp 004152868.td-b3lyp_6-31g+(d).log.xz

004152868.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152868.td-b3lyp_6-31+g(d).gjf (generated)

004152868.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152868.mol 004152868.PUBCHEM 004152868.mol (via Jmol)
004152891.b3lyp_6-31g(d).inp

004152891.b3lyp_6-31g(d).qchem.inp (generated)

004152891.b3lyp_6-31g(d).gjf (generated)

004152891.b3lyp_6-31g(d).firefly.inp (generated)

004152891.b3lyp_6-31g(d).smash.inp (generated)

004152891.b3lyp_6-31g(d).nwchem.inp (generated) 004152891.b3lyp_6-31g(d).log.xz 004152891.td-b3lyp_6-31g+(d).inp 004152891.td-b3lyp_6-31g+(d).log.xz

004152891.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152891.td-b3lyp_6-31+g(d).gjf (generated)

004152891.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152891.mol 004152891.PUBCHEM 004152891.mol (via Jmol)
004152894.b3lyp_6-31g(d).inp

004152894.b3lyp_6-31g(d).qchem.inp (generated)

004152894.b3lyp_6-31g(d).gjf (generated)

004152894.b3lyp_6-31g(d).firefly.inp (generated)

004152894.b3lyp_6-31g(d).smash.inp (generated)

004152894.b3lyp_6-31g(d).nwchem.inp (generated) 004152894.b3lyp_6-31g(d).log.xz 004152894.td-b3lyp_6-31g+(d).inp 004152894.td-b3lyp_6-31g+(d).log.xz

004152894.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152894.td-b3lyp_6-31+g(d).gjf (generated)

004152894.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152894.mol 004152894.PUBCHEM 004152894.mol (via Jmol)
004152954.b3lyp_6-31g(d).inp

004152954.b3lyp_6-31g(d).qchem.inp (generated)

004152954.b3lyp_6-31g(d).gjf (generated)

004152954.b3lyp_6-31g(d).firefly.inp (generated)

004152954.b3lyp_6-31g(d).smash.inp (generated)

004152954.b3lyp_6-31g(d).nwchem.inp (generated) 004152954.b3lyp_6-31g(d).log.xz 004152954.td-b3lyp_6-31g+(d).inp 004152954.td-b3lyp_6-31g+(d).log.xz

004152954.td-b3lyp_6-31+g(d).qchem.inp (generated)

004152954.td-b3lyp_6-31+g(d).gjf (generated)

004152954.td-b3lyp_6-31+g(d).firefly.inp (generated)

004152954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004152954.mol 004152954.PUBCHEM 004152954.mol (via Jmol)
004153043.b3lyp_6-31g(d).inp

004153043.b3lyp_6-31g(d).qchem.inp (generated)

004153043.b3lyp_6-31g(d).gjf (generated)

004153043.b3lyp_6-31g(d).firefly.inp (generated)

004153043.b3lyp_6-31g(d).smash.inp (generated)

004153043.b3lyp_6-31g(d).nwchem.inp (generated) 004153043.b3lyp_6-31g(d).log.xz 004153043.mol 004153043.PUBCHEM 004153043.mol (via Jmol)
004153064.b3lyp_6-31g(d).inp

004153064.b3lyp_6-31g(d).qchem.inp (generated)

004153064.b3lyp_6-31g(d).gjf (generated)

004153064.b3lyp_6-31g(d).firefly.inp (generated)

004153064.b3lyp_6-31g(d).smash.inp (generated)

004153064.b3lyp_6-31g(d).nwchem.inp (generated) 004153064.b3lyp_6-31g(d).log.xz 004153064.td-b3lyp_6-31g+(d).inp 004153064.td-b3lyp_6-31g+(d).log.xz

004153064.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153064.td-b3lyp_6-31+g(d).gjf (generated)

004153064.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153064.mol 004153064.PUBCHEM 004153064.mol (via Jmol)
004153069.b3lyp_6-31g(d).inp

004153069.b3lyp_6-31g(d).qchem.inp (generated)

004153069.b3lyp_6-31g(d).gjf (generated)

004153069.b3lyp_6-31g(d).firefly.inp (generated)

004153069.b3lyp_6-31g(d).smash.inp (generated)

004153069.b3lyp_6-31g(d).nwchem.inp (generated) 004153069.b3lyp_6-31g(d).log.xz 004153069.td-b3lyp_6-31g+(d).inp 004153069.td-b3lyp_6-31g+(d).log.xz

004153069.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153069.td-b3lyp_6-31+g(d).gjf (generated)

004153069.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153069.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153069.mol 004153069.PUBCHEM 004153069.mol (via Jmol)
004153080.b3lyp_6-31g(d).inp

004153080.b3lyp_6-31g(d).qchem.inp (generated)

004153080.b3lyp_6-31g(d).gjf (generated)

004153080.b3lyp_6-31g(d).firefly.inp (generated)

004153080.b3lyp_6-31g(d).smash.inp (generated)

004153080.b3lyp_6-31g(d).nwchem.inp (generated) 004153080.b3lyp_6-31g(d).log.xz 004153080.mol 004153080.PUBCHEM 004153080.mol (via Jmol)
004153136.b3lyp_6-31g(d).inp

004153136.b3lyp_6-31g(d).qchem.inp (generated)

004153136.b3lyp_6-31g(d).gjf (generated)

004153136.b3lyp_6-31g(d).firefly.inp (generated)

004153136.b3lyp_6-31g(d).smash.inp (generated)

004153136.b3lyp_6-31g(d).nwchem.inp (generated) 004153136.b3lyp_6-31g(d).log.xz 004153136.td-b3lyp_6-31g+(d).inp 004153136.td-b3lyp_6-31g+(d).log.xz

004153136.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153136.td-b3lyp_6-31+g(d).gjf (generated)

004153136.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153136.mol 004153136.PUBCHEM 004153136.mol (via Jmol)
004153140.b3lyp_6-31g(d).inp

004153140.b3lyp_6-31g(d).qchem.inp (generated)

004153140.b3lyp_6-31g(d).gjf (generated)

004153140.b3lyp_6-31g(d).firefly.inp (generated)

004153140.b3lyp_6-31g(d).smash.inp (generated)

004153140.b3lyp_6-31g(d).nwchem.inp (generated) 004153140.b3lyp_6-31g(d).log.xz 004153140.mol 004153140.PUBCHEM 004153140.mol (via Jmol)
004153144.b3lyp_6-31g(d).inp

004153144.b3lyp_6-31g(d).qchem.inp (generated)

004153144.b3lyp_6-31g(d).gjf (generated)

004153144.b3lyp_6-31g(d).firefly.inp (generated)

004153144.b3lyp_6-31g(d).smash.inp (generated)

004153144.b3lyp_6-31g(d).nwchem.inp (generated) 004153144.b3lyp_6-31g(d).log.xz 004153144.td-b3lyp_6-31g+(d).inp 004153144.td-b3lyp_6-31g+(d).log.xz

004153144.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153144.td-b3lyp_6-31+g(d).gjf (generated)

004153144.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153144.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153144.mol 004153144.PUBCHEM 004153144.mol (via Jmol)
004153165.b3lyp_6-31g(d).inp

004153165.b3lyp_6-31g(d).qchem.inp (generated)

004153165.b3lyp_6-31g(d).gjf (generated)

004153165.b3lyp_6-31g(d).firefly.inp (generated)

004153165.b3lyp_6-31g(d).smash.inp (generated)

004153165.b3lyp_6-31g(d).nwchem.inp (generated) 004153165.b3lyp_6-31g(d).log.xz 004153165.mol 004153165.PUBCHEM 004153165.mol (via Jmol)
004153218.b3lyp_6-31g(d).inp

004153218.b3lyp_6-31g(d).qchem.inp (generated)

004153218.b3lyp_6-31g(d).gjf (generated)

004153218.b3lyp_6-31g(d).firefly.inp (generated)

004153218.b3lyp_6-31g(d).smash.inp (generated)

004153218.b3lyp_6-31g(d).nwchem.inp (generated) 004153218.b3lyp_6-31g(d).log.xz 004153218.td-b3lyp_6-31g+(d).inp 004153218.td-b3lyp_6-31g+(d).log.xz

004153218.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153218.td-b3lyp_6-31+g(d).gjf (generated)

004153218.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153218.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153218.mol 004153218.PUBCHEM 004153218.mol (via Jmol)
004153226.b3lyp_6-31g(d).inp

004153226.b3lyp_6-31g(d).qchem.inp (generated)

004153226.b3lyp_6-31g(d).gjf (generated)

004153226.b3lyp_6-31g(d).firefly.inp (generated)

004153226.b3lyp_6-31g(d).smash.inp (generated)

004153226.b3lyp_6-31g(d).nwchem.inp (generated) 004153226.b3lyp_6-31g(d).log.xz 004153226.td-b3lyp_6-31g+(d).inp 004153226.td-b3lyp_6-31g+(d).log.xz

004153226.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153226.td-b3lyp_6-31+g(d).gjf (generated)

004153226.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153226.mol 004153226.PUBCHEM 004153226.mol (via Jmol)
004153227.b3lyp_6-31g(d).inp

004153227.b3lyp_6-31g(d).qchem.inp (generated)

004153227.b3lyp_6-31g(d).gjf (generated)

004153227.b3lyp_6-31g(d).firefly.inp (generated)

004153227.b3lyp_6-31g(d).smash.inp (generated)

004153227.b3lyp_6-31g(d).nwchem.inp (generated) 004153227.b3lyp_6-31g(d).log.xz 004153227.td-b3lyp_6-31g+(d).inp 004153227.td-b3lyp_6-31g+(d).log.xz

004153227.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153227.td-b3lyp_6-31+g(d).gjf (generated)

004153227.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153227.mol 004153227.PUBCHEM 004153227.mol (via Jmol)
004153256.b3lyp_6-31g(d).inp

004153256.b3lyp_6-31g(d).qchem.inp (generated)

004153256.b3lyp_6-31g(d).gjf (generated)

004153256.b3lyp_6-31g(d).firefly.inp (generated)

004153256.b3lyp_6-31g(d).smash.inp (generated)

004153256.b3lyp_6-31g(d).nwchem.inp (generated) 004153256.b3lyp_6-31g(d).log.xz 004153256.td-b3lyp_6-31g+(d).inp 004153256.td-b3lyp_6-31g+(d).log.xz

004153256.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153256.td-b3lyp_6-31+g(d).gjf (generated)

004153256.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153256.mol 004153256.PUBCHEM 004153256.mol (via Jmol)
004153269.b3lyp_6-31g(d).inp

004153269.b3lyp_6-31g(d).qchem.inp (generated)

004153269.b3lyp_6-31g(d).gjf (generated)

004153269.b3lyp_6-31g(d).firefly.inp (generated)

004153269.b3lyp_6-31g(d).smash.inp (generated)

004153269.b3lyp_6-31g(d).nwchem.inp (generated) 004153269.b3lyp_6-31g(d).log.xz 004153269.td-b3lyp_6-31g+(d).inp 004153269.td-b3lyp_6-31g+(d).log.xz

004153269.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153269.td-b3lyp_6-31+g(d).gjf (generated)

004153269.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153269.mol 004153269.PUBCHEM 004153269.mol (via Jmol)
004153270.b3lyp_6-31g(d).inp

004153270.b3lyp_6-31g(d).qchem.inp (generated)

004153270.b3lyp_6-31g(d).gjf (generated)

004153270.b3lyp_6-31g(d).firefly.inp (generated)

004153270.b3lyp_6-31g(d).smash.inp (generated)

004153270.b3lyp_6-31g(d).nwchem.inp (generated) 004153270.b3lyp_6-31g(d).log.xz 004153270.td-b3lyp_6-31g+(d).inp 004153270.td-b3lyp_6-31g+(d).log.xz

004153270.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153270.td-b3lyp_6-31+g(d).gjf (generated)

004153270.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153270.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153270.mol 004153270.PUBCHEM 004153270.mol (via Jmol)
004153324.b3lyp_6-31g(d).inp

004153324.b3lyp_6-31g(d).qchem.inp (generated)

004153324.b3lyp_6-31g(d).gjf (generated)

004153324.b3lyp_6-31g(d).firefly.inp (generated)

004153324.b3lyp_6-31g(d).smash.inp (generated)

004153324.b3lyp_6-31g(d).nwchem.inp (generated) 004153324.b3lyp_6-31g(d).log.xz 004153324.td-b3lyp_6-31g+(d).inp 004153324.td-b3lyp_6-31g+(d).log.xz

004153324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153324.td-b3lyp_6-31+g(d).gjf (generated)

004153324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153324.mol 004153324.PUBCHEM 004153324.mol (via Jmol)
004153325.b3lyp_6-31g(d).inp

004153325.b3lyp_6-31g(d).qchem.inp (generated)

004153325.b3lyp_6-31g(d).gjf (generated)

004153325.b3lyp_6-31g(d).firefly.inp (generated)

004153325.b3lyp_6-31g(d).smash.inp (generated)

004153325.b3lyp_6-31g(d).nwchem.inp (generated) 004153325.b3lyp_6-31g(d).log.xz 004153325.td-b3lyp_6-31g+(d).inp 004153325.td-b3lyp_6-31g+(d).log.xz

004153325.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153325.td-b3lyp_6-31+g(d).gjf (generated)

004153325.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153325.mol 004153325.PUBCHEM 004153325.mol (via Jmol)
004153338.b3lyp_6-31g(d).inp

004153338.b3lyp_6-31g(d).qchem.inp (generated)

004153338.b3lyp_6-31g(d).gjf (generated)

004153338.b3lyp_6-31g(d).firefly.inp (generated)

004153338.b3lyp_6-31g(d).smash.inp (generated)

004153338.b3lyp_6-31g(d).nwchem.inp (generated) 004153338.b3lyp_6-31g(d).log.xz 004153338.mol 004153338.PUBCHEM 004153338.mol (via Jmol)
004153345.b3lyp_6-31g(d).inp

004153345.b3lyp_6-31g(d).qchem.inp (generated)

004153345.b3lyp_6-31g(d).gjf (generated)

004153345.b3lyp_6-31g(d).firefly.inp (generated)

004153345.b3lyp_6-31g(d).smash.inp (generated)

004153345.b3lyp_6-31g(d).nwchem.inp (generated) 004153345.b3lyp_6-31g(d).log.xz 004153345.mol 004153345.PUBCHEM 004153345.mol (via Jmol)
004153346.b3lyp_6-31g(d).inp

004153346.b3lyp_6-31g(d).qchem.inp (generated)

004153346.b3lyp_6-31g(d).gjf (generated)

004153346.b3lyp_6-31g(d).firefly.inp (generated)

004153346.b3lyp_6-31g(d).smash.inp (generated)

004153346.b3lyp_6-31g(d).nwchem.inp (generated) 004153346.b3lyp_6-31g(d).log.xz 004153346.td-b3lyp_6-31g+(d).inp 004153346.td-b3lyp_6-31g+(d).log.xz

004153346.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153346.td-b3lyp_6-31+g(d).gjf (generated)

004153346.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153346.mol 004153346.PUBCHEM 004153346.mol (via Jmol)
004153361.b3lyp_6-31g(d).inp

004153361.b3lyp_6-31g(d).qchem.inp (generated)

004153361.b3lyp_6-31g(d).gjf (generated)

004153361.b3lyp_6-31g(d).firefly.inp (generated)

004153361.b3lyp_6-31g(d).smash.inp (generated)

004153361.b3lyp_6-31g(d).nwchem.inp (generated) 004153361.b3lyp_6-31g(d).log.xz 004153361.td-b3lyp_6-31g+(d).inp 004153361.td-b3lyp_6-31g+(d).log.xz

004153361.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153361.td-b3lyp_6-31+g(d).gjf (generated)

004153361.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153361.mol 004153361.PUBCHEM 004153361.mol (via Jmol)
004153364.b3lyp_6-31g(d).inp

004153364.b3lyp_6-31g(d).qchem.inp (generated)

004153364.b3lyp_6-31g(d).gjf (generated)

004153364.b3lyp_6-31g(d).firefly.inp (generated)

004153364.b3lyp_6-31g(d).smash.inp (generated)

004153364.b3lyp_6-31g(d).nwchem.inp (generated) 004153364.b3lyp_6-31g(d).log.xz 004153364.td-b3lyp_6-31g+(d).inp 004153364.td-b3lyp_6-31g+(d).log.xz

004153364.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153364.td-b3lyp_6-31+g(d).gjf (generated)

004153364.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153364.mol 004153364.PUBCHEM 004153364.mol (via Jmol)
004153371.b3lyp_6-31g(d).inp

004153371.b3lyp_6-31g(d).qchem.inp (generated)

004153371.b3lyp_6-31g(d).gjf (generated)

004153371.b3lyp_6-31g(d).firefly.inp (generated)

004153371.b3lyp_6-31g(d).smash.inp (generated)

004153371.b3lyp_6-31g(d).nwchem.inp (generated) 004153371.b3lyp_6-31g(d).log.xz 004153371.td-b3lyp_6-31g+(d).inp 004153371.td-b3lyp_6-31g+(d).log.xz

004153371.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153371.td-b3lyp_6-31+g(d).gjf (generated)

004153371.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153371.mol 004153371.PUBCHEM 004153371.mol (via Jmol)
004153372.b3lyp_6-31g(d).inp

004153372.b3lyp_6-31g(d).qchem.inp (generated)

004153372.b3lyp_6-31g(d).gjf (generated)

004153372.b3lyp_6-31g(d).firefly.inp (generated)

004153372.b3lyp_6-31g(d).smash.inp (generated)

004153372.b3lyp_6-31g(d).nwchem.inp (generated) 004153372.b3lyp_6-31g(d).log.xz 004153372.td-b3lyp_6-31g+(d).inp 004153372.td-b3lyp_6-31g+(d).log.xz

004153372.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153372.td-b3lyp_6-31+g(d).gjf (generated)

004153372.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153372.mol 004153372.PUBCHEM 004153372.mol (via Jmol)
004153378.b3lyp_6-31g(d).inp

004153378.b3lyp_6-31g(d).qchem.inp (generated)

004153378.b3lyp_6-31g(d).gjf (generated)

004153378.b3lyp_6-31g(d).firefly.inp (generated)

004153378.b3lyp_6-31g(d).smash.inp (generated)

004153378.b3lyp_6-31g(d).nwchem.inp (generated) 004153378.b3lyp_6-31g(d).log.xz 004153378.mol 004153378.PUBCHEM 004153378.mol (via Jmol)
004153392.b3lyp_6-31g(d).inp

004153392.b3lyp_6-31g(d).qchem.inp (generated)

004153392.b3lyp_6-31g(d).gjf (generated)

004153392.b3lyp_6-31g(d).firefly.inp (generated)

004153392.b3lyp_6-31g(d).smash.inp (generated)

004153392.b3lyp_6-31g(d).nwchem.inp (generated) 004153392.b3lyp_6-31g(d).log.xz 004153392.td-b3lyp_6-31g+(d).inp 004153392.td-b3lyp_6-31g+(d).log.xz

004153392.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153392.td-b3lyp_6-31+g(d).gjf (generated)

004153392.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153392.mol 004153392.PUBCHEM 004153392.mol (via Jmol)
004153393.b3lyp_6-31g(d).inp

004153393.b3lyp_6-31g(d).qchem.inp (generated)

004153393.b3lyp_6-31g(d).gjf (generated)

004153393.b3lyp_6-31g(d).firefly.inp (generated)

004153393.b3lyp_6-31g(d).smash.inp (generated)

004153393.b3lyp_6-31g(d).nwchem.inp (generated) 004153393.b3lyp_6-31g(d).log.xz 004153393.td-b3lyp_6-31g+(d).inp 004153393.td-b3lyp_6-31g+(d).log.xz

004153393.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153393.td-b3lyp_6-31+g(d).gjf (generated)

004153393.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153393.mol 004153393.PUBCHEM 004153393.mol (via Jmol)
004153394.b3lyp_6-31g(d).inp

004153394.b3lyp_6-31g(d).qchem.inp (generated)

004153394.b3lyp_6-31g(d).gjf (generated)

004153394.b3lyp_6-31g(d).firefly.inp (generated)

004153394.b3lyp_6-31g(d).smash.inp (generated)

004153394.b3lyp_6-31g(d).nwchem.inp (generated) 004153394.b3lyp_6-31g(d).log.xz 004153394.td-b3lyp_6-31g+(d).inp 004153394.td-b3lyp_6-31g+(d).log.xz

004153394.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153394.td-b3lyp_6-31+g(d).gjf (generated)

004153394.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153394.mol 004153394.PUBCHEM 004153394.mol (via Jmol)
004153395.b3lyp_6-31g(d).inp

004153395.b3lyp_6-31g(d).qchem.inp (generated)

004153395.b3lyp_6-31g(d).gjf (generated)

004153395.b3lyp_6-31g(d).firefly.inp (generated)

004153395.b3lyp_6-31g(d).smash.inp (generated)

004153395.b3lyp_6-31g(d).nwchem.inp (generated) 004153395.b3lyp_6-31g(d).log.xz 004153395.td-b3lyp_6-31g+(d).inp 004153395.td-b3lyp_6-31g+(d).log.xz

004153395.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153395.td-b3lyp_6-31+g(d).gjf (generated)

004153395.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153395.mol 004153395.PUBCHEM 004153395.mol (via Jmol)
004153396.b3lyp_6-31g(d).inp

004153396.b3lyp_6-31g(d).qchem.inp (generated)

004153396.b3lyp_6-31g(d).gjf (generated)

004153396.b3lyp_6-31g(d).firefly.inp (generated)

004153396.b3lyp_6-31g(d).smash.inp (generated)

004153396.b3lyp_6-31g(d).nwchem.inp (generated) 004153396.b3lyp_6-31g(d).log.xz 004153396.td-b3lyp_6-31g+(d).inp 004153396.td-b3lyp_6-31g+(d).log.xz

004153396.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153396.td-b3lyp_6-31+g(d).gjf (generated)

004153396.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153396.mol 004153396.PUBCHEM 004153396.mol (via Jmol)
004153424.b3lyp_6-31g(d).inp

004153424.b3lyp_6-31g(d).qchem.inp (generated)

004153424.b3lyp_6-31g(d).gjf (generated)

004153424.b3lyp_6-31g(d).firefly.inp (generated)

004153424.b3lyp_6-31g(d).smash.inp (generated)

004153424.b3lyp_6-31g(d).nwchem.inp (generated) 004153424.b3lyp_6-31g(d).log.xz 004153424.td-b3lyp_6-31g+(d).inp 004153424.td-b3lyp_6-31g+(d).log.xz

004153424.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153424.td-b3lyp_6-31+g(d).gjf (generated)

004153424.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153424.mol 004153424.PUBCHEM 004153424.mol (via Jmol)
004153447.b3lyp_6-31g(d).inp

004153447.b3lyp_6-31g(d).qchem.inp (generated)

004153447.b3lyp_6-31g(d).gjf (generated)

004153447.b3lyp_6-31g(d).firefly.inp (generated)

004153447.b3lyp_6-31g(d).smash.inp (generated)

004153447.b3lyp_6-31g(d).nwchem.inp (generated) 004153447.b3lyp_6-31g(d).log.xz 004153447.td-b3lyp_6-31g+(d).inp 004153447.td-b3lyp_6-31g+(d).log.xz

004153447.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153447.td-b3lyp_6-31+g(d).gjf (generated)

004153447.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153447.mol 004153447.PUBCHEM 004153447.mol (via Jmol)
004153452.b3lyp_6-31g(d).inp

004153452.b3lyp_6-31g(d).qchem.inp (generated)

004153452.b3lyp_6-31g(d).gjf (generated)

004153452.b3lyp_6-31g(d).firefly.inp (generated)

004153452.b3lyp_6-31g(d).smash.inp (generated)

004153452.b3lyp_6-31g(d).nwchem.inp (generated) 004153452.b3lyp_6-31g(d).log.xz 004153452.mol 004153452.PUBCHEM 004153452.mol (via Jmol)
004153467.b3lyp_6-31g(d).inp

004153467.b3lyp_6-31g(d).qchem.inp (generated)

004153467.b3lyp_6-31g(d).gjf (generated)

004153467.b3lyp_6-31g(d).firefly.inp (generated)

004153467.b3lyp_6-31g(d).smash.inp (generated)

004153467.b3lyp_6-31g(d).nwchem.inp (generated) 004153467.b3lyp_6-31g(d).log.xz 004153467.td-b3lyp_6-31g+(d).inp 004153467.td-b3lyp_6-31g+(d).log.xz

004153467.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153467.td-b3lyp_6-31+g(d).gjf (generated)

004153467.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153467.mol 004153467.PUBCHEM 004153467.mol (via Jmol)
004153551.b3lyp_6-31g(d).inp

004153551.b3lyp_6-31g(d).qchem.inp (generated)

004153551.b3lyp_6-31g(d).gjf (generated)

004153551.b3lyp_6-31g(d).firefly.inp (generated)

004153551.b3lyp_6-31g(d).smash.inp (generated)

004153551.b3lyp_6-31g(d).nwchem.inp (generated) 004153551.b3lyp_6-31g(d).log.xz 004153551.mol 004153551.PUBCHEM 004153551.mol (via Jmol)
004153577.b3lyp_6-31g(d).inp

004153577.b3lyp_6-31g(d).qchem.inp (generated)

004153577.b3lyp_6-31g(d).gjf (generated)

004153577.b3lyp_6-31g(d).firefly.inp (generated)

004153577.b3lyp_6-31g(d).smash.inp (generated)

004153577.b3lyp_6-31g(d).nwchem.inp (generated) 004153577.b3lyp_6-31g(d).log.xz 004153577.td-b3lyp_6-31g+(d).inp 004153577.td-b3lyp_6-31g+(d).log.xz

004153577.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153577.td-b3lyp_6-31+g(d).gjf (generated)

004153577.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153577.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153577.mol 004153577.PUBCHEM 004153577.mol (via Jmol)
004153653.b3lyp_6-31g(d).inp

004153653.b3lyp_6-31g(d).qchem.inp (generated)

004153653.b3lyp_6-31g(d).gjf (generated)

004153653.b3lyp_6-31g(d).firefly.inp (generated)

004153653.b3lyp_6-31g(d).smash.inp (generated)

004153653.b3lyp_6-31g(d).nwchem.inp (generated) 004153653.b3lyp_6-31g(d).log.xz 004153653.td-b3lyp_6-31g+(d).inp 004153653.td-b3lyp_6-31g+(d).log.xz

004153653.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153653.td-b3lyp_6-31+g(d).gjf (generated)

004153653.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153653.mol 004153653.PUBCHEM 004153653.mol (via Jmol)
004153737.b3lyp_6-31g(d).inp

004153737.b3lyp_6-31g(d).qchem.inp (generated)

004153737.b3lyp_6-31g(d).gjf (generated)

004153737.b3lyp_6-31g(d).firefly.inp (generated)

004153737.b3lyp_6-31g(d).smash.inp (generated)

004153737.b3lyp_6-31g(d).nwchem.inp (generated) 004153737.b3lyp_6-31g(d).log.xz 004153737.td-b3lyp_6-31g+(d).inp 004153737.td-b3lyp_6-31g+(d).log.xz

004153737.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153737.td-b3lyp_6-31+g(d).gjf (generated)

004153737.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153737.mol 004153737.PUBCHEM 004153737.mol (via Jmol)
004153764.b3lyp_6-31g(d).inp

004153764.b3lyp_6-31g(d).qchem.inp (generated)

004153764.b3lyp_6-31g(d).gjf (generated)

004153764.b3lyp_6-31g(d).firefly.inp (generated)

004153764.b3lyp_6-31g(d).smash.inp (generated)

004153764.b3lyp_6-31g(d).nwchem.inp (generated) 004153764.b3lyp_6-31g(d).log.xz 004153764.td-b3lyp_6-31g+(d).inp 004153764.td-b3lyp_6-31g+(d).log.xz

004153764.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153764.td-b3lyp_6-31+g(d).gjf (generated)

004153764.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153764.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153764.mol 004153764.PUBCHEM 004153764.mol (via Jmol)
004153776.b3lyp_6-31g(d).inp

004153776.b3lyp_6-31g(d).qchem.inp (generated)

004153776.b3lyp_6-31g(d).gjf (generated)

004153776.b3lyp_6-31g(d).firefly.inp (generated)

004153776.b3lyp_6-31g(d).smash.inp (generated)

004153776.b3lyp_6-31g(d).nwchem.inp (generated) 004153776.b3lyp_6-31g(d).log.xz 004153776.td-b3lyp_6-31g+(d).inp 004153776.td-b3lyp_6-31g+(d).log.xz

004153776.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153776.td-b3lyp_6-31+g(d).gjf (generated)

004153776.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153776.mol 004153776.PUBCHEM 004153776.mol (via Jmol)
004153777.b3lyp_6-31g(d).inp

004153777.b3lyp_6-31g(d).qchem.inp (generated)

004153777.b3lyp_6-31g(d).gjf (generated)

004153777.b3lyp_6-31g(d).firefly.inp (generated)

004153777.b3lyp_6-31g(d).smash.inp (generated)

004153777.b3lyp_6-31g(d).nwchem.inp (generated) 004153777.b3lyp_6-31g(d).log.xz 004153777.td-b3lyp_6-31g+(d).inp 004153777.td-b3lyp_6-31g+(d).log.xz

004153777.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153777.td-b3lyp_6-31+g(d).gjf (generated)

004153777.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153777.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153777.mol 004153777.PUBCHEM 004153777.mol (via Jmol)
004153797.b3lyp_6-31g(d).inp

004153797.b3lyp_6-31g(d).qchem.inp (generated)

004153797.b3lyp_6-31g(d).gjf (generated)

004153797.b3lyp_6-31g(d).firefly.inp (generated)

004153797.b3lyp_6-31g(d).smash.inp (generated)

004153797.b3lyp_6-31g(d).nwchem.inp (generated) 004153797.b3lyp_6-31g(d).log.xz 004153797.td-b3lyp_6-31g+(d).inp 004153797.td-b3lyp_6-31g+(d).log.xz

004153797.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153797.td-b3lyp_6-31+g(d).gjf (generated)

004153797.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153797.mol 004153797.PUBCHEM 004153797.mol (via Jmol)
004153846.b3lyp_6-31g(d).inp

004153846.b3lyp_6-31g(d).qchem.inp (generated)

004153846.b3lyp_6-31g(d).gjf (generated)

004153846.b3lyp_6-31g(d).firefly.inp (generated)

004153846.b3lyp_6-31g(d).smash.inp (generated)

004153846.b3lyp_6-31g(d).nwchem.inp (generated) 004153846.b3lyp_6-31g(d).log.xz 004153846.td-b3lyp_6-31g+(d).inp 004153846.td-b3lyp_6-31g+(d).log.xz

004153846.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153846.td-b3lyp_6-31+g(d).gjf (generated)

004153846.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153846.mol 004153846.PUBCHEM 004153846.mol (via Jmol)
004153853.b3lyp_6-31g(d).inp

004153853.b3lyp_6-31g(d).qchem.inp (generated)

004153853.b3lyp_6-31g(d).gjf (generated)

004153853.b3lyp_6-31g(d).firefly.inp (generated)

004153853.b3lyp_6-31g(d).smash.inp (generated)

004153853.b3lyp_6-31g(d).nwchem.inp (generated) 004153853.b3lyp_6-31g(d).log.xz 004153853.mol 004153853.PUBCHEM 004153853.mol (via Jmol)
004153905.b3lyp_6-31g(d).inp

004153905.b3lyp_6-31g(d).qchem.inp (generated)

004153905.b3lyp_6-31g(d).gjf (generated)

004153905.b3lyp_6-31g(d).firefly.inp (generated)

004153905.b3lyp_6-31g(d).smash.inp (generated)

004153905.b3lyp_6-31g(d).nwchem.inp (generated) 004153905.b3lyp_6-31g(d).log.xz 004153905.td-b3lyp_6-31g+(d).inp 004153905.td-b3lyp_6-31g+(d).log.xz

004153905.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153905.td-b3lyp_6-31+g(d).gjf (generated)

004153905.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153905.mol 004153905.PUBCHEM 004153905.mol (via Jmol)
004153941.b3lyp_6-31g(d).inp

004153941.b3lyp_6-31g(d).qchem.inp (generated)

004153941.b3lyp_6-31g(d).gjf (generated)

004153941.b3lyp_6-31g(d).firefly.inp (generated)

004153941.b3lyp_6-31g(d).smash.inp (generated)

004153941.b3lyp_6-31g(d).nwchem.inp (generated) 004153941.b3lyp_6-31g(d).log.xz 004153941.td-b3lyp_6-31g+(d).inp 004153941.td-b3lyp_6-31g+(d).log.xz

004153941.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153941.td-b3lyp_6-31+g(d).gjf (generated)

004153941.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153941.mol 004153941.PUBCHEM 004153941.mol (via Jmol)
004153962.b3lyp_6-31g(d).inp

004153962.b3lyp_6-31g(d).qchem.inp (generated)

004153962.b3lyp_6-31g(d).gjf (generated)

004153962.b3lyp_6-31g(d).firefly.inp (generated)

004153962.b3lyp_6-31g(d).smash.inp (generated)

004153962.b3lyp_6-31g(d).nwchem.inp (generated) 004153962.b3lyp_6-31g(d).log.xz 004153962.td-b3lyp_6-31g+(d).inp 004153962.td-b3lyp_6-31g+(d).log.xz

004153962.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153962.td-b3lyp_6-31+g(d).gjf (generated)

004153962.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153962.mol 004153962.PUBCHEM 004153962.mol (via Jmol)
004153980.b3lyp_6-31g(d).inp

004153980.b3lyp_6-31g(d).qchem.inp (generated)

004153980.b3lyp_6-31g(d).gjf (generated)

004153980.b3lyp_6-31g(d).firefly.inp (generated)

004153980.b3lyp_6-31g(d).smash.inp (generated)

004153980.b3lyp_6-31g(d).nwchem.inp (generated) 004153980.b3lyp_6-31g(d).log.xz 004153980.td-b3lyp_6-31g+(d).inp 004153980.td-b3lyp_6-31g+(d).log.xz

004153980.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153980.td-b3lyp_6-31+g(d).gjf (generated)

004153980.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153980.mol 004153980.PUBCHEM 004153980.mol (via Jmol)
004153991.b3lyp_6-31g(d).inp

004153991.b3lyp_6-31g(d).qchem.inp (generated)

004153991.b3lyp_6-31g(d).gjf (generated)

004153991.b3lyp_6-31g(d).firefly.inp (generated)

004153991.b3lyp_6-31g(d).smash.inp (generated)

004153991.b3lyp_6-31g(d).nwchem.inp (generated) 004153991.b3lyp_6-31g(d).log.xz 004153991.td-b3lyp_6-31g+(d).inp 004153991.td-b3lyp_6-31g+(d).log.xz

004153991.td-b3lyp_6-31+g(d).qchem.inp (generated)

004153991.td-b3lyp_6-31+g(d).gjf (generated)

004153991.td-b3lyp_6-31+g(d).firefly.inp (generated)

004153991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004153991.mol 004153991.PUBCHEM 004153991.mol (via Jmol)
004154039.b3lyp_6-31g(d).inp

004154039.b3lyp_6-31g(d).qchem.inp (generated)

004154039.b3lyp_6-31g(d).gjf (generated)

004154039.b3lyp_6-31g(d).firefly.inp (generated)

004154039.b3lyp_6-31g(d).smash.inp (generated)

004154039.b3lyp_6-31g(d).nwchem.inp (generated) 004154039.b3lyp_6-31g(d).log.xz 004154039.td-b3lyp_6-31g+(d).inp 004154039.td-b3lyp_6-31g+(d).log.xz

004154039.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154039.td-b3lyp_6-31+g(d).gjf (generated)

004154039.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154039.mol 004154039.PUBCHEM 004154039.mol (via Jmol)
004154053.b3lyp_6-31g(d).inp

004154053.b3lyp_6-31g(d).qchem.inp (generated)

004154053.b3lyp_6-31g(d).gjf (generated)

004154053.b3lyp_6-31g(d).firefly.inp (generated)

004154053.b3lyp_6-31g(d).smash.inp (generated)

004154053.b3lyp_6-31g(d).nwchem.inp (generated) 004154053.b3lyp_6-31g(d).log.xz 004154053.td-b3lyp_6-31g+(d).inp 004154053.td-b3lyp_6-31g+(d).log.xz

004154053.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154053.td-b3lyp_6-31+g(d).gjf (generated)

004154053.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154053.mol 004154053.PUBCHEM 004154053.mol (via Jmol)
004154060.b3lyp_6-31g(d).inp

004154060.b3lyp_6-31g(d).qchem.inp (generated)

004154060.b3lyp_6-31g(d).gjf (generated)

004154060.b3lyp_6-31g(d).firefly.inp (generated)

004154060.b3lyp_6-31g(d).smash.inp (generated)

004154060.b3lyp_6-31g(d).nwchem.inp (generated) 004154060.b3lyp_6-31g(d).log.xz 004154060.td-b3lyp_6-31g+(d).inp 004154060.td-b3lyp_6-31g+(d).log.xz

004154060.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154060.td-b3lyp_6-31+g(d).gjf (generated)

004154060.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154060.mol 004154060.PUBCHEM 004154060.mol (via Jmol)
004154072.b3lyp_6-31g(d).inp

004154072.b3lyp_6-31g(d).qchem.inp (generated)

004154072.b3lyp_6-31g(d).gjf (generated)

004154072.b3lyp_6-31g(d).firefly.inp (generated)

004154072.b3lyp_6-31g(d).smash.inp (generated)

004154072.b3lyp_6-31g(d).nwchem.inp (generated) 004154072.b3lyp_6-31g(d).log.xz 004154072.td-b3lyp_6-31g+(d).inp 004154072.td-b3lyp_6-31g+(d).log.xz

004154072.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154072.td-b3lyp_6-31+g(d).gjf (generated)

004154072.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154072.mol 004154072.PUBCHEM 004154072.mol (via Jmol)
004154074.b3lyp_6-31g(d).inp

004154074.b3lyp_6-31g(d).qchem.inp (generated)

004154074.b3lyp_6-31g(d).gjf (generated)

004154074.b3lyp_6-31g(d).firefly.inp (generated)

004154074.b3lyp_6-31g(d).smash.inp (generated)

004154074.b3lyp_6-31g(d).nwchem.inp (generated) 004154074.b3lyp_6-31g(d).log.xz 004154074.td-b3lyp_6-31g+(d).inp 004154074.td-b3lyp_6-31g+(d).log.xz

004154074.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154074.td-b3lyp_6-31+g(d).gjf (generated)

004154074.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154074.mol 004154074.PUBCHEM 004154074.mol (via Jmol)
004154132.b3lyp_6-31g(d).inp

004154132.b3lyp_6-31g(d).qchem.inp (generated)

004154132.b3lyp_6-31g(d).gjf (generated)

004154132.b3lyp_6-31g(d).firefly.inp (generated)

004154132.b3lyp_6-31g(d).smash.inp (generated)

004154132.b3lyp_6-31g(d).nwchem.inp (generated) 004154132.b3lyp_6-31g(d).log.xz 004154132.td-b3lyp_6-31g+(d).inp 004154132.td-b3lyp_6-31g+(d).log.xz

004154132.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154132.td-b3lyp_6-31+g(d).gjf (generated)

004154132.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154132.mol 004154132.PUBCHEM 004154132.mol (via Jmol)
004154137.b3lyp_6-31g(d).inp

004154137.b3lyp_6-31g(d).qchem.inp (generated)

004154137.b3lyp_6-31g(d).gjf (generated)

004154137.b3lyp_6-31g(d).firefly.inp (generated)

004154137.b3lyp_6-31g(d).smash.inp (generated)

004154137.b3lyp_6-31g(d).nwchem.inp (generated) 004154137.b3lyp_6-31g(d).log.xz 004154137.td-b3lyp_6-31g+(d).inp 004154137.td-b3lyp_6-31g+(d).log.xz

004154137.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154137.td-b3lyp_6-31+g(d).gjf (generated)

004154137.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154137.mol 004154137.PUBCHEM 004154137.mol (via Jmol)
004154140.b3lyp_6-31g(d).inp

004154140.b3lyp_6-31g(d).qchem.inp (generated)

004154140.b3lyp_6-31g(d).gjf (generated)

004154140.b3lyp_6-31g(d).firefly.inp (generated)

004154140.b3lyp_6-31g(d).smash.inp (generated)

004154140.b3lyp_6-31g(d).nwchem.inp (generated) 004154140.b3lyp_6-31g(d).log.xz 004154140.td-b3lyp_6-31g+(d).inp 004154140.td-b3lyp_6-31g+(d).log.xz

004154140.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154140.td-b3lyp_6-31+g(d).gjf (generated)

004154140.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154140.mol 004154140.PUBCHEM 004154140.mol (via Jmol)
004154165.b3lyp_6-31g(d).inp

004154165.b3lyp_6-31g(d).qchem.inp (generated)

004154165.b3lyp_6-31g(d).gjf (generated)

004154165.b3lyp_6-31g(d).firefly.inp (generated)

004154165.b3lyp_6-31g(d).smash.inp (generated)

004154165.b3lyp_6-31g(d).nwchem.inp (generated) 004154165.b3lyp_6-31g(d).log.xz 004154165.td-b3lyp_6-31g+(d).inp 004154165.td-b3lyp_6-31g+(d).log.xz

004154165.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154165.td-b3lyp_6-31+g(d).gjf (generated)

004154165.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154165.mol 004154165.PUBCHEM 004154165.mol (via Jmol)
004154195.b3lyp_6-31g(d).inp

004154195.b3lyp_6-31g(d).qchem.inp (generated)

004154195.b3lyp_6-31g(d).gjf (generated)

004154195.b3lyp_6-31g(d).firefly.inp (generated)

004154195.b3lyp_6-31g(d).smash.inp (generated)

004154195.b3lyp_6-31g(d).nwchem.inp (generated) 004154195.b3lyp_6-31g(d).log.xz 004154195.td-b3lyp_6-31g+(d).inp 004154195.td-b3lyp_6-31g+(d).log.xz

004154195.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154195.td-b3lyp_6-31+g(d).gjf (generated)

004154195.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154195.mol 004154195.PUBCHEM 004154195.mol (via Jmol)
004154210.b3lyp_6-31g(d).inp

004154210.b3lyp_6-31g(d).qchem.inp (generated)

004154210.b3lyp_6-31g(d).gjf (generated)

004154210.b3lyp_6-31g(d).firefly.inp (generated)

004154210.b3lyp_6-31g(d).smash.inp (generated)

004154210.b3lyp_6-31g(d).nwchem.inp (generated) 004154210.b3lyp_6-31g(d).log.xz 004154210.td-b3lyp_6-31g+(d).inp 004154210.td-b3lyp_6-31g+(d).log.xz

004154210.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154210.td-b3lyp_6-31+g(d).gjf (generated)

004154210.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154210.mol 004154210.PUBCHEM 004154210.mol (via Jmol)
004154240.b3lyp_6-31g(d).inp

004154240.b3lyp_6-31g(d).qchem.inp (generated)

004154240.b3lyp_6-31g(d).gjf (generated)

004154240.b3lyp_6-31g(d).firefly.inp (generated)

004154240.b3lyp_6-31g(d).smash.inp (generated)

004154240.b3lyp_6-31g(d).nwchem.inp (generated) 004154240.b3lyp_6-31g(d).log.xz 004154240.td-b3lyp_6-31g+(d).inp 004154240.td-b3lyp_6-31g+(d).log.xz

004154240.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154240.td-b3lyp_6-31+g(d).gjf (generated)

004154240.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154240.mol 004154240.PUBCHEM 004154240.mol (via Jmol)
004154258.b3lyp_6-31g(d).inp

004154258.b3lyp_6-31g(d).qchem.inp (generated)

004154258.b3lyp_6-31g(d).gjf (generated)

004154258.b3lyp_6-31g(d).firefly.inp (generated)

004154258.b3lyp_6-31g(d).smash.inp (generated)

004154258.b3lyp_6-31g(d).nwchem.inp (generated) 004154258.b3lyp_6-31g(d).log.xz 004154258.td-b3lyp_6-31g+(d).inp 004154258.td-b3lyp_6-31g+(d).log.xz

004154258.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154258.td-b3lyp_6-31+g(d).gjf (generated)

004154258.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154258.mol 004154258.PUBCHEM 004154258.mol (via Jmol)
004154385.b3lyp_6-31g(d).inp

004154385.b3lyp_6-31g(d).qchem.inp (generated)

004154385.b3lyp_6-31g(d).gjf (generated)

004154385.b3lyp_6-31g(d).firefly.inp (generated)

004154385.b3lyp_6-31g(d).smash.inp (generated)

004154385.b3lyp_6-31g(d).nwchem.inp (generated) 004154385.b3lyp_6-31g(d).log.xz 004154385.td-b3lyp_6-31g+(d).inp 004154385.td-b3lyp_6-31g+(d).log.xz

004154385.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154385.td-b3lyp_6-31+g(d).gjf (generated)

004154385.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154385.mol 004154385.PUBCHEM 004154385.mol (via Jmol)
004154473.b3lyp_6-31g(d).inp

004154473.b3lyp_6-31g(d).qchem.inp (generated)

004154473.b3lyp_6-31g(d).gjf (generated)

004154473.b3lyp_6-31g(d).firefly.inp (generated)

004154473.b3lyp_6-31g(d).smash.inp (generated)

004154473.b3lyp_6-31g(d).nwchem.inp (generated) 004154473.b3lyp_6-31g(d).log.xz 004154473.td-b3lyp_6-31g+(d).inp 004154473.td-b3lyp_6-31g+(d).log.xz

004154473.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154473.td-b3lyp_6-31+g(d).gjf (generated)

004154473.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154473.mol 004154473.PUBCHEM 004154473.mol (via Jmol)
004154546.b3lyp_6-31g(d).inp

004154546.b3lyp_6-31g(d).qchem.inp (generated)

004154546.b3lyp_6-31g(d).gjf (generated)

004154546.b3lyp_6-31g(d).firefly.inp (generated)

004154546.b3lyp_6-31g(d).smash.inp (generated)

004154546.b3lyp_6-31g(d).nwchem.inp (generated) 004154546.b3lyp_6-31g(d).log.xz 004154546.td-b3lyp_6-31g+(d).inp 004154546.td-b3lyp_6-31g+(d).log.xz

004154546.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154546.td-b3lyp_6-31+g(d).gjf (generated)

004154546.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154546.mol 004154546.PUBCHEM 004154546.mol (via Jmol)
004154550.b3lyp_6-31g(d).inp

004154550.b3lyp_6-31g(d).qchem.inp (generated)

004154550.b3lyp_6-31g(d).gjf (generated)

004154550.b3lyp_6-31g(d).firefly.inp (generated)

004154550.b3lyp_6-31g(d).smash.inp (generated)

004154550.b3lyp_6-31g(d).nwchem.inp (generated) 004154550.b3lyp_6-31g(d).log.xz 004154550.td-b3lyp_6-31g+(d).inp 004154550.td-b3lyp_6-31g+(d).log.xz

004154550.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154550.td-b3lyp_6-31+g(d).gjf (generated)

004154550.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154550.mol 004154550.PUBCHEM 004154550.mol (via Jmol)
004154551.b3lyp_6-31g(d).inp

004154551.b3lyp_6-31g(d).qchem.inp (generated)

004154551.b3lyp_6-31g(d).gjf (generated)

004154551.b3lyp_6-31g(d).firefly.inp (generated)

004154551.b3lyp_6-31g(d).smash.inp (generated)

004154551.b3lyp_6-31g(d).nwchem.inp (generated) 004154551.b3lyp_6-31g(d).log.xz 004154551.td-b3lyp_6-31g+(d).inp 004154551.td-b3lyp_6-31g+(d).log.xz

004154551.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154551.td-b3lyp_6-31+g(d).gjf (generated)

004154551.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154551.mol 004154551.PUBCHEM 004154551.mol (via Jmol)
004154641.b3lyp_6-31g(d).inp

004154641.b3lyp_6-31g(d).qchem.inp (generated)

004154641.b3lyp_6-31g(d).gjf (generated)

004154641.b3lyp_6-31g(d).firefly.inp (generated)

004154641.b3lyp_6-31g(d).smash.inp (generated)

004154641.b3lyp_6-31g(d).nwchem.inp (generated) 004154641.b3lyp_6-31g(d).log.xz 004154641.td-b3lyp_6-31g+(d).inp 004154641.td-b3lyp_6-31g+(d).log.xz

004154641.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154641.td-b3lyp_6-31+g(d).gjf (generated)

004154641.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154641.mol 004154641.PUBCHEM 004154641.mol (via Jmol)
004154740.b3lyp_6-31g(d).inp

004154740.b3lyp_6-31g(d).qchem.inp (generated)

004154740.b3lyp_6-31g(d).gjf (generated)

004154740.b3lyp_6-31g(d).firefly.inp (generated)

004154740.b3lyp_6-31g(d).smash.inp (generated)

004154740.b3lyp_6-31g(d).nwchem.inp (generated) 004154740.b3lyp_6-31g(d).log.xz 004154740.td-b3lyp_6-31g+(d).inp 004154740.td-b3lyp_6-31g+(d).log.xz

004154740.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154740.td-b3lyp_6-31+g(d).gjf (generated)

004154740.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154740.mol 004154740.PUBCHEM 004154740.mol (via Jmol)
004154751.b3lyp_6-31g(d).inp

004154751.b3lyp_6-31g(d).qchem.inp (generated)

004154751.b3lyp_6-31g(d).gjf (generated)

004154751.b3lyp_6-31g(d).firefly.inp (generated)

004154751.b3lyp_6-31g(d).smash.inp (generated)

004154751.b3lyp_6-31g(d).nwchem.inp (generated) 004154751.b3lyp_6-31g(d).log.xz 004154751.td-b3lyp_6-31g+(d).inp 004154751.td-b3lyp_6-31g+(d).log.xz

004154751.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154751.td-b3lyp_6-31+g(d).gjf (generated)

004154751.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154751.mol 004154751.PUBCHEM 004154751.mol (via Jmol)
004154753.b3lyp_6-31g(d).inp

004154753.b3lyp_6-31g(d).qchem.inp (generated)

004154753.b3lyp_6-31g(d).gjf (generated)

004154753.b3lyp_6-31g(d).firefly.inp (generated)

004154753.b3lyp_6-31g(d).smash.inp (generated)

004154753.b3lyp_6-31g(d).nwchem.inp (generated) 004154753.b3lyp_6-31g(d).log.xz 004154753.td-b3lyp_6-31g+(d).inp 004154753.td-b3lyp_6-31g+(d).log.xz

004154753.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154753.td-b3lyp_6-31+g(d).gjf (generated)

004154753.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154753.mol 004154753.PUBCHEM 004154753.mol (via Jmol)
004154794.b3lyp_6-31g(d).inp

004154794.b3lyp_6-31g(d).qchem.inp (generated)

004154794.b3lyp_6-31g(d).gjf (generated)

004154794.b3lyp_6-31g(d).firefly.inp (generated)

004154794.b3lyp_6-31g(d).smash.inp (generated)

004154794.b3lyp_6-31g(d).nwchem.inp (generated) 004154794.b3lyp_6-31g(d).log.xz 004154794.td-b3lyp_6-31g+(d).inp 004154794.td-b3lyp_6-31g+(d).log.xz

004154794.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154794.td-b3lyp_6-31+g(d).gjf (generated)

004154794.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154794.mol 004154794.PUBCHEM 004154794.mol (via Jmol)
004154813.b3lyp_6-31g(d).inp

004154813.b3lyp_6-31g(d).qchem.inp (generated)

004154813.b3lyp_6-31g(d).gjf (generated)

004154813.b3lyp_6-31g(d).firefly.inp (generated)

004154813.b3lyp_6-31g(d).smash.inp (generated)

004154813.b3lyp_6-31g(d).nwchem.inp (generated) 004154813.b3lyp_6-31g(d).log.xz 004154813.td-b3lyp_6-31g+(d).inp 004154813.td-b3lyp_6-31g+(d).log.xz

004154813.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154813.td-b3lyp_6-31+g(d).gjf (generated)

004154813.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154813.mol 004154813.PUBCHEM 004154813.mol (via Jmol)
004154815.b3lyp_6-31g(d).inp

004154815.b3lyp_6-31g(d).qchem.inp (generated)

004154815.b3lyp_6-31g(d).gjf (generated)

004154815.b3lyp_6-31g(d).firefly.inp (generated)

004154815.b3lyp_6-31g(d).smash.inp (generated)

004154815.b3lyp_6-31g(d).nwchem.inp (generated) 004154815.b3lyp_6-31g(d).log.xz 004154815.td-b3lyp_6-31g+(d).inp 004154815.td-b3lyp_6-31g+(d).log.xz

004154815.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154815.td-b3lyp_6-31+g(d).gjf (generated)

004154815.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154815.mol 004154815.PUBCHEM 004154815.mol (via Jmol)
004154827.b3lyp_6-31g(d).inp

004154827.b3lyp_6-31g(d).qchem.inp (generated)

004154827.b3lyp_6-31g(d).gjf (generated)

004154827.b3lyp_6-31g(d).firefly.inp (generated)

004154827.b3lyp_6-31g(d).smash.inp (generated)

004154827.b3lyp_6-31g(d).nwchem.inp (generated) 004154827.b3lyp_6-31g(d).log.xz 004154827.td-b3lyp_6-31g+(d).inp 004154827.td-b3lyp_6-31g+(d).log.xz

004154827.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154827.td-b3lyp_6-31+g(d).gjf (generated)

004154827.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154827.mol 004154827.PUBCHEM 004154827.mol (via Jmol)
004154842.b3lyp_6-31g(d).inp

004154842.b3lyp_6-31g(d).qchem.inp (generated)

004154842.b3lyp_6-31g(d).gjf (generated)

004154842.b3lyp_6-31g(d).firefly.inp (generated)

004154842.b3lyp_6-31g(d).smash.inp (generated)

004154842.b3lyp_6-31g(d).nwchem.inp (generated) 004154842.b3lyp_6-31g(d).log.xz 004154842.td-b3lyp_6-31g+(d).inp 004154842.td-b3lyp_6-31g+(d).log.xz

004154842.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154842.td-b3lyp_6-31+g(d).gjf (generated)

004154842.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154842.mol 004154842.PUBCHEM 004154842.mol (via Jmol)
004154856.b3lyp_6-31g(d).inp

004154856.b3lyp_6-31g(d).qchem.inp (generated)

004154856.b3lyp_6-31g(d).gjf (generated)

004154856.b3lyp_6-31g(d).firefly.inp (generated)

004154856.b3lyp_6-31g(d).smash.inp (generated)

004154856.b3lyp_6-31g(d).nwchem.inp (generated) 004154856.b3lyp_6-31g(d).log.xz 004154856.mol 004154856.PUBCHEM 004154856.mol (via Jmol)
004154888.b3lyp_6-31g(d).inp

004154888.b3lyp_6-31g(d).qchem.inp (generated)

004154888.b3lyp_6-31g(d).gjf (generated)

004154888.b3lyp_6-31g(d).firefly.inp (generated)

004154888.b3lyp_6-31g(d).smash.inp (generated)

004154888.b3lyp_6-31g(d).nwchem.inp (generated) 004154888.b3lyp_6-31g(d).log.xz 004154888.td-b3lyp_6-31g+(d).inp 004154888.td-b3lyp_6-31g+(d).log.xz

004154888.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154888.td-b3lyp_6-31+g(d).gjf (generated)

004154888.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154888.mol 004154888.PUBCHEM 004154888.mol (via Jmol)
004154904.b3lyp_6-31g(d).inp

004154904.b3lyp_6-31g(d).qchem.inp (generated)

004154904.b3lyp_6-31g(d).gjf (generated)

004154904.b3lyp_6-31g(d).firefly.inp (generated)

004154904.b3lyp_6-31g(d).smash.inp (generated)

004154904.b3lyp_6-31g(d).nwchem.inp (generated) 004154904.b3lyp_6-31g(d).log.xz 004154904.td-b3lyp_6-31g+(d).inp 004154904.td-b3lyp_6-31g+(d).log.xz

004154904.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154904.td-b3lyp_6-31+g(d).gjf (generated)

004154904.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154904.mol 004154904.PUBCHEM 004154904.mol (via Jmol)
004154911.b3lyp_6-31g(d).inp

004154911.b3lyp_6-31g(d).qchem.inp (generated)

004154911.b3lyp_6-31g(d).gjf (generated)

004154911.b3lyp_6-31g(d).firefly.inp (generated)

004154911.b3lyp_6-31g(d).smash.inp (generated)

004154911.b3lyp_6-31g(d).nwchem.inp (generated) 004154911.b3lyp_6-31g(d).log.xz 004154911.td-b3lyp_6-31g+(d).inp 004154911.td-b3lyp_6-31g+(d).log.xz

004154911.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154911.td-b3lyp_6-31+g(d).gjf (generated)

004154911.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154911.mol 004154911.PUBCHEM 004154911.mol (via Jmol)
004154935.b3lyp_6-31g(d).inp

004154935.b3lyp_6-31g(d).qchem.inp (generated)

004154935.b3lyp_6-31g(d).gjf (generated)

004154935.b3lyp_6-31g(d).firefly.inp (generated)

004154935.b3lyp_6-31g(d).smash.inp (generated)

004154935.b3lyp_6-31g(d).nwchem.inp (generated) 004154935.b3lyp_6-31g(d).log.xz 004154935.td-b3lyp_6-31g+(d).inp 004154935.td-b3lyp_6-31g+(d).log.xz

004154935.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154935.td-b3lyp_6-31+g(d).gjf (generated)

004154935.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154935.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154935.mol 004154935.PUBCHEM 004154935.mol (via Jmol)
004154963.b3lyp_6-31g(d).inp

004154963.b3lyp_6-31g(d).qchem.inp (generated)

004154963.b3lyp_6-31g(d).gjf (generated)

004154963.b3lyp_6-31g(d).firefly.inp (generated)

004154963.b3lyp_6-31g(d).smash.inp (generated)

004154963.b3lyp_6-31g(d).nwchem.inp (generated) 004154963.b3lyp_6-31g(d).log.xz 004154963.td-b3lyp_6-31g+(d).inp 004154963.td-b3lyp_6-31g+(d).log.xz

004154963.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154963.td-b3lyp_6-31+g(d).gjf (generated)

004154963.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154963.mol 004154963.PUBCHEM 004154963.mol (via Jmol)
004154995.b3lyp_6-31g(d).inp

004154995.b3lyp_6-31g(d).qchem.inp (generated)

004154995.b3lyp_6-31g(d).gjf (generated)

004154995.b3lyp_6-31g(d).firefly.inp (generated)

004154995.b3lyp_6-31g(d).smash.inp (generated)

004154995.b3lyp_6-31g(d).nwchem.inp (generated) 004154995.b3lyp_6-31g(d).log.xz 004154995.td-b3lyp_6-31g+(d).inp 004154995.td-b3lyp_6-31g+(d).log.xz

004154995.td-b3lyp_6-31+g(d).qchem.inp (generated)

004154995.td-b3lyp_6-31+g(d).gjf (generated)

004154995.td-b3lyp_6-31+g(d).firefly.inp (generated)

004154995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004154995.mol 004154995.PUBCHEM 004154995.mol (via Jmol)
004155160.b3lyp_6-31g(d).inp

004155160.b3lyp_6-31g(d).qchem.inp (generated)

004155160.b3lyp_6-31g(d).gjf (generated)

004155160.b3lyp_6-31g(d).firefly.inp (generated)

004155160.b3lyp_6-31g(d).smash.inp (generated)

004155160.b3lyp_6-31g(d).nwchem.inp (generated) 004155160.b3lyp_6-31g(d).log.xz 004155160.td-b3lyp_6-31g+(d).inp 004155160.td-b3lyp_6-31g+(d).log.xz

004155160.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155160.td-b3lyp_6-31+g(d).gjf (generated)

004155160.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155160.mol 004155160.PUBCHEM 004155160.mol (via Jmol)
004155200.b3lyp_6-31g(d).inp

004155200.b3lyp_6-31g(d).qchem.inp (generated)

004155200.b3lyp_6-31g(d).gjf (generated)

004155200.b3lyp_6-31g(d).firefly.inp (generated)

004155200.b3lyp_6-31g(d).smash.inp (generated)

004155200.b3lyp_6-31g(d).nwchem.inp (generated) 004155200.b3lyp_6-31g(d).log.xz 004155200.td-b3lyp_6-31g+(d).inp 004155200.td-b3lyp_6-31g+(d).log.xz

004155200.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155200.td-b3lyp_6-31+g(d).gjf (generated)

004155200.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155200.mol 004155200.PUBCHEM 004155200.mol (via Jmol)
004155201.b3lyp_6-31g(d).inp

004155201.b3lyp_6-31g(d).qchem.inp (generated)

004155201.b3lyp_6-31g(d).gjf (generated)

004155201.b3lyp_6-31g(d).firefly.inp (generated)

004155201.b3lyp_6-31g(d).smash.inp (generated)

004155201.b3lyp_6-31g(d).nwchem.inp (generated) 004155201.b3lyp_6-31g(d).log.xz 004155201.mol 004155201.PUBCHEM 004155201.mol (via Jmol)
004155216.b3lyp_6-31g(d).inp

004155216.b3lyp_6-31g(d).qchem.inp (generated)

004155216.b3lyp_6-31g(d).gjf (generated)

004155216.b3lyp_6-31g(d).firefly.inp (generated)

004155216.b3lyp_6-31g(d).smash.inp (generated)

004155216.b3lyp_6-31g(d).nwchem.inp (generated) 004155216.b3lyp_6-31g(d).log.xz 004155216.td-b3lyp_6-31g+(d).inp 004155216.td-b3lyp_6-31g+(d).log.xz

004155216.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155216.td-b3lyp_6-31+g(d).gjf (generated)

004155216.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155216.mol 004155216.PUBCHEM 004155216.mol (via Jmol)
004155223.b3lyp_6-31g(d).inp

004155223.b3lyp_6-31g(d).qchem.inp (generated)

004155223.b3lyp_6-31g(d).gjf (generated)

004155223.b3lyp_6-31g(d).firefly.inp (generated)

004155223.b3lyp_6-31g(d).smash.inp (generated)

004155223.b3lyp_6-31g(d).nwchem.inp (generated) 004155223.b3lyp_6-31g(d).log.xz 004155223.mol 004155223.PUBCHEM 004155223.mol (via Jmol)
004155245.b3lyp_6-31g(d).inp

004155245.b3lyp_6-31g(d).qchem.inp (generated)

004155245.b3lyp_6-31g(d).gjf (generated)

004155245.b3lyp_6-31g(d).firefly.inp (generated)

004155245.b3lyp_6-31g(d).smash.inp (generated)

004155245.b3lyp_6-31g(d).nwchem.inp (generated) 004155245.b3lyp_6-31g(d).log.xz 004155245.td-b3lyp_6-31g+(d).inp 004155245.td-b3lyp_6-31g+(d).log.xz

004155245.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155245.td-b3lyp_6-31+g(d).gjf (generated)

004155245.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155245.mol 004155245.PUBCHEM 004155245.mol (via Jmol)
004155246.b3lyp_6-31g(d).inp

004155246.b3lyp_6-31g(d).qchem.inp (generated)

004155246.b3lyp_6-31g(d).gjf (generated)

004155246.b3lyp_6-31g(d).firefly.inp (generated)

004155246.b3lyp_6-31g(d).smash.inp (generated)

004155246.b3lyp_6-31g(d).nwchem.inp (generated) 004155246.b3lyp_6-31g(d).log.xz 004155246.td-b3lyp_6-31g+(d).inp 004155246.td-b3lyp_6-31g+(d).log.xz

004155246.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155246.td-b3lyp_6-31+g(d).gjf (generated)

004155246.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155246.mol 004155246.PUBCHEM 004155246.mol (via Jmol)
004155292.b3lyp_6-31g(d).inp

004155292.b3lyp_6-31g(d).qchem.inp (generated)

004155292.b3lyp_6-31g(d).gjf (generated)

004155292.b3lyp_6-31g(d).firefly.inp (generated)

004155292.b3lyp_6-31g(d).smash.inp (generated)

004155292.b3lyp_6-31g(d).nwchem.inp (generated) 004155292.b3lyp_6-31g(d).log.xz 004155292.td-b3lyp_6-31g+(d).inp 004155292.td-b3lyp_6-31g+(d).log.xz

004155292.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155292.td-b3lyp_6-31+g(d).gjf (generated)

004155292.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155292.mol 004155292.PUBCHEM 004155292.mol (via Jmol)
004155299.b3lyp_6-31g(d).inp

004155299.b3lyp_6-31g(d).qchem.inp (generated)

004155299.b3lyp_6-31g(d).gjf (generated)

004155299.b3lyp_6-31g(d).firefly.inp (generated)

004155299.b3lyp_6-31g(d).smash.inp (generated)

004155299.b3lyp_6-31g(d).nwchem.inp (generated) 004155299.b3lyp_6-31g(d).log.xz 004155299.td-b3lyp_6-31g+(d).inp 004155299.td-b3lyp_6-31g+(d).log.xz

004155299.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155299.td-b3lyp_6-31+g(d).gjf (generated)

004155299.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155299.mol 004155299.PUBCHEM 004155299.mol (via Jmol)
004155303.b3lyp_6-31g(d).inp

004155303.b3lyp_6-31g(d).qchem.inp (generated)

004155303.b3lyp_6-31g(d).gjf (generated)

004155303.b3lyp_6-31g(d).firefly.inp (generated)

004155303.b3lyp_6-31g(d).smash.inp (generated)

004155303.b3lyp_6-31g(d).nwchem.inp (generated) 004155303.b3lyp_6-31g(d).log.xz 004155303.td-b3lyp_6-31g+(d).inp 004155303.td-b3lyp_6-31g+(d).log.xz

004155303.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155303.td-b3lyp_6-31+g(d).gjf (generated)

004155303.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155303.mol 004155303.PUBCHEM 004155303.mol (via Jmol)
004155322.b3lyp_6-31g(d).inp

004155322.b3lyp_6-31g(d).qchem.inp (generated)

004155322.b3lyp_6-31g(d).gjf (generated)

004155322.b3lyp_6-31g(d).firefly.inp (generated)

004155322.b3lyp_6-31g(d).smash.inp (generated)

004155322.b3lyp_6-31g(d).nwchem.inp (generated) 004155322.b3lyp_6-31g(d).log.xz 004155322.td-b3lyp_6-31g+(d).inp 004155322.td-b3lyp_6-31g+(d).log.xz

004155322.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155322.td-b3lyp_6-31+g(d).gjf (generated)

004155322.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155322.mol 004155322.PUBCHEM 004155322.mol (via Jmol)
004155323.b3lyp_6-31g(d).inp

004155323.b3lyp_6-31g(d).qchem.inp (generated)

004155323.b3lyp_6-31g(d).gjf (generated)

004155323.b3lyp_6-31g(d).firefly.inp (generated)

004155323.b3lyp_6-31g(d).smash.inp (generated)

004155323.b3lyp_6-31g(d).nwchem.inp (generated) 004155323.b3lyp_6-31g(d).log.xz 004155323.td-b3lyp_6-31g+(d).inp 004155323.td-b3lyp_6-31g+(d).log.xz

004155323.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155323.td-b3lyp_6-31+g(d).gjf (generated)

004155323.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155323.mol 004155323.PUBCHEM 004155323.mol (via Jmol)
004155351.b3lyp_6-31g(d).inp

004155351.b3lyp_6-31g(d).qchem.inp (generated)

004155351.b3lyp_6-31g(d).gjf (generated)

004155351.b3lyp_6-31g(d).firefly.inp (generated)

004155351.b3lyp_6-31g(d).smash.inp (generated)

004155351.b3lyp_6-31g(d).nwchem.inp (generated) 004155351.b3lyp_6-31g(d).log.xz 004155351.td-b3lyp_6-31g+(d).inp 004155351.td-b3lyp_6-31g+(d).log.xz

004155351.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155351.td-b3lyp_6-31+g(d).gjf (generated)

004155351.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155351.mol 004155351.PUBCHEM 004155351.mol (via Jmol)
004155369.b3lyp_6-31g(d).inp

004155369.b3lyp_6-31g(d).qchem.inp (generated)

004155369.b3lyp_6-31g(d).gjf (generated)

004155369.b3lyp_6-31g(d).firefly.inp (generated)

004155369.b3lyp_6-31g(d).smash.inp (generated)

004155369.b3lyp_6-31g(d).nwchem.inp (generated) 004155369.b3lyp_6-31g(d).log.xz 004155369.td-b3lyp_6-31g+(d).inp 004155369.td-b3lyp_6-31g+(d).log.xz

004155369.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155369.td-b3lyp_6-31+g(d).gjf (generated)

004155369.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155369.mol 004155369.PUBCHEM 004155369.mol (via Jmol)
004155371.b3lyp_6-31g(d).inp

004155371.b3lyp_6-31g(d).qchem.inp (generated)

004155371.b3lyp_6-31g(d).gjf (generated)

004155371.b3lyp_6-31g(d).firefly.inp (generated)

004155371.b3lyp_6-31g(d).smash.inp (generated)

004155371.b3lyp_6-31g(d).nwchem.inp (generated) 004155371.b3lyp_6-31g(d).log.xz 004155371.mol 004155371.PUBCHEM 004155371.mol (via Jmol)
004155372.b3lyp_6-31g(d).inp

004155372.b3lyp_6-31g(d).qchem.inp (generated)

004155372.b3lyp_6-31g(d).gjf (generated)

004155372.b3lyp_6-31g(d).firefly.inp (generated)

004155372.b3lyp_6-31g(d).smash.inp (generated)

004155372.b3lyp_6-31g(d).nwchem.inp (generated) 004155372.b3lyp_6-31g(d).log.xz 004155372.td-b3lyp_6-31g+(d).inp 004155372.td-b3lyp_6-31g+(d).log.xz

004155372.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155372.td-b3lyp_6-31+g(d).gjf (generated)

004155372.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155372.mol 004155372.PUBCHEM 004155372.mol (via Jmol)
004155373.b3lyp_6-31g(d).inp

004155373.b3lyp_6-31g(d).qchem.inp (generated)

004155373.b3lyp_6-31g(d).gjf (generated)

004155373.b3lyp_6-31g(d).firefly.inp (generated)

004155373.b3lyp_6-31g(d).smash.inp (generated)

004155373.b3lyp_6-31g(d).nwchem.inp (generated) 004155373.b3lyp_6-31g(d).log.xz 004155373.td-b3lyp_6-31g+(d).inp 004155373.td-b3lyp_6-31g+(d).log.xz

004155373.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155373.td-b3lyp_6-31+g(d).gjf (generated)

004155373.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155373.mol 004155373.PUBCHEM 004155373.mol (via Jmol)
004155406.b3lyp_6-31g(d).inp

004155406.b3lyp_6-31g(d).qchem.inp (generated)

004155406.b3lyp_6-31g(d).gjf (generated)

004155406.b3lyp_6-31g(d).firefly.inp (generated)

004155406.b3lyp_6-31g(d).smash.inp (generated)

004155406.b3lyp_6-31g(d).nwchem.inp (generated) 004155406.b3lyp_6-31g(d).log.xz 004155406.td-b3lyp_6-31g+(d).inp 004155406.td-b3lyp_6-31g+(d).log.xz

004155406.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155406.td-b3lyp_6-31+g(d).gjf (generated)

004155406.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155406.mol 004155406.PUBCHEM 004155406.mol (via Jmol)
004155448.b3lyp_6-31g(d).inp

004155448.b3lyp_6-31g(d).qchem.inp (generated)

004155448.b3lyp_6-31g(d).gjf (generated)

004155448.b3lyp_6-31g(d).firefly.inp (generated)

004155448.b3lyp_6-31g(d).smash.inp (generated)

004155448.b3lyp_6-31g(d).nwchem.inp (generated) 004155448.b3lyp_6-31g(d).log.xz 004155448.td-b3lyp_6-31g+(d).inp 004155448.td-b3lyp_6-31g+(d).log.xz

004155448.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155448.td-b3lyp_6-31+g(d).gjf (generated)

004155448.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155448.mol 004155448.PUBCHEM 004155448.mol (via Jmol)
004155478.b3lyp_6-31g(d).inp

004155478.b3lyp_6-31g(d).qchem.inp (generated)

004155478.b3lyp_6-31g(d).gjf (generated)

004155478.b3lyp_6-31g(d).firefly.inp (generated)

004155478.b3lyp_6-31g(d).smash.inp (generated)

004155478.b3lyp_6-31g(d).nwchem.inp (generated) 004155478.b3lyp_6-31g(d).log.xz 004155478.td-b3lyp_6-31g+(d).inp 004155478.td-b3lyp_6-31g+(d).log.xz

004155478.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155478.td-b3lyp_6-31+g(d).gjf (generated)

004155478.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155478.mol 004155478.PUBCHEM 004155478.mol (via Jmol)
004155480.b3lyp_6-31g(d).inp

004155480.b3lyp_6-31g(d).qchem.inp (generated)

004155480.b3lyp_6-31g(d).gjf (generated)

004155480.b3lyp_6-31g(d).firefly.inp (generated)

004155480.b3lyp_6-31g(d).smash.inp (generated)

004155480.b3lyp_6-31g(d).nwchem.inp (generated) 004155480.b3lyp_6-31g(d).log.xz 004155480.td-b3lyp_6-31g+(d).inp 004155480.td-b3lyp_6-31g+(d).log.xz

004155480.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155480.td-b3lyp_6-31+g(d).gjf (generated)

004155480.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155480.mol 004155480.PUBCHEM 004155480.mol (via Jmol)
004155481.b3lyp_6-31g(d).inp

004155481.b3lyp_6-31g(d).qchem.inp (generated)

004155481.b3lyp_6-31g(d).gjf (generated)

004155481.b3lyp_6-31g(d).firefly.inp (generated)

004155481.b3lyp_6-31g(d).smash.inp (generated)

004155481.b3lyp_6-31g(d).nwchem.inp (generated) 004155481.b3lyp_6-31g(d).log.xz 004155481.td-b3lyp_6-31g+(d).inp 004155481.td-b3lyp_6-31g+(d).log.xz

004155481.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155481.td-b3lyp_6-31+g(d).gjf (generated)

004155481.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155481.mol 004155481.PUBCHEM 004155481.mol (via Jmol)
004155502.b3lyp_6-31g(d).inp

004155502.b3lyp_6-31g(d).qchem.inp (generated)

004155502.b3lyp_6-31g(d).gjf (generated)

004155502.b3lyp_6-31g(d).firefly.inp (generated)

004155502.b3lyp_6-31g(d).smash.inp (generated)

004155502.b3lyp_6-31g(d).nwchem.inp (generated) 004155502.b3lyp_6-31g(d).log.xz 004155502.td-b3lyp_6-31g+(d).inp 004155502.td-b3lyp_6-31g+(d).log.xz

004155502.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155502.td-b3lyp_6-31+g(d).gjf (generated)

004155502.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155502.mol 004155502.PUBCHEM 004155502.mol (via Jmol)
004155533.b3lyp_6-31g(d).inp

004155533.b3lyp_6-31g(d).qchem.inp (generated)

004155533.b3lyp_6-31g(d).gjf (generated)

004155533.b3lyp_6-31g(d).firefly.inp (generated)

004155533.b3lyp_6-31g(d).smash.inp (generated)

004155533.b3lyp_6-31g(d).nwchem.inp (generated) 004155533.b3lyp_6-31g(d).log.xz 004155533.td-b3lyp_6-31g+(d).inp 004155533.td-b3lyp_6-31g+(d).log.xz

004155533.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155533.td-b3lyp_6-31+g(d).gjf (generated)

004155533.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155533.mol 004155533.PUBCHEM 004155533.mol (via Jmol)
004155580.b3lyp_6-31g(d).inp

004155580.b3lyp_6-31g(d).qchem.inp (generated)

004155580.b3lyp_6-31g(d).gjf (generated)

004155580.b3lyp_6-31g(d).firefly.inp (generated)

004155580.b3lyp_6-31g(d).smash.inp (generated)

004155580.b3lyp_6-31g(d).nwchem.inp (generated) 004155580.b3lyp_6-31g(d).log.xz 004155580.td-b3lyp_6-31g+(d).inp 004155580.td-b3lyp_6-31g+(d).log.xz

004155580.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155580.td-b3lyp_6-31+g(d).gjf (generated)

004155580.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155580.mol 004155580.PUBCHEM 004155580.mol (via Jmol)
004155610.b3lyp_6-31g(d).inp

004155610.b3lyp_6-31g(d).qchem.inp (generated)

004155610.b3lyp_6-31g(d).gjf (generated)

004155610.b3lyp_6-31g(d).firefly.inp (generated)

004155610.b3lyp_6-31g(d).smash.inp (generated)

004155610.b3lyp_6-31g(d).nwchem.inp (generated) 004155610.b3lyp_6-31g(d).log.xz 004155610.mol 004155610.PUBCHEM 004155610.mol (via Jmol)
004155619.b3lyp_6-31g(d).inp

004155619.b3lyp_6-31g(d).qchem.inp (generated)

004155619.b3lyp_6-31g(d).gjf (generated)

004155619.b3lyp_6-31g(d).firefly.inp (generated)

004155619.b3lyp_6-31g(d).smash.inp (generated)

004155619.b3lyp_6-31g(d).nwchem.inp (generated) 004155619.b3lyp_6-31g(d).log.xz 004155619.td-b3lyp_6-31g+(d).inp 004155619.td-b3lyp_6-31g+(d).log.xz

004155619.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155619.td-b3lyp_6-31+g(d).gjf (generated)

004155619.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155619.mol 004155619.PUBCHEM 004155619.mol (via Jmol)
004155674.b3lyp_6-31g(d).inp

004155674.b3lyp_6-31g(d).qchem.inp (generated)

004155674.b3lyp_6-31g(d).gjf (generated)

004155674.b3lyp_6-31g(d).firefly.inp (generated)

004155674.b3lyp_6-31g(d).smash.inp (generated)

004155674.b3lyp_6-31g(d).nwchem.inp (generated) 004155674.b3lyp_6-31g(d).log.xz 004155674.td-b3lyp_6-31g+(d).inp 004155674.td-b3lyp_6-31g+(d).log.xz

004155674.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155674.td-b3lyp_6-31+g(d).gjf (generated)

004155674.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155674.mol 004155674.PUBCHEM 004155674.mol (via Jmol)
004155709.b3lyp_6-31g(d).inp

004155709.b3lyp_6-31g(d).qchem.inp (generated)

004155709.b3lyp_6-31g(d).gjf (generated)

004155709.b3lyp_6-31g(d).firefly.inp (generated)

004155709.b3lyp_6-31g(d).smash.inp (generated)

004155709.b3lyp_6-31g(d).nwchem.inp (generated) 004155709.b3lyp_6-31g(d).log.xz 004155709.td-b3lyp_6-31g+(d).inp 004155709.td-b3lyp_6-31g+(d).log.xz

004155709.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155709.td-b3lyp_6-31+g(d).gjf (generated)

004155709.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155709.mol 004155709.PUBCHEM 004155709.mol (via Jmol)
004155765.b3lyp_6-31g(d).inp

004155765.b3lyp_6-31g(d).qchem.inp (generated)

004155765.b3lyp_6-31g(d).gjf (generated)

004155765.b3lyp_6-31g(d).firefly.inp (generated)

004155765.b3lyp_6-31g(d).smash.inp (generated)

004155765.b3lyp_6-31g(d).nwchem.inp (generated) 004155765.b3lyp_6-31g(d).log.xz 004155765.td-b3lyp_6-31g+(d).inp 004155765.td-b3lyp_6-31g+(d).log.xz

004155765.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155765.td-b3lyp_6-31+g(d).gjf (generated)

004155765.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155765.mol 004155765.PUBCHEM 004155765.mol (via Jmol)
004155767.b3lyp_6-31g(d).inp

004155767.b3lyp_6-31g(d).qchem.inp (generated)

004155767.b3lyp_6-31g(d).gjf (generated)

004155767.b3lyp_6-31g(d).firefly.inp (generated)

004155767.b3lyp_6-31g(d).smash.inp (generated)

004155767.b3lyp_6-31g(d).nwchem.inp (generated) 004155767.b3lyp_6-31g(d).log.xz 004155767.td-b3lyp_6-31g+(d).inp 004155767.td-b3lyp_6-31g+(d).log.xz

004155767.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155767.td-b3lyp_6-31+g(d).gjf (generated)

004155767.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155767.mol 004155767.PUBCHEM 004155767.mol (via Jmol)
004155803.b3lyp_6-31g(d).inp

004155803.b3lyp_6-31g(d).qchem.inp (generated)

004155803.b3lyp_6-31g(d).gjf (generated)

004155803.b3lyp_6-31g(d).firefly.inp (generated)

004155803.b3lyp_6-31g(d).smash.inp (generated)

004155803.b3lyp_6-31g(d).nwchem.inp (generated) 004155803.b3lyp_6-31g(d).log.xz 004155803.td-b3lyp_6-31g+(d).inp 004155803.td-b3lyp_6-31g+(d).log.xz

004155803.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155803.td-b3lyp_6-31+g(d).gjf (generated)

004155803.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155803.mol 004155803.PUBCHEM 004155803.mol (via Jmol)
004155810.b3lyp_6-31g(d).inp

004155810.b3lyp_6-31g(d).qchem.inp (generated)

004155810.b3lyp_6-31g(d).gjf (generated)

004155810.b3lyp_6-31g(d).firefly.inp (generated)

004155810.b3lyp_6-31g(d).smash.inp (generated)

004155810.b3lyp_6-31g(d).nwchem.inp (generated) 004155810.b3lyp_6-31g(d).log.xz 004155810.mol 004155810.PUBCHEM 004155810.mol (via Jmol)
004155813.b3lyp_6-31g(d).inp

004155813.b3lyp_6-31g(d).qchem.inp (generated)

004155813.b3lyp_6-31g(d).gjf (generated)

004155813.b3lyp_6-31g(d).firefly.inp (generated)

004155813.b3lyp_6-31g(d).smash.inp (generated)

004155813.b3lyp_6-31g(d).nwchem.inp (generated) 004155813.b3lyp_6-31g(d).log.xz 004155813.td-b3lyp_6-31g+(d).inp 004155813.td-b3lyp_6-31g+(d).log.xz

004155813.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155813.td-b3lyp_6-31+g(d).gjf (generated)

004155813.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155813.mol 004155813.PUBCHEM 004155813.mol (via Jmol)
004155877.b3lyp_6-31g(d).inp

004155877.b3lyp_6-31g(d).qchem.inp (generated)

004155877.b3lyp_6-31g(d).gjf (generated)

004155877.b3lyp_6-31g(d).firefly.inp (generated)

004155877.b3lyp_6-31g(d).smash.inp (generated)

004155877.b3lyp_6-31g(d).nwchem.inp (generated) 004155877.b3lyp_6-31g(d).log.xz 004155877.td-b3lyp_6-31g+(d).inp 004155877.td-b3lyp_6-31g+(d).log.xz

004155877.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155877.td-b3lyp_6-31+g(d).gjf (generated)

004155877.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155877.mol 004155877.PUBCHEM 004155877.mol (via Jmol)
004155878.b3lyp_6-31g(d).inp

004155878.b3lyp_6-31g(d).qchem.inp (generated)

004155878.b3lyp_6-31g(d).gjf (generated)

004155878.b3lyp_6-31g(d).firefly.inp (generated)

004155878.b3lyp_6-31g(d).smash.inp (generated)

004155878.b3lyp_6-31g(d).nwchem.inp (generated) 004155878.b3lyp_6-31g(d).log.xz 004155878.td-b3lyp_6-31g+(d).inp 004155878.td-b3lyp_6-31g+(d).log.xz

004155878.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155878.td-b3lyp_6-31+g(d).gjf (generated)

004155878.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155878.mol 004155878.PUBCHEM 004155878.mol (via Jmol)
004155919.b3lyp_6-31g(d).inp

004155919.b3lyp_6-31g(d).qchem.inp (generated)

004155919.b3lyp_6-31g(d).gjf (generated)

004155919.b3lyp_6-31g(d).firefly.inp (generated)

004155919.b3lyp_6-31g(d).smash.inp (generated)

004155919.b3lyp_6-31g(d).nwchem.inp (generated) 004155919.b3lyp_6-31g(d).log.xz 004155919.mol 004155919.PUBCHEM 004155919.mol (via Jmol)
004155932.b3lyp_6-31g(d).inp

004155932.b3lyp_6-31g(d).qchem.inp (generated)

004155932.b3lyp_6-31g(d).gjf (generated)

004155932.b3lyp_6-31g(d).firefly.inp (generated)

004155932.b3lyp_6-31g(d).smash.inp (generated)

004155932.b3lyp_6-31g(d).nwchem.inp (generated) 004155932.b3lyp_6-31g(d).log.xz 004155932.td-b3lyp_6-31g+(d).inp 004155932.td-b3lyp_6-31g+(d).log.xz

004155932.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155932.td-b3lyp_6-31+g(d).gjf (generated)

004155932.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155932.mol 004155932.PUBCHEM 004155932.mol (via Jmol)
004155933.b3lyp_6-31g(d).inp

004155933.b3lyp_6-31g(d).qchem.inp (generated)

004155933.b3lyp_6-31g(d).gjf (generated)

004155933.b3lyp_6-31g(d).firefly.inp (generated)

004155933.b3lyp_6-31g(d).smash.inp (generated)

004155933.b3lyp_6-31g(d).nwchem.inp (generated) 004155933.b3lyp_6-31g(d).log.xz 004155933.td-b3lyp_6-31g+(d).inp 004155933.td-b3lyp_6-31g+(d).log.xz

004155933.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155933.td-b3lyp_6-31+g(d).gjf (generated)

004155933.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155933.mol 004155933.PUBCHEM 004155933.mol (via Jmol)
004155943.b3lyp_6-31g(d).inp

004155943.b3lyp_6-31g(d).qchem.inp (generated)

004155943.b3lyp_6-31g(d).gjf (generated)

004155943.b3lyp_6-31g(d).firefly.inp (generated)

004155943.b3lyp_6-31g(d).smash.inp (generated)

004155943.b3lyp_6-31g(d).nwchem.inp (generated) 004155943.b3lyp_6-31g(d).log.xz 004155943.td-b3lyp_6-31g+(d).inp 004155943.td-b3lyp_6-31g+(d).log.xz

004155943.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155943.td-b3lyp_6-31+g(d).gjf (generated)

004155943.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155943.mol 004155943.PUBCHEM 004155943.mol (via Jmol)
004155975.b3lyp_6-31g(d).inp

004155975.b3lyp_6-31g(d).qchem.inp (generated)

004155975.b3lyp_6-31g(d).gjf (generated)

004155975.b3lyp_6-31g(d).firefly.inp (generated)

004155975.b3lyp_6-31g(d).smash.inp (generated)

004155975.b3lyp_6-31g(d).nwchem.inp (generated) 004155975.b3lyp_6-31g(d).log.xz 004155975.td-b3lyp_6-31g+(d).inp 004155975.td-b3lyp_6-31g+(d).log.xz

004155975.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155975.td-b3lyp_6-31+g(d).gjf (generated)

004155975.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155975.mol 004155975.PUBCHEM 004155975.mol (via Jmol)
004155994.b3lyp_6-31g(d).inp

004155994.b3lyp_6-31g(d).qchem.inp (generated)

004155994.b3lyp_6-31g(d).gjf (generated)

004155994.b3lyp_6-31g(d).firefly.inp (generated)

004155994.b3lyp_6-31g(d).smash.inp (generated)

004155994.b3lyp_6-31g(d).nwchem.inp (generated) 004155994.b3lyp_6-31g(d).log.xz 004155994.td-b3lyp_6-31g+(d).inp 004155994.td-b3lyp_6-31g+(d).log.xz

004155994.td-b3lyp_6-31+g(d).qchem.inp (generated)

004155994.td-b3lyp_6-31+g(d).gjf (generated)

004155994.td-b3lyp_6-31+g(d).firefly.inp (generated)

004155994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004155994.mol 004155994.PUBCHEM 004155994.mol (via Jmol)
004156003.b3lyp_6-31g(d).inp

004156003.b3lyp_6-31g(d).qchem.inp (generated)

004156003.b3lyp_6-31g(d).gjf (generated)

004156003.b3lyp_6-31g(d).firefly.inp (generated)

004156003.b3lyp_6-31g(d).smash.inp (generated)

004156003.b3lyp_6-31g(d).nwchem.inp (generated) 004156003.b3lyp_6-31g(d).log.xz 004156003.td-b3lyp_6-31g+(d).inp 004156003.td-b3lyp_6-31g+(d).log.xz

004156003.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156003.td-b3lyp_6-31+g(d).gjf (generated)

004156003.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156003.mol 004156003.PUBCHEM 004156003.mol (via Jmol)
004156247.b3lyp_6-31g(d).inp

004156247.b3lyp_6-31g(d).qchem.inp (generated)

004156247.b3lyp_6-31g(d).gjf (generated)

004156247.b3lyp_6-31g(d).firefly.inp (generated)

004156247.b3lyp_6-31g(d).smash.inp (generated)

004156247.b3lyp_6-31g(d).nwchem.inp (generated) 004156247.b3lyp_6-31g(d).log.xz 004156247.mol 004156247.PUBCHEM 004156247.mol (via Jmol)
004156260.b3lyp_6-31g(d).inp

004156260.b3lyp_6-31g(d).qchem.inp (generated)

004156260.b3lyp_6-31g(d).gjf (generated)

004156260.b3lyp_6-31g(d).firefly.inp (generated)

004156260.b3lyp_6-31g(d).smash.inp (generated)

004156260.b3lyp_6-31g(d).nwchem.inp (generated) 004156260.b3lyp_6-31g(d).log.xz 004156260.mol 004156260.PUBCHEM 004156260.mol (via Jmol)
004156263.b3lyp_6-31g(d).inp

004156263.b3lyp_6-31g(d).qchem.inp (generated)

004156263.b3lyp_6-31g(d).gjf (generated)

004156263.b3lyp_6-31g(d).firefly.inp (generated)

004156263.b3lyp_6-31g(d).smash.inp (generated)

004156263.b3lyp_6-31g(d).nwchem.inp (generated) 004156263.b3lyp_6-31g(d).log.xz 004156263.td-b3lyp_6-31g+(d).inp 004156263.td-b3lyp_6-31g+(d).log.xz

004156263.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156263.td-b3lyp_6-31+g(d).gjf (generated)

004156263.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156263.mol 004156263.PUBCHEM 004156263.mol (via Jmol)
004156264.b3lyp_6-31g(d).inp

004156264.b3lyp_6-31g(d).qchem.inp (generated)

004156264.b3lyp_6-31g(d).gjf (generated)

004156264.b3lyp_6-31g(d).firefly.inp (generated)

004156264.b3lyp_6-31g(d).smash.inp (generated)

004156264.b3lyp_6-31g(d).nwchem.inp (generated) 004156264.b3lyp_6-31g(d).log.xz 004156264.td-b3lyp_6-31g+(d).inp 004156264.td-b3lyp_6-31g+(d).log.xz

004156264.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156264.td-b3lyp_6-31+g(d).gjf (generated)

004156264.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156264.mol 004156264.PUBCHEM 004156264.mol (via Jmol)
004156305.b3lyp_6-31g(d).inp

004156305.b3lyp_6-31g(d).qchem.inp (generated)

004156305.b3lyp_6-31g(d).gjf (generated)

004156305.b3lyp_6-31g(d).firefly.inp (generated)

004156305.b3lyp_6-31g(d).smash.inp (generated)

004156305.b3lyp_6-31g(d).nwchem.inp (generated) 004156305.b3lyp_6-31g(d).log.xz 004156305.td-b3lyp_6-31g+(d).inp 004156305.td-b3lyp_6-31g+(d).log.xz

004156305.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156305.td-b3lyp_6-31+g(d).gjf (generated)

004156305.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156305.mol 004156305.PUBCHEM 004156305.mol (via Jmol)
004156319.b3lyp_6-31g(d).inp

004156319.b3lyp_6-31g(d).qchem.inp (generated)

004156319.b3lyp_6-31g(d).gjf (generated)

004156319.b3lyp_6-31g(d).firefly.inp (generated)

004156319.b3lyp_6-31g(d).smash.inp (generated)

004156319.b3lyp_6-31g(d).nwchem.inp (generated) 004156319.b3lyp_6-31g(d).log.xz 004156319.td-b3lyp_6-31g+(d).inp 004156319.td-b3lyp_6-31g+(d).log.xz

004156319.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156319.td-b3lyp_6-31+g(d).gjf (generated)

004156319.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156319.mol 004156319.PUBCHEM 004156319.mol (via Jmol)
004156336.b3lyp_6-31g(d).inp

004156336.b3lyp_6-31g(d).qchem.inp (generated)

004156336.b3lyp_6-31g(d).gjf (generated)

004156336.b3lyp_6-31g(d).firefly.inp (generated)

004156336.b3lyp_6-31g(d).smash.inp (generated)

004156336.b3lyp_6-31g(d).nwchem.inp (generated) 004156336.b3lyp_6-31g(d).log.xz 004156336.td-b3lyp_6-31g+(d).inp 004156336.td-b3lyp_6-31g+(d).log.xz

004156336.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156336.td-b3lyp_6-31+g(d).gjf (generated)

004156336.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156336.mol 004156336.PUBCHEM 004156336.mol (via Jmol)
004156337.b3lyp_6-31g(d).inp

004156337.b3lyp_6-31g(d).qchem.inp (generated)

004156337.b3lyp_6-31g(d).gjf (generated)

004156337.b3lyp_6-31g(d).firefly.inp (generated)

004156337.b3lyp_6-31g(d).smash.inp (generated)

004156337.b3lyp_6-31g(d).nwchem.inp (generated) 004156337.b3lyp_6-31g(d).log.xz 004156337.td-b3lyp_6-31g+(d).inp 004156337.td-b3lyp_6-31g+(d).log.xz

004156337.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156337.td-b3lyp_6-31+g(d).gjf (generated)

004156337.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156337.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156337.mol 004156337.PUBCHEM 004156337.mol (via Jmol)
004156340.b3lyp_6-31g(d).inp

004156340.b3lyp_6-31g(d).qchem.inp (generated)

004156340.b3lyp_6-31g(d).gjf (generated)

004156340.b3lyp_6-31g(d).firefly.inp (generated)

004156340.b3lyp_6-31g(d).smash.inp (generated)

004156340.b3lyp_6-31g(d).nwchem.inp (generated) 004156340.b3lyp_6-31g(d).log.xz 004156340.td-b3lyp_6-31g+(d).inp 004156340.td-b3lyp_6-31g+(d).log.xz

004156340.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156340.td-b3lyp_6-31+g(d).gjf (generated)

004156340.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156340.mol 004156340.PUBCHEM 004156340.mol (via Jmol)
004156366.b3lyp_6-31g(d).inp

004156366.b3lyp_6-31g(d).qchem.inp (generated)

004156366.b3lyp_6-31g(d).gjf (generated)

004156366.b3lyp_6-31g(d).firefly.inp (generated)

004156366.b3lyp_6-31g(d).smash.inp (generated)

004156366.b3lyp_6-31g(d).nwchem.inp (generated) 004156366.b3lyp_6-31g(d).log.xz 004156366.mol 004156366.PUBCHEM 004156366.mol (via Jmol)
004156383.b3lyp_6-31g(d).inp

004156383.b3lyp_6-31g(d).qchem.inp (generated)

004156383.b3lyp_6-31g(d).gjf (generated)

004156383.b3lyp_6-31g(d).firefly.inp (generated)

004156383.b3lyp_6-31g(d).smash.inp (generated)

004156383.b3lyp_6-31g(d).nwchem.inp (generated) 004156383.b3lyp_6-31g(d).log.xz 004156383.td-b3lyp_6-31g+(d).inp 004156383.td-b3lyp_6-31g+(d).log.xz

004156383.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156383.td-b3lyp_6-31+g(d).gjf (generated)

004156383.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156383.mol 004156383.PUBCHEM 004156383.mol (via Jmol)
004156395.b3lyp_6-31g(d).inp

004156395.b3lyp_6-31g(d).qchem.inp (generated)

004156395.b3lyp_6-31g(d).gjf (generated)

004156395.b3lyp_6-31g(d).firefly.inp (generated)

004156395.b3lyp_6-31g(d).smash.inp (generated)

004156395.b3lyp_6-31g(d).nwchem.inp (generated) 004156395.b3lyp_6-31g(d).log.xz 004156395.td-b3lyp_6-31g+(d).inp 004156395.td-b3lyp_6-31g+(d).log.xz

004156395.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156395.td-b3lyp_6-31+g(d).gjf (generated)

004156395.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156395.mol 004156395.PUBCHEM 004156395.mol (via Jmol)
004156430.b3lyp_6-31g(d).inp

004156430.b3lyp_6-31g(d).qchem.inp (generated)

004156430.b3lyp_6-31g(d).gjf (generated)

004156430.b3lyp_6-31g(d).firefly.inp (generated)

004156430.b3lyp_6-31g(d).smash.inp (generated)

004156430.b3lyp_6-31g(d).nwchem.inp (generated) 004156430.b3lyp_6-31g(d).log.xz 004156430.td-b3lyp_6-31g+(d).inp 004156430.td-b3lyp_6-31g+(d).log.xz

004156430.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156430.td-b3lyp_6-31+g(d).gjf (generated)

004156430.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156430.mol 004156430.PUBCHEM 004156430.mol (via Jmol)
004156437.b3lyp_6-31g(d).inp

004156437.b3lyp_6-31g(d).qchem.inp (generated)

004156437.b3lyp_6-31g(d).gjf (generated)

004156437.b3lyp_6-31g(d).firefly.inp (generated)

004156437.b3lyp_6-31g(d).smash.inp (generated)

004156437.b3lyp_6-31g(d).nwchem.inp (generated) 004156437.b3lyp_6-31g(d).log.xz 004156437.td-b3lyp_6-31g+(d).inp 004156437.td-b3lyp_6-31g+(d).log.xz

004156437.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156437.td-b3lyp_6-31+g(d).gjf (generated)

004156437.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156437.mol 004156437.PUBCHEM 004156437.mol (via Jmol)
004156449.b3lyp_6-31g(d).inp

004156449.b3lyp_6-31g(d).qchem.inp (generated)

004156449.b3lyp_6-31g(d).gjf (generated)

004156449.b3lyp_6-31g(d).firefly.inp (generated)

004156449.b3lyp_6-31g(d).smash.inp (generated)

004156449.b3lyp_6-31g(d).nwchem.inp (generated) 004156449.b3lyp_6-31g(d).log.xz 004156449.td-b3lyp_6-31g+(d).inp 004156449.td-b3lyp_6-31g+(d).log.xz

004156449.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156449.td-b3lyp_6-31+g(d).gjf (generated)

004156449.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156449.mol 004156449.PUBCHEM 004156449.mol (via Jmol)
004156474.b3lyp_6-31g(d).inp

004156474.b3lyp_6-31g(d).qchem.inp (generated)

004156474.b3lyp_6-31g(d).gjf (generated)

004156474.b3lyp_6-31g(d).firefly.inp (generated)

004156474.b3lyp_6-31g(d).smash.inp (generated)

004156474.b3lyp_6-31g(d).nwchem.inp (generated) 004156474.b3lyp_6-31g(d).log.xz 004156474.td-b3lyp_6-31g+(d).inp 004156474.td-b3lyp_6-31g+(d).log.xz

004156474.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156474.td-b3lyp_6-31+g(d).gjf (generated)

004156474.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156474.mol 004156474.PUBCHEM 004156474.mol (via Jmol)
004156523.b3lyp_6-31g(d).inp

004156523.b3lyp_6-31g(d).qchem.inp (generated)

004156523.b3lyp_6-31g(d).gjf (generated)

004156523.b3lyp_6-31g(d).firefly.inp (generated)

004156523.b3lyp_6-31g(d).smash.inp (generated)

004156523.b3lyp_6-31g(d).nwchem.inp (generated) 004156523.b3lyp_6-31g(d).log.xz 004156523.td-b3lyp_6-31g+(d).inp 004156523.td-b3lyp_6-31g+(d).log.xz

004156523.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156523.td-b3lyp_6-31+g(d).gjf (generated)

004156523.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156523.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156523.mol 004156523.PUBCHEM 004156523.mol (via Jmol)
004156638.b3lyp_6-31g(d).inp

004156638.b3lyp_6-31g(d).qchem.inp (generated)

004156638.b3lyp_6-31g(d).gjf (generated)

004156638.b3lyp_6-31g(d).firefly.inp (generated)

004156638.b3lyp_6-31g(d).smash.inp (generated)

004156638.b3lyp_6-31g(d).nwchem.inp (generated) 004156638.b3lyp_6-31g(d).log.xz 004156638.td-b3lyp_6-31g+(d).inp 004156638.td-b3lyp_6-31g+(d).log.xz

004156638.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156638.td-b3lyp_6-31+g(d).gjf (generated)

004156638.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156638.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156638.mol 004156638.PUBCHEM 004156638.mol (via Jmol)
004156639.b3lyp_6-31g(d).inp

004156639.b3lyp_6-31g(d).qchem.inp (generated)

004156639.b3lyp_6-31g(d).gjf (generated)

004156639.b3lyp_6-31g(d).firefly.inp (generated)

004156639.b3lyp_6-31g(d).smash.inp (generated)

004156639.b3lyp_6-31g(d).nwchem.inp (generated) 004156639.b3lyp_6-31g(d).log.xz 004156639.td-b3lyp_6-31g+(d).inp 004156639.td-b3lyp_6-31g+(d).log.xz

004156639.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156639.td-b3lyp_6-31+g(d).gjf (generated)

004156639.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156639.mol 004156639.PUBCHEM 004156639.mol (via Jmol)
004156657.b3lyp_6-31g(d).inp

004156657.b3lyp_6-31g(d).qchem.inp (generated)

004156657.b3lyp_6-31g(d).gjf (generated)

004156657.b3lyp_6-31g(d).firefly.inp (generated)

004156657.b3lyp_6-31g(d).smash.inp (generated)

004156657.b3lyp_6-31g(d).nwchem.inp (generated) 004156657.b3lyp_6-31g(d).log.xz 004156657.td-b3lyp_6-31g+(d).inp 004156657.td-b3lyp_6-31g+(d).log.xz

004156657.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156657.td-b3lyp_6-31+g(d).gjf (generated)

004156657.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156657.mol 004156657.PUBCHEM 004156657.mol (via Jmol)
004156662.b3lyp_6-31g(d).inp

004156662.b3lyp_6-31g(d).qchem.inp (generated)

004156662.b3lyp_6-31g(d).gjf (generated)

004156662.b3lyp_6-31g(d).firefly.inp (generated)

004156662.b3lyp_6-31g(d).smash.inp (generated)

004156662.b3lyp_6-31g(d).nwchem.inp (generated) 004156662.b3lyp_6-31g(d).log.xz 004156662.td-b3lyp_6-31g+(d).inp 004156662.td-b3lyp_6-31g+(d).log.xz

004156662.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156662.td-b3lyp_6-31+g(d).gjf (generated)

004156662.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156662.mol 004156662.PUBCHEM 004156662.mol (via Jmol)
004156749.b3lyp_6-31g(d).inp

004156749.b3lyp_6-31g(d).qchem.inp (generated)

004156749.b3lyp_6-31g(d).gjf (generated)

004156749.b3lyp_6-31g(d).firefly.inp (generated)

004156749.b3lyp_6-31g(d).smash.inp (generated)

004156749.b3lyp_6-31g(d).nwchem.inp (generated) 004156749.b3lyp_6-31g(d).log.xz 004156749.td-b3lyp_6-31g+(d).inp 004156749.td-b3lyp_6-31g+(d).log.xz

004156749.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156749.td-b3lyp_6-31+g(d).gjf (generated)

004156749.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156749.mol 004156749.PUBCHEM 004156749.mol (via Jmol)
004156762.b3lyp_6-31g(d).inp

004156762.b3lyp_6-31g(d).qchem.inp (generated)

004156762.b3lyp_6-31g(d).gjf (generated)

004156762.b3lyp_6-31g(d).firefly.inp (generated)

004156762.b3lyp_6-31g(d).smash.inp (generated)

004156762.b3lyp_6-31g(d).nwchem.inp (generated) 004156762.b3lyp_6-31g(d).log.xz 004156762.td-b3lyp_6-31g+(d).inp 004156762.td-b3lyp_6-31g+(d).log.xz

004156762.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156762.td-b3lyp_6-31+g(d).gjf (generated)

004156762.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156762.mol 004156762.PUBCHEM 004156762.mol (via Jmol)
004156799.b3lyp_6-31g(d).inp

004156799.b3lyp_6-31g(d).qchem.inp (generated)

004156799.b3lyp_6-31g(d).gjf (generated)

004156799.b3lyp_6-31g(d).firefly.inp (generated)

004156799.b3lyp_6-31g(d).smash.inp (generated)

004156799.b3lyp_6-31g(d).nwchem.inp (generated) 004156799.b3lyp_6-31g(d).log.xz 004156799.td-b3lyp_6-31g+(d).inp 004156799.td-b3lyp_6-31g+(d).log.xz

004156799.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156799.td-b3lyp_6-31+g(d).gjf (generated)

004156799.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156799.mol 004156799.PUBCHEM 004156799.mol (via Jmol)
004156804.b3lyp_6-31g(d).inp

004156804.b3lyp_6-31g(d).qchem.inp (generated)

004156804.b3lyp_6-31g(d).gjf (generated)

004156804.b3lyp_6-31g(d).firefly.inp (generated)

004156804.b3lyp_6-31g(d).smash.inp (generated)

004156804.b3lyp_6-31g(d).nwchem.inp (generated) 004156804.b3lyp_6-31g(d).log.xz 004156804.td-b3lyp_6-31g+(d).inp 004156804.td-b3lyp_6-31g+(d).log.xz

004156804.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156804.td-b3lyp_6-31+g(d).gjf (generated)

004156804.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156804.mol 004156804.PUBCHEM 004156804.mol (via Jmol)
004156805.b3lyp_6-31g(d).inp

004156805.b3lyp_6-31g(d).qchem.inp (generated)

004156805.b3lyp_6-31g(d).gjf (generated)

004156805.b3lyp_6-31g(d).firefly.inp (generated)

004156805.b3lyp_6-31g(d).smash.inp (generated)

004156805.b3lyp_6-31g(d).nwchem.inp (generated) 004156805.b3lyp_6-31g(d).log.xz 004156805.td-b3lyp_6-31g+(d).inp 004156805.td-b3lyp_6-31g+(d).log.xz

004156805.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156805.td-b3lyp_6-31+g(d).gjf (generated)

004156805.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156805.mol 004156805.PUBCHEM 004156805.mol (via Jmol)
004156825.b3lyp_6-31g(d).inp

004156825.b3lyp_6-31g(d).qchem.inp (generated)

004156825.b3lyp_6-31g(d).gjf (generated)

004156825.b3lyp_6-31g(d).firefly.inp (generated)

004156825.b3lyp_6-31g(d).smash.inp (generated)

004156825.b3lyp_6-31g(d).nwchem.inp (generated) 004156825.b3lyp_6-31g(d).log.xz 004156825.td-b3lyp_6-31g+(d).inp 004156825.td-b3lyp_6-31g+(d).log.xz

004156825.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156825.td-b3lyp_6-31+g(d).gjf (generated)

004156825.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156825.mol 004156825.PUBCHEM 004156825.mol (via Jmol)
004156861.b3lyp_6-31g(d).inp

004156861.b3lyp_6-31g(d).qchem.inp (generated)

004156861.b3lyp_6-31g(d).gjf (generated)

004156861.b3lyp_6-31g(d).firefly.inp (generated)

004156861.b3lyp_6-31g(d).smash.inp (generated)

004156861.b3lyp_6-31g(d).nwchem.inp (generated) 004156861.b3lyp_6-31g(d).log.xz 004156861.td-b3lyp_6-31g+(d).inp 004156861.td-b3lyp_6-31g+(d).log.xz

004156861.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156861.td-b3lyp_6-31+g(d).gjf (generated)

004156861.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156861.mol 004156861.PUBCHEM 004156861.mol (via Jmol)
004156869.b3lyp_6-31g(d).inp

004156869.b3lyp_6-31g(d).qchem.inp (generated)

004156869.b3lyp_6-31g(d).gjf (generated)

004156869.b3lyp_6-31g(d).firefly.inp (generated)

004156869.b3lyp_6-31g(d).smash.inp (generated)

004156869.b3lyp_6-31g(d).nwchem.inp (generated) 004156869.b3lyp_6-31g(d).log.xz 004156869.td-b3lyp_6-31g+(d).inp 004156869.td-b3lyp_6-31g+(d).log.xz

004156869.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156869.td-b3lyp_6-31+g(d).gjf (generated)

004156869.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156869.mol 004156869.PUBCHEM 004156869.mol (via Jmol)
004156894.b3lyp_6-31g(d).inp

004156894.b3lyp_6-31g(d).qchem.inp (generated)

004156894.b3lyp_6-31g(d).gjf (generated)

004156894.b3lyp_6-31g(d).firefly.inp (generated)

004156894.b3lyp_6-31g(d).smash.inp (generated)

004156894.b3lyp_6-31g(d).nwchem.inp (generated) 004156894.b3lyp_6-31g(d).log.xz 004156894.td-b3lyp_6-31g+(d).inp 004156894.td-b3lyp_6-31g+(d).log.xz

004156894.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156894.td-b3lyp_6-31+g(d).gjf (generated)

004156894.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156894.mol 004156894.PUBCHEM 004156894.mol (via Jmol)
004156895.b3lyp_6-31g(d).inp

004156895.b3lyp_6-31g(d).qchem.inp (generated)

004156895.b3lyp_6-31g(d).gjf (generated)

004156895.b3lyp_6-31g(d).firefly.inp (generated)

004156895.b3lyp_6-31g(d).smash.inp (generated)

004156895.b3lyp_6-31g(d).nwchem.inp (generated) 004156895.b3lyp_6-31g(d).log.xz 004156895.td-b3lyp_6-31g+(d).inp 004156895.td-b3lyp_6-31g+(d).log.xz

004156895.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156895.td-b3lyp_6-31+g(d).gjf (generated)

004156895.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156895.mol 004156895.PUBCHEM 004156895.mol (via Jmol)
004156907.b3lyp_6-31g(d).inp

004156907.b3lyp_6-31g(d).qchem.inp (generated)

004156907.b3lyp_6-31g(d).gjf (generated)

004156907.b3lyp_6-31g(d).firefly.inp (generated)

004156907.b3lyp_6-31g(d).smash.inp (generated)

004156907.b3lyp_6-31g(d).nwchem.inp (generated) 004156907.b3lyp_6-31g(d).log.xz 004156907.mol 004156907.PUBCHEM 004156907.mol (via Jmol)
004156937.b3lyp_6-31g(d).inp

004156937.b3lyp_6-31g(d).qchem.inp (generated)

004156937.b3lyp_6-31g(d).gjf (generated)

004156937.b3lyp_6-31g(d).firefly.inp (generated)

004156937.b3lyp_6-31g(d).smash.inp (generated)

004156937.b3lyp_6-31g(d).nwchem.inp (generated) 004156937.b3lyp_6-31g(d).log.xz 004156937.td-b3lyp_6-31g+(d).inp 004156937.td-b3lyp_6-31g+(d).log.xz

004156937.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156937.td-b3lyp_6-31+g(d).gjf (generated)

004156937.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156937.mol 004156937.PUBCHEM 004156937.mol (via Jmol)
004156948.b3lyp_6-31g(d).inp

004156948.b3lyp_6-31g(d).qchem.inp (generated)

004156948.b3lyp_6-31g(d).gjf (generated)

004156948.b3lyp_6-31g(d).firefly.inp (generated)

004156948.b3lyp_6-31g(d).smash.inp (generated)

004156948.b3lyp_6-31g(d).nwchem.inp (generated) 004156948.b3lyp_6-31g(d).log.xz 004156948.td-b3lyp_6-31g+(d).inp 004156948.td-b3lyp_6-31g+(d).log.xz

004156948.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156948.td-b3lyp_6-31+g(d).gjf (generated)

004156948.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156948.mol 004156948.PUBCHEM 004156948.mol (via Jmol)
004156968.b3lyp_6-31g(d).inp

004156968.b3lyp_6-31g(d).qchem.inp (generated)

004156968.b3lyp_6-31g(d).gjf (generated)

004156968.b3lyp_6-31g(d).firefly.inp (generated)

004156968.b3lyp_6-31g(d).smash.inp (generated)

004156968.b3lyp_6-31g(d).nwchem.inp (generated) 004156968.b3lyp_6-31g(d).log.xz 004156968.td-b3lyp_6-31g+(d).inp 004156968.td-b3lyp_6-31g+(d).log.xz

004156968.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156968.td-b3lyp_6-31+g(d).gjf (generated)

004156968.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156968.mol 004156968.PUBCHEM 004156968.mol (via Jmol)
004156981.b3lyp_6-31g(d).inp

004156981.b3lyp_6-31g(d).qchem.inp (generated)

004156981.b3lyp_6-31g(d).gjf (generated)

004156981.b3lyp_6-31g(d).firefly.inp (generated)

004156981.b3lyp_6-31g(d).smash.inp (generated)

004156981.b3lyp_6-31g(d).nwchem.inp (generated) 004156981.b3lyp_6-31g(d).log.xz 004156981.td-b3lyp_6-31g+(d).inp 004156981.td-b3lyp_6-31g+(d).log.xz

004156981.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156981.td-b3lyp_6-31+g(d).gjf (generated)

004156981.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156981.mol 004156981.PUBCHEM 004156981.mol (via Jmol)
004156986.b3lyp_6-31g(d).inp

004156986.b3lyp_6-31g(d).qchem.inp (generated)

004156986.b3lyp_6-31g(d).gjf (generated)

004156986.b3lyp_6-31g(d).firefly.inp (generated)

004156986.b3lyp_6-31g(d).smash.inp (generated)

004156986.b3lyp_6-31g(d).nwchem.inp (generated) 004156986.b3lyp_6-31g(d).log.xz 004156986.td-b3lyp_6-31g+(d).inp 004156986.td-b3lyp_6-31g+(d).log.xz

004156986.td-b3lyp_6-31+g(d).qchem.inp (generated)

004156986.td-b3lyp_6-31+g(d).gjf (generated)

004156986.td-b3lyp_6-31+g(d).firefly.inp (generated)

004156986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004156986.mol 004156986.PUBCHEM 004156986.mol (via Jmol)
004157007.b3lyp_6-31g(d).inp

004157007.b3lyp_6-31g(d).qchem.inp (generated)

004157007.b3lyp_6-31g(d).gjf (generated)

004157007.b3lyp_6-31g(d).firefly.inp (generated)

004157007.b3lyp_6-31g(d).smash.inp (generated)

004157007.b3lyp_6-31g(d).nwchem.inp (generated) 004157007.b3lyp_6-31g(d).log.xz 004157007.td-b3lyp_6-31g+(d).inp 004157007.td-b3lyp_6-31g+(d).log.xz

004157007.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157007.td-b3lyp_6-31+g(d).gjf (generated)

004157007.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157007.mol 004157007.PUBCHEM 004157007.mol (via Jmol)
004157008.b3lyp_6-31g(d).inp

004157008.b3lyp_6-31g(d).qchem.inp (generated)

004157008.b3lyp_6-31g(d).gjf (generated)

004157008.b3lyp_6-31g(d).firefly.inp (generated)

004157008.b3lyp_6-31g(d).smash.inp (generated)

004157008.b3lyp_6-31g(d).nwchem.inp (generated) 004157008.b3lyp_6-31g(d).log.xz 004157008.td-b3lyp_6-31g+(d).inp 004157008.td-b3lyp_6-31g+(d).log.xz

004157008.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157008.td-b3lyp_6-31+g(d).gjf (generated)

004157008.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157008.mol 004157008.PUBCHEM 004157008.mol (via Jmol)
004157065.b3lyp_6-31g(d).inp

004157065.b3lyp_6-31g(d).qchem.inp (generated)

004157065.b3lyp_6-31g(d).gjf (generated)

004157065.b3lyp_6-31g(d).firefly.inp (generated)

004157065.b3lyp_6-31g(d).smash.inp (generated)

004157065.b3lyp_6-31g(d).nwchem.inp (generated) 004157065.b3lyp_6-31g(d).log.xz 004157065.td-b3lyp_6-31g+(d).inp 004157065.td-b3lyp_6-31g+(d).log.xz

004157065.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157065.td-b3lyp_6-31+g(d).gjf (generated)

004157065.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157065.mol 004157065.PUBCHEM 004157065.mol (via Jmol)
004157075.b3lyp_6-31g(d).inp

004157075.b3lyp_6-31g(d).qchem.inp (generated)

004157075.b3lyp_6-31g(d).gjf (generated)

004157075.b3lyp_6-31g(d).firefly.inp (generated)

004157075.b3lyp_6-31g(d).smash.inp (generated)

004157075.b3lyp_6-31g(d).nwchem.inp (generated) 004157075.b3lyp_6-31g(d).log.xz 004157075.td-b3lyp_6-31g+(d).inp 004157075.td-b3lyp_6-31g+(d).log.xz

004157075.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157075.td-b3lyp_6-31+g(d).gjf (generated)

004157075.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157075.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157075.mol 004157075.PUBCHEM 004157075.mol (via Jmol)
004157089.b3lyp_6-31g(d).inp

004157089.b3lyp_6-31g(d).qchem.inp (generated)

004157089.b3lyp_6-31g(d).gjf (generated)

004157089.b3lyp_6-31g(d).firefly.inp (generated)

004157089.b3lyp_6-31g(d).smash.inp (generated)

004157089.b3lyp_6-31g(d).nwchem.inp (generated) 004157089.b3lyp_6-31g(d).log.xz 004157089.td-b3lyp_6-31g+(d).inp 004157089.td-b3lyp_6-31g+(d).log.xz

004157089.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157089.td-b3lyp_6-31+g(d).gjf (generated)

004157089.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157089.mol 004157089.PUBCHEM 004157089.mol (via Jmol)
004157211.b3lyp_6-31g(d).inp

004157211.b3lyp_6-31g(d).qchem.inp (generated)

004157211.b3lyp_6-31g(d).gjf (generated)

004157211.b3lyp_6-31g(d).firefly.inp (generated)

004157211.b3lyp_6-31g(d).smash.inp (generated)

004157211.b3lyp_6-31g(d).nwchem.inp (generated) 004157211.b3lyp_6-31g(d).log.xz 004157211.td-b3lyp_6-31g+(d).inp 004157211.td-b3lyp_6-31g+(d).log.xz

004157211.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157211.td-b3lyp_6-31+g(d).gjf (generated)

004157211.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157211.mol 004157211.PUBCHEM 004157211.mol (via Jmol)
004157249.b3lyp_6-31g(d).inp

004157249.b3lyp_6-31g(d).qchem.inp (generated)

004157249.b3lyp_6-31g(d).gjf (generated)

004157249.b3lyp_6-31g(d).firefly.inp (generated)

004157249.b3lyp_6-31g(d).smash.inp (generated)

004157249.b3lyp_6-31g(d).nwchem.inp (generated) 004157249.b3lyp_6-31g(d).log.xz 004157249.td-b3lyp_6-31g+(d).inp 004157249.td-b3lyp_6-31g+(d).log.xz

004157249.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157249.td-b3lyp_6-31+g(d).gjf (generated)

004157249.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157249.mol 004157249.PUBCHEM 004157249.mol (via Jmol)
004157251.b3lyp_6-31g(d).inp

004157251.b3lyp_6-31g(d).qchem.inp (generated)

004157251.b3lyp_6-31g(d).gjf (generated)

004157251.b3lyp_6-31g(d).firefly.inp (generated)

004157251.b3lyp_6-31g(d).smash.inp (generated)

004157251.b3lyp_6-31g(d).nwchem.inp (generated) 004157251.b3lyp_6-31g(d).log.xz 004157251.td-b3lyp_6-31g+(d).inp 004157251.td-b3lyp_6-31g+(d).log.xz

004157251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157251.td-b3lyp_6-31+g(d).gjf (generated)

004157251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157251.mol 004157251.PUBCHEM 004157251.mol (via Jmol)
004157314.b3lyp_6-31g(d).inp

004157314.b3lyp_6-31g(d).qchem.inp (generated)

004157314.b3lyp_6-31g(d).gjf (generated)

004157314.b3lyp_6-31g(d).firefly.inp (generated)

004157314.b3lyp_6-31g(d).smash.inp (generated)

004157314.b3lyp_6-31g(d).nwchem.inp (generated) 004157314.b3lyp_6-31g(d).log.xz 004157314.td-b3lyp_6-31g+(d).inp 004157314.td-b3lyp_6-31g+(d).log.xz

004157314.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157314.td-b3lyp_6-31+g(d).gjf (generated)

004157314.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157314.mol 004157314.PUBCHEM 004157314.mol (via Jmol)
004157315.b3lyp_6-31g(d).inp

004157315.b3lyp_6-31g(d).qchem.inp (generated)

004157315.b3lyp_6-31g(d).gjf (generated)

004157315.b3lyp_6-31g(d).firefly.inp (generated)

004157315.b3lyp_6-31g(d).smash.inp (generated)

004157315.b3lyp_6-31g(d).nwchem.inp (generated) 004157315.b3lyp_6-31g(d).log.xz 004157315.td-b3lyp_6-31g+(d).inp 004157315.td-b3lyp_6-31g+(d).log.xz

004157315.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157315.td-b3lyp_6-31+g(d).gjf (generated)

004157315.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157315.mol 004157315.PUBCHEM 004157315.mol (via Jmol)
004157317.b3lyp_6-31g(d).inp

004157317.b3lyp_6-31g(d).qchem.inp (generated)

004157317.b3lyp_6-31g(d).gjf (generated)

004157317.b3lyp_6-31g(d).firefly.inp (generated)

004157317.b3lyp_6-31g(d).smash.inp (generated)

004157317.b3lyp_6-31g(d).nwchem.inp (generated) 004157317.b3lyp_6-31g(d).log.xz 004157317.td-b3lyp_6-31g+(d).inp 004157317.td-b3lyp_6-31g+(d).log.xz

004157317.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157317.td-b3lyp_6-31+g(d).gjf (generated)

004157317.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157317.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157317.mol 004157317.PUBCHEM 004157317.mol (via Jmol)
004157323.b3lyp_6-31g(d).inp

004157323.b3lyp_6-31g(d).qchem.inp (generated)

004157323.b3lyp_6-31g(d).gjf (generated)

004157323.b3lyp_6-31g(d).firefly.inp (generated)

004157323.b3lyp_6-31g(d).smash.inp (generated)

004157323.b3lyp_6-31g(d).nwchem.inp (generated) 004157323.b3lyp_6-31g(d).log.xz 004157323.td-b3lyp_6-31g+(d).inp 004157323.td-b3lyp_6-31g+(d).log.xz

004157323.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157323.td-b3lyp_6-31+g(d).gjf (generated)

004157323.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157323.mol 004157323.PUBCHEM 004157323.mol (via Jmol)
004157411.b3lyp_6-31g(d).inp

004157411.b3lyp_6-31g(d).qchem.inp (generated)

004157411.b3lyp_6-31g(d).gjf (generated)

004157411.b3lyp_6-31g(d).firefly.inp (generated)

004157411.b3lyp_6-31g(d).smash.inp (generated)

004157411.b3lyp_6-31g(d).nwchem.inp (generated) 004157411.b3lyp_6-31g(d).log.xz 004157411.td-b3lyp_6-31g+(d).inp 004157411.td-b3lyp_6-31g+(d).log.xz

004157411.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157411.td-b3lyp_6-31+g(d).gjf (generated)

004157411.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157411.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157411.mol 004157411.PUBCHEM 004157411.mol (via Jmol)
004157423.b3lyp_6-31g(d).inp

004157423.b3lyp_6-31g(d).qchem.inp (generated)

004157423.b3lyp_6-31g(d).gjf (generated)

004157423.b3lyp_6-31g(d).firefly.inp (generated)

004157423.b3lyp_6-31g(d).smash.inp (generated)

004157423.b3lyp_6-31g(d).nwchem.inp (generated) 004157423.b3lyp_6-31g(d).log.xz 004157423.td-b3lyp_6-31g+(d).inp 004157423.td-b3lyp_6-31g+(d).log.xz

004157423.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157423.td-b3lyp_6-31+g(d).gjf (generated)

004157423.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157423.mol 004157423.PUBCHEM 004157423.mol (via Jmol)
004157425.b3lyp_6-31g(d).inp

004157425.b3lyp_6-31g(d).qchem.inp (generated)

004157425.b3lyp_6-31g(d).gjf (generated)

004157425.b3lyp_6-31g(d).firefly.inp (generated)

004157425.b3lyp_6-31g(d).smash.inp (generated)

004157425.b3lyp_6-31g(d).nwchem.inp (generated) 004157425.b3lyp_6-31g(d).log.xz 004157425.td-b3lyp_6-31g+(d).inp 004157425.td-b3lyp_6-31g+(d).log.xz

004157425.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157425.td-b3lyp_6-31+g(d).gjf (generated)

004157425.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157425.mol 004157425.PUBCHEM 004157425.mol (via Jmol)
004157426.b3lyp_6-31g(d).inp

004157426.b3lyp_6-31g(d).qchem.inp (generated)

004157426.b3lyp_6-31g(d).gjf (generated)

004157426.b3lyp_6-31g(d).firefly.inp (generated)

004157426.b3lyp_6-31g(d).smash.inp (generated)

004157426.b3lyp_6-31g(d).nwchem.inp (generated) 004157426.b3lyp_6-31g(d).log.xz 004157426.td-b3lyp_6-31g+(d).inp 004157426.td-b3lyp_6-31g+(d).log.xz

004157426.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157426.td-b3lyp_6-31+g(d).gjf (generated)

004157426.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157426.mol 004157426.PUBCHEM 004157426.mol (via Jmol)
004157428.b3lyp_6-31g(d).inp

004157428.b3lyp_6-31g(d).qchem.inp (generated)

004157428.b3lyp_6-31g(d).gjf (generated)

004157428.b3lyp_6-31g(d).firefly.inp (generated)

004157428.b3lyp_6-31g(d).smash.inp (generated)

004157428.b3lyp_6-31g(d).nwchem.inp (generated) 004157428.b3lyp_6-31g(d).log.xz 004157428.td-b3lyp_6-31g+(d).inp 004157428.td-b3lyp_6-31g+(d).log.xz

004157428.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157428.td-b3lyp_6-31+g(d).gjf (generated)

004157428.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157428.mol 004157428.PUBCHEM 004157428.mol (via Jmol)
004157461.b3lyp_6-31g(d).inp

004157461.b3lyp_6-31g(d).qchem.inp (generated)

004157461.b3lyp_6-31g(d).gjf (generated)

004157461.b3lyp_6-31g(d).firefly.inp (generated)

004157461.b3lyp_6-31g(d).smash.inp (generated)

004157461.b3lyp_6-31g(d).nwchem.inp (generated) 004157461.b3lyp_6-31g(d).log.xz 004157461.td-b3lyp_6-31g+(d).inp 004157461.td-b3lyp_6-31g+(d).log.xz

004157461.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157461.td-b3lyp_6-31+g(d).gjf (generated)

004157461.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157461.mol 004157461.PUBCHEM 004157461.mol (via Jmol)
004157477.b3lyp_6-31g(d).inp

004157477.b3lyp_6-31g(d).qchem.inp (generated)

004157477.b3lyp_6-31g(d).gjf (generated)

004157477.b3lyp_6-31g(d).firefly.inp (generated)

004157477.b3lyp_6-31g(d).smash.inp (generated)

004157477.b3lyp_6-31g(d).nwchem.inp (generated) 004157477.b3lyp_6-31g(d).log.xz 004157477.td-b3lyp_6-31g+(d).inp 004157477.td-b3lyp_6-31g+(d).log.xz

004157477.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157477.td-b3lyp_6-31+g(d).gjf (generated)

004157477.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157477.mol 004157477.PUBCHEM 004157477.mol (via Jmol)
004157511.b3lyp_6-31g(d).inp

004157511.b3lyp_6-31g(d).qchem.inp (generated)

004157511.b3lyp_6-31g(d).gjf (generated)

004157511.b3lyp_6-31g(d).firefly.inp (generated)

004157511.b3lyp_6-31g(d).smash.inp (generated)

004157511.b3lyp_6-31g(d).nwchem.inp (generated) 004157511.b3lyp_6-31g(d).log.xz 004157511.td-b3lyp_6-31g+(d).inp 004157511.td-b3lyp_6-31g+(d).log.xz

004157511.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157511.td-b3lyp_6-31+g(d).gjf (generated)

004157511.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157511.mol 004157511.PUBCHEM 004157511.mol (via Jmol)
004157531.b3lyp_6-31g(d).inp

004157531.b3lyp_6-31g(d).qchem.inp (generated)

004157531.b3lyp_6-31g(d).gjf (generated)

004157531.b3lyp_6-31g(d).firefly.inp (generated)

004157531.b3lyp_6-31g(d).smash.inp (generated)

004157531.b3lyp_6-31g(d).nwchem.inp (generated) 004157531.b3lyp_6-31g(d).log.xz 004157531.td-b3lyp_6-31g+(d).inp 004157531.td-b3lyp_6-31g+(d).log.xz

004157531.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157531.td-b3lyp_6-31+g(d).gjf (generated)

004157531.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157531.mol 004157531.PUBCHEM 004157531.mol (via Jmol)
004157532.b3lyp_6-31g(d).inp

004157532.b3lyp_6-31g(d).qchem.inp (generated)

004157532.b3lyp_6-31g(d).gjf (generated)

004157532.b3lyp_6-31g(d).firefly.inp (generated)

004157532.b3lyp_6-31g(d).smash.inp (generated)

004157532.b3lyp_6-31g(d).nwchem.inp (generated) 004157532.b3lyp_6-31g(d).log.xz 004157532.td-b3lyp_6-31g+(d).inp 004157532.td-b3lyp_6-31g+(d).log.xz

004157532.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157532.td-b3lyp_6-31+g(d).gjf (generated)

004157532.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157532.mol 004157532.PUBCHEM 004157532.mol (via Jmol)
004157533.b3lyp_6-31g(d).inp

004157533.b3lyp_6-31g(d).qchem.inp (generated)

004157533.b3lyp_6-31g(d).gjf (generated)

004157533.b3lyp_6-31g(d).firefly.inp (generated)

004157533.b3lyp_6-31g(d).smash.inp (generated)

004157533.b3lyp_6-31g(d).nwchem.inp (generated) 004157533.b3lyp_6-31g(d).log.xz 004157533.mol 004157533.PUBCHEM 004157533.mol (via Jmol)
004157537.b3lyp_6-31g(d).inp

004157537.b3lyp_6-31g(d).qchem.inp (generated)

004157537.b3lyp_6-31g(d).gjf (generated)

004157537.b3lyp_6-31g(d).firefly.inp (generated)

004157537.b3lyp_6-31g(d).smash.inp (generated)

004157537.b3lyp_6-31g(d).nwchem.inp (generated) 004157537.b3lyp_6-31g(d).log.xz 004157537.td-b3lyp_6-31g+(d).inp 004157537.td-b3lyp_6-31g+(d).log.xz

004157537.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157537.td-b3lyp_6-31+g(d).gjf (generated)

004157537.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157537.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157537.mol 004157537.PUBCHEM 004157537.mol (via Jmol)
004157551.b3lyp_6-31g(d).inp

004157551.b3lyp_6-31g(d).qchem.inp (generated)

004157551.b3lyp_6-31g(d).gjf (generated)

004157551.b3lyp_6-31g(d).firefly.inp (generated)

004157551.b3lyp_6-31g(d).smash.inp (generated)

004157551.b3lyp_6-31g(d).nwchem.inp (generated) 004157551.b3lyp_6-31g(d).log.xz 004157551.td-b3lyp_6-31g+(d).inp 004157551.td-b3lyp_6-31g+(d).log.xz

004157551.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157551.td-b3lyp_6-31+g(d).gjf (generated)

004157551.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157551.mol 004157551.PUBCHEM 004157551.mol (via Jmol)
004157555.b3lyp_6-31g(d).inp

004157555.b3lyp_6-31g(d).qchem.inp (generated)

004157555.b3lyp_6-31g(d).gjf (generated)

004157555.b3lyp_6-31g(d).firefly.inp (generated)

004157555.b3lyp_6-31g(d).smash.inp (generated)

004157555.b3lyp_6-31g(d).nwchem.inp (generated) 004157555.b3lyp_6-31g(d).log.xz 004157555.td-b3lyp_6-31g+(d).inp 004157555.td-b3lyp_6-31g+(d).log.xz

004157555.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157555.td-b3lyp_6-31+g(d).gjf (generated)

004157555.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157555.mol 004157555.PUBCHEM 004157555.mol (via Jmol)
004157579.b3lyp_6-31g(d).inp

004157579.b3lyp_6-31g(d).qchem.inp (generated)

004157579.b3lyp_6-31g(d).gjf (generated)

004157579.b3lyp_6-31g(d).firefly.inp (generated)

004157579.b3lyp_6-31g(d).smash.inp (generated)

004157579.b3lyp_6-31g(d).nwchem.inp (generated) 004157579.b3lyp_6-31g(d).log.xz 004157579.td-b3lyp_6-31g+(d).inp 004157579.td-b3lyp_6-31g+(d).log.xz

004157579.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157579.td-b3lyp_6-31+g(d).gjf (generated)

004157579.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157579.mol 004157579.PUBCHEM 004157579.mol (via Jmol)
004157584.b3lyp_6-31g(d).inp

004157584.b3lyp_6-31g(d).qchem.inp (generated)

004157584.b3lyp_6-31g(d).gjf (generated)

004157584.b3lyp_6-31g(d).firefly.inp (generated)

004157584.b3lyp_6-31g(d).smash.inp (generated)

004157584.b3lyp_6-31g(d).nwchem.inp (generated) 004157584.b3lyp_6-31g(d).log.xz 004157584.td-b3lyp_6-31g+(d).inp 004157584.td-b3lyp_6-31g+(d).log.xz

004157584.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157584.td-b3lyp_6-31+g(d).gjf (generated)

004157584.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157584.mol 004157584.PUBCHEM 004157584.mol (via Jmol)
004157588.b3lyp_6-31g(d).inp

004157588.b3lyp_6-31g(d).qchem.inp (generated)

004157588.b3lyp_6-31g(d).gjf (generated)

004157588.b3lyp_6-31g(d).firefly.inp (generated)

004157588.b3lyp_6-31g(d).smash.inp (generated)

004157588.b3lyp_6-31g(d).nwchem.inp (generated) 004157588.b3lyp_6-31g(d).log.xz 004157588.td-b3lyp_6-31g+(d).inp 004157588.td-b3lyp_6-31g+(d).log.xz

004157588.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157588.td-b3lyp_6-31+g(d).gjf (generated)

004157588.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157588.mol 004157588.PUBCHEM 004157588.mol (via Jmol)
004157617.b3lyp_6-31g(d).inp

004157617.b3lyp_6-31g(d).qchem.inp (generated)

004157617.b3lyp_6-31g(d).gjf (generated)

004157617.b3lyp_6-31g(d).firefly.inp (generated)

004157617.b3lyp_6-31g(d).smash.inp (generated)

004157617.b3lyp_6-31g(d).nwchem.inp (generated) 004157617.b3lyp_6-31g(d).log.xz 004157617.mol 004157617.PUBCHEM 004157617.mol (via Jmol)
004157714.b3lyp_6-31g(d).inp

004157714.b3lyp_6-31g(d).qchem.inp (generated)

004157714.b3lyp_6-31g(d).gjf (generated)

004157714.b3lyp_6-31g(d).firefly.inp (generated)

004157714.b3lyp_6-31g(d).smash.inp (generated)

004157714.b3lyp_6-31g(d).nwchem.inp (generated) 004157714.b3lyp_6-31g(d).log.xz 004157714.td-b3lyp_6-31g+(d).inp 004157714.td-b3lyp_6-31g+(d).log.xz

004157714.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157714.td-b3lyp_6-31+g(d).gjf (generated)

004157714.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157714.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157714.mol 004157714.PUBCHEM 004157714.mol (via Jmol)
004157745.b3lyp_6-31g(d).inp

004157745.b3lyp_6-31g(d).qchem.inp (generated)

004157745.b3lyp_6-31g(d).gjf (generated)

004157745.b3lyp_6-31g(d).firefly.inp (generated)

004157745.b3lyp_6-31g(d).smash.inp (generated)

004157745.b3lyp_6-31g(d).nwchem.inp (generated) 004157745.b3lyp_6-31g(d).log.xz 004157745.td-b3lyp_6-31g+(d).inp 004157745.td-b3lyp_6-31g+(d).log.xz

004157745.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157745.td-b3lyp_6-31+g(d).gjf (generated)

004157745.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157745.mol 004157745.PUBCHEM 004157745.mol (via Jmol)
004157750.b3lyp_6-31g(d).inp

004157750.b3lyp_6-31g(d).qchem.inp (generated)

004157750.b3lyp_6-31g(d).gjf (generated)

004157750.b3lyp_6-31g(d).firefly.inp (generated)

004157750.b3lyp_6-31g(d).smash.inp (generated)

004157750.b3lyp_6-31g(d).nwchem.inp (generated) 004157750.b3lyp_6-31g(d).log.xz 004157750.mol 004157750.PUBCHEM 004157750.mol (via Jmol)
004157759.b3lyp_6-31g(d).inp

004157759.b3lyp_6-31g(d).qchem.inp (generated)

004157759.b3lyp_6-31g(d).gjf (generated)

004157759.b3lyp_6-31g(d).firefly.inp (generated)

004157759.b3lyp_6-31g(d).smash.inp (generated)

004157759.b3lyp_6-31g(d).nwchem.inp (generated) 004157759.b3lyp_6-31g(d).log.xz 004157759.td-b3lyp_6-31g+(d).inp 004157759.td-b3lyp_6-31g+(d).log.xz

004157759.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157759.td-b3lyp_6-31+g(d).gjf (generated)

004157759.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157759.mol 004157759.PUBCHEM 004157759.mol (via Jmol)
004157760.b3lyp_6-31g(d).inp

004157760.b3lyp_6-31g(d).qchem.inp (generated)

004157760.b3lyp_6-31g(d).gjf (generated)

004157760.b3lyp_6-31g(d).firefly.inp (generated)

004157760.b3lyp_6-31g(d).smash.inp (generated)

004157760.b3lyp_6-31g(d).nwchem.inp (generated) 004157760.b3lyp_6-31g(d).log.xz 004157760.mol 004157760.PUBCHEM 004157760.mol (via Jmol)
004157797.b3lyp_6-31g(d).inp

004157797.b3lyp_6-31g(d).qchem.inp (generated)

004157797.b3lyp_6-31g(d).gjf (generated)

004157797.b3lyp_6-31g(d).firefly.inp (generated)

004157797.b3lyp_6-31g(d).smash.inp (generated)

004157797.b3lyp_6-31g(d).nwchem.inp (generated) 004157797.b3lyp_6-31g(d).log.xz 004157797.td-b3lyp_6-31g+(d).inp 004157797.td-b3lyp_6-31g+(d).log.xz

004157797.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157797.td-b3lyp_6-31+g(d).gjf (generated)

004157797.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157797.mol 004157797.PUBCHEM 004157797.mol (via Jmol)
004157836.b3lyp_6-31g(d).inp

004157836.b3lyp_6-31g(d).qchem.inp (generated)

004157836.b3lyp_6-31g(d).gjf (generated)

004157836.b3lyp_6-31g(d).firefly.inp (generated)

004157836.b3lyp_6-31g(d).smash.inp (generated)

004157836.b3lyp_6-31g(d).nwchem.inp (generated) 004157836.b3lyp_6-31g(d).log.xz 004157836.td-b3lyp_6-31g+(d).inp 004157836.td-b3lyp_6-31g+(d).log.xz

004157836.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157836.td-b3lyp_6-31+g(d).gjf (generated)

004157836.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157836.mol 004157836.PUBCHEM 004157836.mol (via Jmol)
004157973.b3lyp_6-31g(d).inp

004157973.b3lyp_6-31g(d).qchem.inp (generated)

004157973.b3lyp_6-31g(d).gjf (generated)

004157973.b3lyp_6-31g(d).firefly.inp (generated)

004157973.b3lyp_6-31g(d).smash.inp (generated)

004157973.b3lyp_6-31g(d).nwchem.inp (generated) 004157973.b3lyp_6-31g(d).log.xz 004157973.td-b3lyp_6-31g+(d).inp 004157973.td-b3lyp_6-31g+(d).log.xz

004157973.td-b3lyp_6-31+g(d).qchem.inp (generated)

004157973.td-b3lyp_6-31+g(d).gjf (generated)

004157973.td-b3lyp_6-31+g(d).firefly.inp (generated)

004157973.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004157973.mol 004157973.PUBCHEM 004157973.mol (via Jmol)
004158025.b3lyp_6-31g(d).inp

004158025.b3lyp_6-31g(d).qchem.inp (generated)

004158025.b3lyp_6-31g(d).gjf (generated)

004158025.b3lyp_6-31g(d).firefly.inp (generated)

004158025.b3lyp_6-31g(d).smash.inp (generated)

004158025.b3lyp_6-31g(d).nwchem.inp (generated) 004158025.b3lyp_6-31g(d).log.xz 004158025.td-b3lyp_6-31g+(d).inp 004158025.td-b3lyp_6-31g+(d).log.xz

004158025.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158025.td-b3lyp_6-31+g(d).gjf (generated)

004158025.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158025.mol 004158025.PUBCHEM 004158025.mol (via Jmol)
004158164.b3lyp_6-31g(d).inp

004158164.b3lyp_6-31g(d).qchem.inp (generated)

004158164.b3lyp_6-31g(d).gjf (generated)

004158164.b3lyp_6-31g(d).firefly.inp (generated)

004158164.b3lyp_6-31g(d).smash.inp (generated)

004158164.b3lyp_6-31g(d).nwchem.inp (generated) 004158164.b3lyp_6-31g(d).log.xz 004158164.td-b3lyp_6-31g+(d).inp 004158164.td-b3lyp_6-31g+(d).log.xz

004158164.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158164.td-b3lyp_6-31+g(d).gjf (generated)

004158164.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158164.mol 004158164.PUBCHEM 004158164.mol (via Jmol)
004158165.b3lyp_6-31g(d).inp

004158165.b3lyp_6-31g(d).qchem.inp (generated)

004158165.b3lyp_6-31g(d).gjf (generated)

004158165.b3lyp_6-31g(d).firefly.inp (generated)

004158165.b3lyp_6-31g(d).smash.inp (generated)

004158165.b3lyp_6-31g(d).nwchem.inp (generated) 004158165.b3lyp_6-31g(d).log.xz 004158165.td-b3lyp_6-31g+(d).inp 004158165.td-b3lyp_6-31g+(d).log.xz

004158165.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158165.td-b3lyp_6-31+g(d).gjf (generated)

004158165.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158165.mol 004158165.PUBCHEM 004158165.mol (via Jmol)
004158166.b3lyp_6-31g(d).inp

004158166.b3lyp_6-31g(d).qchem.inp (generated)

004158166.b3lyp_6-31g(d).gjf (generated)

004158166.b3lyp_6-31g(d).firefly.inp (generated)

004158166.b3lyp_6-31g(d).smash.inp (generated)

004158166.b3lyp_6-31g(d).nwchem.inp (generated) 004158166.b3lyp_6-31g(d).log.xz 004158166.td-b3lyp_6-31g+(d).inp 004158166.td-b3lyp_6-31g+(d).log.xz

004158166.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158166.td-b3lyp_6-31+g(d).gjf (generated)

004158166.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158166.mol 004158166.PUBCHEM 004158166.mol (via Jmol)
004158172.b3lyp_6-31g(d).inp

004158172.b3lyp_6-31g(d).qchem.inp (generated)

004158172.b3lyp_6-31g(d).gjf (generated)

004158172.b3lyp_6-31g(d).firefly.inp (generated)

004158172.b3lyp_6-31g(d).smash.inp (generated)

004158172.b3lyp_6-31g(d).nwchem.inp (generated) 004158172.b3lyp_6-31g(d).log.xz 004158172.td-b3lyp_6-31g+(d).inp 004158172.td-b3lyp_6-31g+(d).log.xz

004158172.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158172.td-b3lyp_6-31+g(d).gjf (generated)

004158172.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158172.mol 004158172.PUBCHEM 004158172.mol (via Jmol)
004158242.b3lyp_6-31g(d).inp

004158242.b3lyp_6-31g(d).qchem.inp (generated)

004158242.b3lyp_6-31g(d).gjf (generated)

004158242.b3lyp_6-31g(d).firefly.inp (generated)

004158242.b3lyp_6-31g(d).smash.inp (generated)

004158242.b3lyp_6-31g(d).nwchem.inp (generated) 004158242.b3lyp_6-31g(d).log.xz 004158242.td-b3lyp_6-31g+(d).inp 004158242.td-b3lyp_6-31g+(d).log.xz

004158242.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158242.td-b3lyp_6-31+g(d).gjf (generated)

004158242.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158242.mol 004158242.PUBCHEM 004158242.mol (via Jmol)
004158244.b3lyp_6-31g(d).inp

004158244.b3lyp_6-31g(d).qchem.inp (generated)

004158244.b3lyp_6-31g(d).gjf (generated)

004158244.b3lyp_6-31g(d).firefly.inp (generated)

004158244.b3lyp_6-31g(d).smash.inp (generated)

004158244.b3lyp_6-31g(d).nwchem.inp (generated) 004158244.b3lyp_6-31g(d).log.xz 004158244.mol 004158244.PUBCHEM 004158244.mol (via Jmol)
004158284.b3lyp_6-31g(d).inp

004158284.b3lyp_6-31g(d).qchem.inp (generated)

004158284.b3lyp_6-31g(d).gjf (generated)

004158284.b3lyp_6-31g(d).firefly.inp (generated)

004158284.b3lyp_6-31g(d).smash.inp (generated)

004158284.b3lyp_6-31g(d).nwchem.inp (generated) 004158284.b3lyp_6-31g(d).log.xz 004158284.td-b3lyp_6-31g+(d).inp 004158284.td-b3lyp_6-31g+(d).log.xz

004158284.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158284.td-b3lyp_6-31+g(d).gjf (generated)

004158284.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158284.mol 004158284.PUBCHEM 004158284.mol (via Jmol)
004158287.b3lyp_6-31g(d).inp

004158287.b3lyp_6-31g(d).qchem.inp (generated)

004158287.b3lyp_6-31g(d).gjf (generated)

004158287.b3lyp_6-31g(d).firefly.inp (generated)

004158287.b3lyp_6-31g(d).smash.inp (generated)

004158287.b3lyp_6-31g(d).nwchem.inp (generated) 004158287.b3lyp_6-31g(d).log.xz 004158287.td-b3lyp_6-31g+(d).inp 004158287.td-b3lyp_6-31g+(d).log.xz

004158287.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158287.td-b3lyp_6-31+g(d).gjf (generated)

004158287.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158287.mol 004158287.PUBCHEM 004158287.mol (via Jmol)
004158293.b3lyp_6-31g(d).inp

004158293.b3lyp_6-31g(d).qchem.inp (generated)

004158293.b3lyp_6-31g(d).gjf (generated)

004158293.b3lyp_6-31g(d).firefly.inp (generated)

004158293.b3lyp_6-31g(d).smash.inp (generated)

004158293.b3lyp_6-31g(d).nwchem.inp (generated) 004158293.b3lyp_6-31g(d).log.xz 004158293.td-b3lyp_6-31g+(d).inp 004158293.td-b3lyp_6-31g+(d).log.xz

004158293.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158293.td-b3lyp_6-31+g(d).gjf (generated)

004158293.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158293.mol 004158293.PUBCHEM 004158293.mol (via Jmol)
004158307.b3lyp_6-31g(d).inp

004158307.b3lyp_6-31g(d).qchem.inp (generated)

004158307.b3lyp_6-31g(d).gjf (generated)

004158307.b3lyp_6-31g(d).firefly.inp (generated)

004158307.b3lyp_6-31g(d).smash.inp (generated)

004158307.b3lyp_6-31g(d).nwchem.inp (generated) 004158307.b3lyp_6-31g(d).log.xz 004158307.mol 004158307.PUBCHEM 004158307.mol (via Jmol)
004158386.b3lyp_6-31g(d).inp

004158386.b3lyp_6-31g(d).qchem.inp (generated)

004158386.b3lyp_6-31g(d).gjf (generated)

004158386.b3lyp_6-31g(d).firefly.inp (generated)

004158386.b3lyp_6-31g(d).smash.inp (generated)

004158386.b3lyp_6-31g(d).nwchem.inp (generated) 004158386.b3lyp_6-31g(d).log.xz 004158386.td-b3lyp_6-31g+(d).inp 004158386.td-b3lyp_6-31g+(d).log.xz

004158386.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158386.td-b3lyp_6-31+g(d).gjf (generated)

004158386.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158386.mol 004158386.PUBCHEM 004158386.mol (via Jmol)
004158456.b3lyp_6-31g(d).inp

004158456.b3lyp_6-31g(d).qchem.inp (generated)

004158456.b3lyp_6-31g(d).gjf (generated)

004158456.b3lyp_6-31g(d).firefly.inp (generated)

004158456.b3lyp_6-31g(d).smash.inp (generated)

004158456.b3lyp_6-31g(d).nwchem.inp (generated) 004158456.b3lyp_6-31g(d).log.xz 004158456.mol 004158456.PUBCHEM 004158456.mol (via Jmol)
004158458.b3lyp_6-31g(d).inp

004158458.b3lyp_6-31g(d).qchem.inp (generated)

004158458.b3lyp_6-31g(d).gjf (generated)

004158458.b3lyp_6-31g(d).firefly.inp (generated)

004158458.b3lyp_6-31g(d).smash.inp (generated)

004158458.b3lyp_6-31g(d).nwchem.inp (generated) 004158458.b3lyp_6-31g(d).log.xz 004158458.td-b3lyp_6-31g+(d).inp 004158458.td-b3lyp_6-31g+(d).log.xz

004158458.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158458.td-b3lyp_6-31+g(d).gjf (generated)

004158458.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158458.mol 004158458.PUBCHEM 004158458.mol (via Jmol)
004158466.b3lyp_6-31g(d).inp

004158466.b3lyp_6-31g(d).qchem.inp (generated)

004158466.b3lyp_6-31g(d).gjf (generated)

004158466.b3lyp_6-31g(d).firefly.inp (generated)

004158466.b3lyp_6-31g(d).smash.inp (generated)

004158466.b3lyp_6-31g(d).nwchem.inp (generated) 004158466.b3lyp_6-31g(d).log.xz 004158466.mol 004158466.PUBCHEM 004158466.mol (via Jmol)
004158483.b3lyp_6-31g(d).inp

004158483.b3lyp_6-31g(d).qchem.inp (generated)

004158483.b3lyp_6-31g(d).gjf (generated)

004158483.b3lyp_6-31g(d).firefly.inp (generated)

004158483.b3lyp_6-31g(d).smash.inp (generated)

004158483.b3lyp_6-31g(d).nwchem.inp (generated) 004158483.b3lyp_6-31g(d).log.xz 004158483.td-b3lyp_6-31g+(d).inp 004158483.td-b3lyp_6-31g+(d).log.xz

004158483.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158483.td-b3lyp_6-31+g(d).gjf (generated)

004158483.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158483.mol 004158483.PUBCHEM 004158483.mol (via Jmol)
004158494.b3lyp_6-31g(d).inp

004158494.b3lyp_6-31g(d).qchem.inp (generated)

004158494.b3lyp_6-31g(d).gjf (generated)

004158494.b3lyp_6-31g(d).firefly.inp (generated)

004158494.b3lyp_6-31g(d).smash.inp (generated)

004158494.b3lyp_6-31g(d).nwchem.inp (generated) 004158494.b3lyp_6-31g(d).log.xz 004158494.td-b3lyp_6-31g+(d).inp 004158494.td-b3lyp_6-31g+(d).log.xz

004158494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158494.td-b3lyp_6-31+g(d).gjf (generated)

004158494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158494.mol 004158494.PUBCHEM 004158494.mol (via Jmol)
004158573.b3lyp_6-31g(d).inp

004158573.b3lyp_6-31g(d).qchem.inp (generated)

004158573.b3lyp_6-31g(d).gjf (generated)

004158573.b3lyp_6-31g(d).firefly.inp (generated)

004158573.b3lyp_6-31g(d).smash.inp (generated)

004158573.b3lyp_6-31g(d).nwchem.inp (generated) 004158573.b3lyp_6-31g(d).log.xz 004158573.mol 004158573.PUBCHEM 004158573.mol (via Jmol)
004158575.b3lyp_6-31g(d).inp

004158575.b3lyp_6-31g(d).qchem.inp (generated)

004158575.b3lyp_6-31g(d).gjf (generated)

004158575.b3lyp_6-31g(d).firefly.inp (generated)

004158575.b3lyp_6-31g(d).smash.inp (generated)

004158575.b3lyp_6-31g(d).nwchem.inp (generated) 004158575.b3lyp_6-31g(d).log.xz 004158575.td-b3lyp_6-31g+(d).inp 004158575.td-b3lyp_6-31g+(d).log.xz

004158575.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158575.td-b3lyp_6-31+g(d).gjf (generated)

004158575.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158575.mol 004158575.PUBCHEM 004158575.mol (via Jmol)
004158579.b3lyp_6-31g(d).inp

004158579.b3lyp_6-31g(d).qchem.inp (generated)

004158579.b3lyp_6-31g(d).gjf (generated)

004158579.b3lyp_6-31g(d).firefly.inp (generated)

004158579.b3lyp_6-31g(d).smash.inp (generated)

004158579.b3lyp_6-31g(d).nwchem.inp (generated) 004158579.b3lyp_6-31g(d).log.xz 004158579.td-b3lyp_6-31g+(d).inp 004158579.td-b3lyp_6-31g+(d).log.xz

004158579.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158579.td-b3lyp_6-31+g(d).gjf (generated)

004158579.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158579.mol 004158579.PUBCHEM 004158579.mol (via Jmol)
004158585.b3lyp_6-31g(d).inp

004158585.b3lyp_6-31g(d).qchem.inp (generated)

004158585.b3lyp_6-31g(d).gjf (generated)

004158585.b3lyp_6-31g(d).firefly.inp (generated)

004158585.b3lyp_6-31g(d).smash.inp (generated)

004158585.b3lyp_6-31g(d).nwchem.inp (generated) 004158585.b3lyp_6-31g(d).log.xz 004158585.td-b3lyp_6-31g+(d).inp 004158585.td-b3lyp_6-31g+(d).log.xz

004158585.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158585.td-b3lyp_6-31+g(d).gjf (generated)

004158585.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158585.mol 004158585.PUBCHEM 004158585.mol (via Jmol)
004158636.b3lyp_6-31g(d).inp

004158636.b3lyp_6-31g(d).qchem.inp (generated)

004158636.b3lyp_6-31g(d).gjf (generated)

004158636.b3lyp_6-31g(d).firefly.inp (generated)

004158636.b3lyp_6-31g(d).smash.inp (generated)

004158636.b3lyp_6-31g(d).nwchem.inp (generated) 004158636.b3lyp_6-31g(d).log.xz 004158636.td-b3lyp_6-31g+(d).inp 004158636.td-b3lyp_6-31g+(d).log.xz

004158636.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158636.td-b3lyp_6-31+g(d).gjf (generated)

004158636.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158636.mol 004158636.PUBCHEM 004158636.mol (via Jmol)
004158688.b3lyp_6-31g(d).inp

004158688.b3lyp_6-31g(d).qchem.inp (generated)

004158688.b3lyp_6-31g(d).gjf (generated)

004158688.b3lyp_6-31g(d).firefly.inp (generated)

004158688.b3lyp_6-31g(d).smash.inp (generated)

004158688.b3lyp_6-31g(d).nwchem.inp (generated) 004158688.b3lyp_6-31g(d).log.xz 004158688.td-b3lyp_6-31g+(d).inp 004158688.td-b3lyp_6-31g+(d).log.xz

004158688.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158688.td-b3lyp_6-31+g(d).gjf (generated)

004158688.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158688.mol 004158688.PUBCHEM 004158688.mol (via Jmol)
004158690.b3lyp_6-31g(d).inp

004158690.b3lyp_6-31g(d).qchem.inp (generated)

004158690.b3lyp_6-31g(d).gjf (generated)

004158690.b3lyp_6-31g(d).firefly.inp (generated)

004158690.b3lyp_6-31g(d).smash.inp (generated)

004158690.b3lyp_6-31g(d).nwchem.inp (generated) 004158690.b3lyp_6-31g(d).log.xz 004158690.td-b3lyp_6-31g+(d).inp 004158690.td-b3lyp_6-31g+(d).log.xz

004158690.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158690.td-b3lyp_6-31+g(d).gjf (generated)

004158690.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158690.mol 004158690.PUBCHEM 004158690.mol (via Jmol)
004158710.b3lyp_6-31g(d).inp

004158710.b3lyp_6-31g(d).qchem.inp (generated)

004158710.b3lyp_6-31g(d).gjf (generated)

004158710.b3lyp_6-31g(d).firefly.inp (generated)

004158710.b3lyp_6-31g(d).smash.inp (generated)

004158710.b3lyp_6-31g(d).nwchem.inp (generated) 004158710.b3lyp_6-31g(d).log.xz 004158710.td-b3lyp_6-31g+(d).inp 004158710.td-b3lyp_6-31g+(d).log.xz

004158710.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158710.td-b3lyp_6-31+g(d).gjf (generated)

004158710.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158710.mol 004158710.PUBCHEM 004158710.mol (via Jmol)
004158719.b3lyp_6-31g(d).inp

004158719.b3lyp_6-31g(d).qchem.inp (generated)

004158719.b3lyp_6-31g(d).gjf (generated)

004158719.b3lyp_6-31g(d).firefly.inp (generated)

004158719.b3lyp_6-31g(d).smash.inp (generated)

004158719.b3lyp_6-31g(d).nwchem.inp (generated) 004158719.b3lyp_6-31g(d).log.xz 004158719.td-b3lyp_6-31g+(d).inp 004158719.td-b3lyp_6-31g+(d).log.xz

004158719.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158719.td-b3lyp_6-31+g(d).gjf (generated)

004158719.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158719.mol 004158719.PUBCHEM 004158719.mol (via Jmol)
004158720.b3lyp_6-31g(d).inp

004158720.b3lyp_6-31g(d).qchem.inp (generated)

004158720.b3lyp_6-31g(d).gjf (generated)

004158720.b3lyp_6-31g(d).firefly.inp (generated)

004158720.b3lyp_6-31g(d).smash.inp (generated)

004158720.b3lyp_6-31g(d).nwchem.inp (generated) 004158720.b3lyp_6-31g(d).log.xz 004158720.td-b3lyp_6-31g+(d).inp 004158720.td-b3lyp_6-31g+(d).log.xz

004158720.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158720.td-b3lyp_6-31+g(d).gjf (generated)

004158720.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158720.mol 004158720.PUBCHEM 004158720.mol (via Jmol)
004158721.b3lyp_6-31g(d).inp

004158721.b3lyp_6-31g(d).qchem.inp (generated)

004158721.b3lyp_6-31g(d).gjf (generated)

004158721.b3lyp_6-31g(d).firefly.inp (generated)

004158721.b3lyp_6-31g(d).smash.inp (generated)

004158721.b3lyp_6-31g(d).nwchem.inp (generated) 004158721.b3lyp_6-31g(d).log.xz 004158721.td-b3lyp_6-31g+(d).inp 004158721.td-b3lyp_6-31g+(d).log.xz

004158721.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158721.td-b3lyp_6-31+g(d).gjf (generated)

004158721.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158721.mol 004158721.PUBCHEM 004158721.mol (via Jmol)
004158722.b3lyp_6-31g(d).inp

004158722.b3lyp_6-31g(d).qchem.inp (generated)

004158722.b3lyp_6-31g(d).gjf (generated)

004158722.b3lyp_6-31g(d).firefly.inp (generated)

004158722.b3lyp_6-31g(d).smash.inp (generated)

004158722.b3lyp_6-31g(d).nwchem.inp (generated) 004158722.b3lyp_6-31g(d).log.xz 004158722.td-b3lyp_6-31g+(d).inp 004158722.td-b3lyp_6-31g+(d).log.xz

004158722.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158722.td-b3lyp_6-31+g(d).gjf (generated)

004158722.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158722.mol 004158722.PUBCHEM 004158722.mol (via Jmol)
004158724.b3lyp_6-31g(d).inp

004158724.b3lyp_6-31g(d).qchem.inp (generated)

004158724.b3lyp_6-31g(d).gjf (generated)

004158724.b3lyp_6-31g(d).firefly.inp (generated)

004158724.b3lyp_6-31g(d).smash.inp (generated)

004158724.b3lyp_6-31g(d).nwchem.inp (generated) 004158724.b3lyp_6-31g(d).log.xz 004158724.mol 004158724.PUBCHEM 004158724.mol (via Jmol)
004158726.b3lyp_6-31g(d).inp

004158726.b3lyp_6-31g(d).qchem.inp (generated)

004158726.b3lyp_6-31g(d).gjf (generated)

004158726.b3lyp_6-31g(d).firefly.inp (generated)

004158726.b3lyp_6-31g(d).smash.inp (generated)

004158726.b3lyp_6-31g(d).nwchem.inp (generated) 004158726.b3lyp_6-31g(d).log.xz 004158726.td-b3lyp_6-31g+(d).inp 004158726.td-b3lyp_6-31g+(d).log.xz

004158726.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158726.td-b3lyp_6-31+g(d).gjf (generated)

004158726.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158726.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158726.mol 004158726.PUBCHEM 004158726.mol (via Jmol)
004158766.b3lyp_6-31g(d).inp

004158766.b3lyp_6-31g(d).qchem.inp (generated)

004158766.b3lyp_6-31g(d).gjf (generated)

004158766.b3lyp_6-31g(d).firefly.inp (generated)

004158766.b3lyp_6-31g(d).smash.inp (generated)

004158766.b3lyp_6-31g(d).nwchem.inp (generated) 004158766.b3lyp_6-31g(d).log.xz 004158766.td-b3lyp_6-31g+(d).inp 004158766.td-b3lyp_6-31g+(d).log.xz

004158766.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158766.td-b3lyp_6-31+g(d).gjf (generated)

004158766.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158766.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158766.mol 004158766.PUBCHEM 004158766.mol (via Jmol)
004158809.b3lyp_6-31g(d).inp

004158809.b3lyp_6-31g(d).qchem.inp (generated)

004158809.b3lyp_6-31g(d).gjf (generated)

004158809.b3lyp_6-31g(d).firefly.inp (generated)

004158809.b3lyp_6-31g(d).smash.inp (generated)

004158809.b3lyp_6-31g(d).nwchem.inp (generated) 004158809.b3lyp_6-31g(d).log.xz 004158809.td-b3lyp_6-31g+(d).inp 004158809.td-b3lyp_6-31g+(d).log.xz

004158809.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158809.td-b3lyp_6-31+g(d).gjf (generated)

004158809.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158809.mol 004158809.PUBCHEM 004158809.mol (via Jmol)
004158813.b3lyp_6-31g(d).inp

004158813.b3lyp_6-31g(d).qchem.inp (generated)

004158813.b3lyp_6-31g(d).gjf (generated)

004158813.b3lyp_6-31g(d).firefly.inp (generated)

004158813.b3lyp_6-31g(d).smash.inp (generated)

004158813.b3lyp_6-31g(d).nwchem.inp (generated) 004158813.b3lyp_6-31g(d).log.xz 004158813.td-b3lyp_6-31g+(d).inp 004158813.td-b3lyp_6-31g+(d).log.xz

004158813.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158813.td-b3lyp_6-31+g(d).gjf (generated)

004158813.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158813.mol 004158813.PUBCHEM 004158813.mol (via Jmol)
004158821.b3lyp_6-31g(d).inp

004158821.b3lyp_6-31g(d).qchem.inp (generated)

004158821.b3lyp_6-31g(d).gjf (generated)

004158821.b3lyp_6-31g(d).firefly.inp (generated)

004158821.b3lyp_6-31g(d).smash.inp (generated)

004158821.b3lyp_6-31g(d).nwchem.inp (generated) 004158821.b3lyp_6-31g(d).log.xz 004158821.td-b3lyp_6-31g+(d).inp 004158821.td-b3lyp_6-31g+(d).log.xz

004158821.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158821.td-b3lyp_6-31+g(d).gjf (generated)

004158821.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158821.mol 004158821.PUBCHEM 004158821.mol (via Jmol)
004158848.b3lyp_6-31g(d).inp

004158848.b3lyp_6-31g(d).qchem.inp (generated)

004158848.b3lyp_6-31g(d).gjf (generated)

004158848.b3lyp_6-31g(d).firefly.inp (generated)

004158848.b3lyp_6-31g(d).smash.inp (generated)

004158848.b3lyp_6-31g(d).nwchem.inp (generated) 004158848.b3lyp_6-31g(d).log.xz 004158848.td-b3lyp_6-31g+(d).inp 004158848.td-b3lyp_6-31g+(d).log.xz

004158848.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158848.td-b3lyp_6-31+g(d).gjf (generated)

004158848.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158848.mol 004158848.PUBCHEM 004158848.mol (via Jmol)
004158849.b3lyp_6-31g(d).inp

004158849.b3lyp_6-31g(d).qchem.inp (generated)

004158849.b3lyp_6-31g(d).gjf (generated)

004158849.b3lyp_6-31g(d).firefly.inp (generated)

004158849.b3lyp_6-31g(d).smash.inp (generated)

004158849.b3lyp_6-31g(d).nwchem.inp (generated) 004158849.b3lyp_6-31g(d).log.xz 004158849.td-b3lyp_6-31g+(d).inp 004158849.td-b3lyp_6-31g+(d).log.xz

004158849.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158849.td-b3lyp_6-31+g(d).gjf (generated)

004158849.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158849.mol 004158849.PUBCHEM 004158849.mol (via Jmol)
004158851.b3lyp_6-31g(d).inp

004158851.b3lyp_6-31g(d).qchem.inp (generated)

004158851.b3lyp_6-31g(d).gjf (generated)

004158851.b3lyp_6-31g(d).firefly.inp (generated)

004158851.b3lyp_6-31g(d).smash.inp (generated)

004158851.b3lyp_6-31g(d).nwchem.inp (generated) 004158851.b3lyp_6-31g(d).log.xz 004158851.td-b3lyp_6-31g+(d).inp 004158851.td-b3lyp_6-31g+(d).log.xz

004158851.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158851.td-b3lyp_6-31+g(d).gjf (generated)

004158851.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158851.mol 004158851.PUBCHEM 004158851.mol (via Jmol)
004158868.b3lyp_6-31g(d).inp

004158868.b3lyp_6-31g(d).qchem.inp (generated)

004158868.b3lyp_6-31g(d).gjf (generated)

004158868.b3lyp_6-31g(d).firefly.inp (generated)

004158868.b3lyp_6-31g(d).smash.inp (generated)

004158868.b3lyp_6-31g(d).nwchem.inp (generated) 004158868.b3lyp_6-31g(d).log.xz 004158868.td-b3lyp_6-31g+(d).inp 004158868.td-b3lyp_6-31g+(d).log.xz

004158868.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158868.td-b3lyp_6-31+g(d).gjf (generated)

004158868.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158868.mol 004158868.PUBCHEM 004158868.mol (via Jmol)
004158927.b3lyp_6-31g(d).inp

004158927.b3lyp_6-31g(d).qchem.inp (generated)

004158927.b3lyp_6-31g(d).gjf (generated)

004158927.b3lyp_6-31g(d).firefly.inp (generated)

004158927.b3lyp_6-31g(d).smash.inp (generated)

004158927.b3lyp_6-31g(d).nwchem.inp (generated) 004158927.b3lyp_6-31g(d).log.xz 004158927.td-b3lyp_6-31g+(d).inp 004158927.td-b3lyp_6-31g+(d).log.xz

004158927.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158927.td-b3lyp_6-31+g(d).gjf (generated)

004158927.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158927.mol 004158927.PUBCHEM 004158927.mol (via Jmol)
004158939.b3lyp_6-31g(d).inp

004158939.b3lyp_6-31g(d).qchem.inp (generated)

004158939.b3lyp_6-31g(d).gjf (generated)

004158939.b3lyp_6-31g(d).firefly.inp (generated)

004158939.b3lyp_6-31g(d).smash.inp (generated)

004158939.b3lyp_6-31g(d).nwchem.inp (generated) 004158939.b3lyp_6-31g(d).log.xz 004158939.td-b3lyp_6-31g+(d).inp 004158939.td-b3lyp_6-31g+(d).log.xz

004158939.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158939.td-b3lyp_6-31+g(d).gjf (generated)

004158939.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158939.mol 004158939.PUBCHEM 004158939.mol (via Jmol)
004158943.b3lyp_6-31g(d).inp

004158943.b3lyp_6-31g(d).qchem.inp (generated)

004158943.b3lyp_6-31g(d).gjf (generated)

004158943.b3lyp_6-31g(d).firefly.inp (generated)

004158943.b3lyp_6-31g(d).smash.inp (generated)

004158943.b3lyp_6-31g(d).nwchem.inp (generated) 004158943.b3lyp_6-31g(d).log.xz 004158943.mol 004158943.PUBCHEM 004158943.mol (via Jmol)
004158954.b3lyp_6-31g(d).inp

004158954.b3lyp_6-31g(d).qchem.inp (generated)

004158954.b3lyp_6-31g(d).gjf (generated)

004158954.b3lyp_6-31g(d).firefly.inp (generated)

004158954.b3lyp_6-31g(d).smash.inp (generated)

004158954.b3lyp_6-31g(d).nwchem.inp (generated) 004158954.b3lyp_6-31g(d).log.xz 004158954.td-b3lyp_6-31g+(d).inp 004158954.td-b3lyp_6-31g+(d).log.xz

004158954.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158954.td-b3lyp_6-31+g(d).gjf (generated)

004158954.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158954.mol 004158954.PUBCHEM 004158954.mol (via Jmol)
004158956.b3lyp_6-31g(d).inp

004158956.b3lyp_6-31g(d).qchem.inp (generated)

004158956.b3lyp_6-31g(d).gjf (generated)

004158956.b3lyp_6-31g(d).firefly.inp (generated)

004158956.b3lyp_6-31g(d).smash.inp (generated)

004158956.b3lyp_6-31g(d).nwchem.inp (generated) 004158956.b3lyp_6-31g(d).log.xz 004158956.td-b3lyp_6-31g+(d).inp 004158956.td-b3lyp_6-31g+(d).log.xz

004158956.td-b3lyp_6-31+g(d).qchem.inp (generated)

004158956.td-b3lyp_6-31+g(d).gjf (generated)

004158956.td-b3lyp_6-31+g(d).firefly.inp (generated)

004158956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004158956.mol 004158956.PUBCHEM 004158956.mol (via Jmol)
004159002.b3lyp_6-31g(d).inp

004159002.b3lyp_6-31g(d).qchem.inp (generated)

004159002.b3lyp_6-31g(d).gjf (generated)

004159002.b3lyp_6-31g(d).firefly.inp (generated)

004159002.b3lyp_6-31g(d).smash.inp (generated)

004159002.b3lyp_6-31g(d).nwchem.inp (generated) 004159002.b3lyp_6-31g(d).log.xz 004159002.td-b3lyp_6-31g+(d).inp 004159002.td-b3lyp_6-31g+(d).log.xz

004159002.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159002.td-b3lyp_6-31+g(d).gjf (generated)

004159002.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159002.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159002.mol 004159002.PUBCHEM 004159002.mol (via Jmol)
004159152.b3lyp_6-31g(d).inp

004159152.b3lyp_6-31g(d).qchem.inp (generated)

004159152.b3lyp_6-31g(d).gjf (generated)

004159152.b3lyp_6-31g(d).firefly.inp (generated)

004159152.b3lyp_6-31g(d).smash.inp (generated)

004159152.b3lyp_6-31g(d).nwchem.inp (generated) 004159152.b3lyp_6-31g(d).log.xz 004159152.td-b3lyp_6-31g+(d).inp 004159152.td-b3lyp_6-31g+(d).log.xz

004159152.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159152.td-b3lyp_6-31+g(d).gjf (generated)

004159152.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159152.mol 004159152.PUBCHEM 004159152.mol (via Jmol)
004159154.b3lyp_6-31g(d).inp

004159154.b3lyp_6-31g(d).qchem.inp (generated)

004159154.b3lyp_6-31g(d).gjf (generated)

004159154.b3lyp_6-31g(d).firefly.inp (generated)

004159154.b3lyp_6-31g(d).smash.inp (generated)

004159154.b3lyp_6-31g(d).nwchem.inp (generated) 004159154.b3lyp_6-31g(d).log.xz 004159154.td-b3lyp_6-31g+(d).inp 004159154.td-b3lyp_6-31g+(d).log.xz

004159154.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159154.td-b3lyp_6-31+g(d).gjf (generated)

004159154.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159154.mol 004159154.PUBCHEM 004159154.mol (via Jmol)
004159159.b3lyp_6-31g(d).inp

004159159.b3lyp_6-31g(d).qchem.inp (generated)

004159159.b3lyp_6-31g(d).gjf (generated)

004159159.b3lyp_6-31g(d).firefly.inp (generated)

004159159.b3lyp_6-31g(d).smash.inp (generated)

004159159.b3lyp_6-31g(d).nwchem.inp (generated) 004159159.b3lyp_6-31g(d).log.xz 004159159.td-b3lyp_6-31g+(d).inp 004159159.td-b3lyp_6-31g+(d).log.xz

004159159.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159159.td-b3lyp_6-31+g(d).gjf (generated)

004159159.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159159.mol 004159159.PUBCHEM 004159159.mol (via Jmol)
004159229.b3lyp_6-31g(d).inp

004159229.b3lyp_6-31g(d).qchem.inp (generated)

004159229.b3lyp_6-31g(d).gjf (generated)

004159229.b3lyp_6-31g(d).firefly.inp (generated)

004159229.b3lyp_6-31g(d).smash.inp (generated)

004159229.b3lyp_6-31g(d).nwchem.inp (generated) 004159229.b3lyp_6-31g(d).log.xz 004159229.td-b3lyp_6-31g+(d).inp 004159229.td-b3lyp_6-31g+(d).log.xz

004159229.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159229.td-b3lyp_6-31+g(d).gjf (generated)

004159229.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159229.mol 004159229.PUBCHEM 004159229.mol (via Jmol)
004159232.b3lyp_6-31g(d).inp

004159232.b3lyp_6-31g(d).qchem.inp (generated)

004159232.b3lyp_6-31g(d).gjf (generated)

004159232.b3lyp_6-31g(d).firefly.inp (generated)

004159232.b3lyp_6-31g(d).smash.inp (generated)

004159232.b3lyp_6-31g(d).nwchem.inp (generated) 004159232.b3lyp_6-31g(d).log.xz 004159232.td-b3lyp_6-31g+(d).inp 004159232.td-b3lyp_6-31g+(d).log.xz

004159232.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159232.td-b3lyp_6-31+g(d).gjf (generated)

004159232.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159232.mol 004159232.PUBCHEM 004159232.mol (via Jmol)
004159233.b3lyp_6-31g(d).inp

004159233.b3lyp_6-31g(d).qchem.inp (generated)

004159233.b3lyp_6-31g(d).gjf (generated)

004159233.b3lyp_6-31g(d).firefly.inp (generated)

004159233.b3lyp_6-31g(d).smash.inp (generated)

004159233.b3lyp_6-31g(d).nwchem.inp (generated) 004159233.b3lyp_6-31g(d).log.xz 004159233.td-b3lyp_6-31g+(d).inp 004159233.td-b3lyp_6-31g+(d).log.xz

004159233.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159233.td-b3lyp_6-31+g(d).gjf (generated)

004159233.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159233.mol 004159233.PUBCHEM 004159233.mol (via Jmol)
004159235.b3lyp_6-31g(d).inp

004159235.b3lyp_6-31g(d).qchem.inp (generated)

004159235.b3lyp_6-31g(d).gjf (generated)

004159235.b3lyp_6-31g(d).firefly.inp (generated)

004159235.b3lyp_6-31g(d).smash.inp (generated)

004159235.b3lyp_6-31g(d).nwchem.inp (generated) 004159235.b3lyp_6-31g(d).log.xz 004159235.td-b3lyp_6-31g+(d).inp 004159235.td-b3lyp_6-31g+(d).log.xz

004159235.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159235.td-b3lyp_6-31+g(d).gjf (generated)

004159235.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159235.mol 004159235.PUBCHEM 004159235.mol (via Jmol)
004159250.b3lyp_6-31g(d).inp

004159250.b3lyp_6-31g(d).qchem.inp (generated)

004159250.b3lyp_6-31g(d).gjf (generated)

004159250.b3lyp_6-31g(d).firefly.inp (generated)

004159250.b3lyp_6-31g(d).smash.inp (generated)

004159250.b3lyp_6-31g(d).nwchem.inp (generated) 004159250.b3lyp_6-31g(d).log.xz 004159250.td-b3lyp_6-31g+(d).inp 004159250.td-b3lyp_6-31g+(d).log.xz

004159250.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159250.td-b3lyp_6-31+g(d).gjf (generated)

004159250.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159250.mol 004159250.PUBCHEM 004159250.mol (via Jmol)
004159354.b3lyp_6-31g(d).inp

004159354.b3lyp_6-31g(d).qchem.inp (generated)

004159354.b3lyp_6-31g(d).gjf (generated)

004159354.b3lyp_6-31g(d).firefly.inp (generated)

004159354.b3lyp_6-31g(d).smash.inp (generated)

004159354.b3lyp_6-31g(d).nwchem.inp (generated) 004159354.b3lyp_6-31g(d).log.xz 004159354.td-b3lyp_6-31g+(d).inp 004159354.td-b3lyp_6-31g+(d).log.xz

004159354.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159354.td-b3lyp_6-31+g(d).gjf (generated)

004159354.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159354.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159354.mol 004159354.PUBCHEM 004159354.mol (via Jmol)
004159375.b3lyp_6-31g(d).inp

004159375.b3lyp_6-31g(d).qchem.inp (generated)

004159375.b3lyp_6-31g(d).gjf (generated)

004159375.b3lyp_6-31g(d).firefly.inp (generated)

004159375.b3lyp_6-31g(d).smash.inp (generated)

004159375.b3lyp_6-31g(d).nwchem.inp (generated) 004159375.b3lyp_6-31g(d).log.xz 004159375.td-b3lyp_6-31g+(d).inp 004159375.td-b3lyp_6-31g+(d).log.xz

004159375.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159375.td-b3lyp_6-31+g(d).gjf (generated)

004159375.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159375.mol 004159375.PUBCHEM 004159375.mol (via Jmol)
004159418.b3lyp_6-31g(d).inp

004159418.b3lyp_6-31g(d).qchem.inp (generated)

004159418.b3lyp_6-31g(d).gjf (generated)

004159418.b3lyp_6-31g(d).firefly.inp (generated)

004159418.b3lyp_6-31g(d).smash.inp (generated)

004159418.b3lyp_6-31g(d).nwchem.inp (generated) 004159418.b3lyp_6-31g(d).log.xz 004159418.td-b3lyp_6-31g+(d).inp 004159418.td-b3lyp_6-31g+(d).log.xz

004159418.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159418.td-b3lyp_6-31+g(d).gjf (generated)

004159418.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159418.mol 004159418.PUBCHEM 004159418.mol (via Jmol)
004159419.b3lyp_6-31g(d).inp

004159419.b3lyp_6-31g(d).qchem.inp (generated)

004159419.b3lyp_6-31g(d).gjf (generated)

004159419.b3lyp_6-31g(d).firefly.inp (generated)

004159419.b3lyp_6-31g(d).smash.inp (generated)

004159419.b3lyp_6-31g(d).nwchem.inp (generated) 004159419.b3lyp_6-31g(d).log.xz 004159419.td-b3lyp_6-31g+(d).inp 004159419.td-b3lyp_6-31g+(d).log.xz

004159419.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159419.td-b3lyp_6-31+g(d).gjf (generated)

004159419.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159419.mol 004159419.PUBCHEM 004159419.mol (via Jmol)
004159492.b3lyp_6-31g(d).inp

004159492.b3lyp_6-31g(d).qchem.inp (generated)

004159492.b3lyp_6-31g(d).gjf (generated)

004159492.b3lyp_6-31g(d).firefly.inp (generated)

004159492.b3lyp_6-31g(d).smash.inp (generated)

004159492.b3lyp_6-31g(d).nwchem.inp (generated) 004159492.b3lyp_6-31g(d).log.xz 004159492.td-b3lyp_6-31g+(d).inp 004159492.td-b3lyp_6-31g+(d).log.xz

004159492.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159492.td-b3lyp_6-31+g(d).gjf (generated)

004159492.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159492.mol 004159492.PUBCHEM 004159492.mol (via Jmol)
004159504.b3lyp_6-31g(d).inp

004159504.b3lyp_6-31g(d).qchem.inp (generated)

004159504.b3lyp_6-31g(d).gjf (generated)

004159504.b3lyp_6-31g(d).firefly.inp (generated)

004159504.b3lyp_6-31g(d).smash.inp (generated)

004159504.b3lyp_6-31g(d).nwchem.inp (generated) 004159504.b3lyp_6-31g(d).log.xz 004159504.td-b3lyp_6-31g+(d).inp 004159504.td-b3lyp_6-31g+(d).log.xz

004159504.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159504.td-b3lyp_6-31+g(d).gjf (generated)

004159504.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159504.mol 004159504.PUBCHEM 004159504.mol (via Jmol)
004159515.b3lyp_6-31g(d).inp

004159515.b3lyp_6-31g(d).qchem.inp (generated)

004159515.b3lyp_6-31g(d).gjf (generated)

004159515.b3lyp_6-31g(d).firefly.inp (generated)

004159515.b3lyp_6-31g(d).smash.inp (generated)

004159515.b3lyp_6-31g(d).nwchem.inp (generated) 004159515.b3lyp_6-31g(d).log.xz 004159515.td-b3lyp_6-31g+(d).inp 004159515.td-b3lyp_6-31g+(d).log.xz

004159515.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159515.td-b3lyp_6-31+g(d).gjf (generated)

004159515.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159515.mol 004159515.PUBCHEM 004159515.mol (via Jmol)
004159544.b3lyp_6-31g(d).inp

004159544.b3lyp_6-31g(d).qchem.inp (generated)

004159544.b3lyp_6-31g(d).gjf (generated)

004159544.b3lyp_6-31g(d).firefly.inp (generated)

004159544.b3lyp_6-31g(d).smash.inp (generated)

004159544.b3lyp_6-31g(d).nwchem.inp (generated) 004159544.b3lyp_6-31g(d).log.xz 004159544.mol 004159544.PUBCHEM 004159544.mol (via Jmol)
004159550.b3lyp_6-31g(d).inp

004159550.b3lyp_6-31g(d).qchem.inp (generated)

004159550.b3lyp_6-31g(d).gjf (generated)

004159550.b3lyp_6-31g(d).firefly.inp (generated)

004159550.b3lyp_6-31g(d).smash.inp (generated)

004159550.b3lyp_6-31g(d).nwchem.inp (generated) 004159550.b3lyp_6-31g(d).log.xz 004159550.td-b3lyp_6-31g+(d).inp 004159550.td-b3lyp_6-31g+(d).log.xz

004159550.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159550.td-b3lyp_6-31+g(d).gjf (generated)

004159550.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159550.mol 004159550.PUBCHEM 004159550.mol (via Jmol)
004159710.b3lyp_6-31g(d).inp

004159710.b3lyp_6-31g(d).qchem.inp (generated)

004159710.b3lyp_6-31g(d).gjf (generated)

004159710.b3lyp_6-31g(d).firefly.inp (generated)

004159710.b3lyp_6-31g(d).smash.inp (generated)

004159710.b3lyp_6-31g(d).nwchem.inp (generated) 004159710.b3lyp_6-31g(d).log.xz 004159710.td-b3lyp_6-31g+(d).inp 004159710.td-b3lyp_6-31g+(d).log.xz

004159710.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159710.td-b3lyp_6-31+g(d).gjf (generated)

004159710.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159710.mol 004159710.PUBCHEM 004159710.mol (via Jmol)
004159711.b3lyp_6-31g(d).inp

004159711.b3lyp_6-31g(d).qchem.inp (generated)

004159711.b3lyp_6-31g(d).gjf (generated)

004159711.b3lyp_6-31g(d).firefly.inp (generated)

004159711.b3lyp_6-31g(d).smash.inp (generated)

004159711.b3lyp_6-31g(d).nwchem.inp (generated) 004159711.b3lyp_6-31g(d).log.xz 004159711.td-b3lyp_6-31g+(d).inp 004159711.td-b3lyp_6-31g+(d).log.xz

004159711.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159711.td-b3lyp_6-31+g(d).gjf (generated)

004159711.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159711.mol 004159711.PUBCHEM 004159711.mol (via Jmol)
004159715.b3lyp_6-31g(d).inp

004159715.b3lyp_6-31g(d).qchem.inp (generated)

004159715.b3lyp_6-31g(d).gjf (generated)

004159715.b3lyp_6-31g(d).firefly.inp (generated)

004159715.b3lyp_6-31g(d).smash.inp (generated)

004159715.b3lyp_6-31g(d).nwchem.inp (generated) 004159715.b3lyp_6-31g(d).log.xz 004159715.td-b3lyp_6-31g+(d).inp 004159715.td-b3lyp_6-31g+(d).log.xz

004159715.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159715.td-b3lyp_6-31+g(d).gjf (generated)

004159715.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159715.mol 004159715.PUBCHEM 004159715.mol (via Jmol)
004159727.b3lyp_6-31g(d).inp

004159727.b3lyp_6-31g(d).qchem.inp (generated)

004159727.b3lyp_6-31g(d).gjf (generated)

004159727.b3lyp_6-31g(d).firefly.inp (generated)

004159727.b3lyp_6-31g(d).smash.inp (generated)

004159727.b3lyp_6-31g(d).nwchem.inp (generated) 004159727.b3lyp_6-31g(d).log.xz 004159727.td-b3lyp_6-31g+(d).inp 004159727.td-b3lyp_6-31g+(d).log.xz

004159727.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159727.td-b3lyp_6-31+g(d).gjf (generated)

004159727.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159727.mol 004159727.PUBCHEM 004159727.mol (via Jmol)
004159732.b3lyp_6-31g(d).inp

004159732.b3lyp_6-31g(d).qchem.inp (generated)

004159732.b3lyp_6-31g(d).gjf (generated)

004159732.b3lyp_6-31g(d).firefly.inp (generated)

004159732.b3lyp_6-31g(d).smash.inp (generated)

004159732.b3lyp_6-31g(d).nwchem.inp (generated) 004159732.b3lyp_6-31g(d).log.xz 004159732.td-b3lyp_6-31g+(d).inp 004159732.td-b3lyp_6-31g+(d).log.xz

004159732.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159732.td-b3lyp_6-31+g(d).gjf (generated)

004159732.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159732.mol 004159732.PUBCHEM 004159732.mol (via Jmol)
004159787.b3lyp_6-31g(d).inp

004159787.b3lyp_6-31g(d).qchem.inp (generated)

004159787.b3lyp_6-31g(d).gjf (generated)

004159787.b3lyp_6-31g(d).firefly.inp (generated)

004159787.b3lyp_6-31g(d).smash.inp (generated)

004159787.b3lyp_6-31g(d).nwchem.inp (generated) 004159787.b3lyp_6-31g(d).log.xz 004159787.td-b3lyp_6-31g+(d).inp 004159787.td-b3lyp_6-31g+(d).log.xz

004159787.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159787.td-b3lyp_6-31+g(d).gjf (generated)

004159787.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159787.mol 004159787.PUBCHEM 004159787.mol (via Jmol)
004159788.b3lyp_6-31g(d).inp

004159788.b3lyp_6-31g(d).qchem.inp (generated)

004159788.b3lyp_6-31g(d).gjf (generated)

004159788.b3lyp_6-31g(d).firefly.inp (generated)

004159788.b3lyp_6-31g(d).smash.inp (generated)

004159788.b3lyp_6-31g(d).nwchem.inp (generated) 004159788.b3lyp_6-31g(d).log.xz 004159788.td-b3lyp_6-31g+(d).inp 004159788.td-b3lyp_6-31g+(d).log.xz

004159788.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159788.td-b3lyp_6-31+g(d).gjf (generated)

004159788.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159788.mol 004159788.PUBCHEM 004159788.mol (via Jmol)
004159800.b3lyp_6-31g(d).inp

004159800.b3lyp_6-31g(d).qchem.inp (generated)

004159800.b3lyp_6-31g(d).gjf (generated)

004159800.b3lyp_6-31g(d).firefly.inp (generated)

004159800.b3lyp_6-31g(d).smash.inp (generated)

004159800.b3lyp_6-31g(d).nwchem.inp (generated) 004159800.b3lyp_6-31g(d).log.xz 004159800.td-b3lyp_6-31g+(d).inp 004159800.td-b3lyp_6-31g+(d).log.xz

004159800.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159800.td-b3lyp_6-31+g(d).gjf (generated)

004159800.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159800.mol 004159800.PUBCHEM 004159800.mol (via Jmol)
004159801.b3lyp_6-31g(d).inp

004159801.b3lyp_6-31g(d).qchem.inp (generated)

004159801.b3lyp_6-31g(d).gjf (generated)

004159801.b3lyp_6-31g(d).firefly.inp (generated)

004159801.b3lyp_6-31g(d).smash.inp (generated)

004159801.b3lyp_6-31g(d).nwchem.inp (generated) 004159801.b3lyp_6-31g(d).log.xz 004159801.td-b3lyp_6-31g+(d).inp 004159801.td-b3lyp_6-31g+(d).log.xz

004159801.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159801.td-b3lyp_6-31+g(d).gjf (generated)

004159801.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159801.mol 004159801.PUBCHEM 004159801.mol (via Jmol)
004159811.b3lyp_6-31g(d).inp

004159811.b3lyp_6-31g(d).qchem.inp (generated)

004159811.b3lyp_6-31g(d).gjf (generated)

004159811.b3lyp_6-31g(d).firefly.inp (generated)

004159811.b3lyp_6-31g(d).smash.inp (generated)

004159811.b3lyp_6-31g(d).nwchem.inp (generated) 004159811.b3lyp_6-31g(d).log.xz 004159811.td-b3lyp_6-31g+(d).inp 004159811.td-b3lyp_6-31g+(d).log.xz

004159811.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159811.td-b3lyp_6-31+g(d).gjf (generated)

004159811.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159811.mol 004159811.PUBCHEM 004159811.mol (via Jmol)
004159826.b3lyp_6-31g(d).inp

004159826.b3lyp_6-31g(d).qchem.inp (generated)

004159826.b3lyp_6-31g(d).gjf (generated)

004159826.b3lyp_6-31g(d).firefly.inp (generated)

004159826.b3lyp_6-31g(d).smash.inp (generated)

004159826.b3lyp_6-31g(d).nwchem.inp (generated) 004159826.b3lyp_6-31g(d).log.xz 004159826.td-b3lyp_6-31g+(d).inp 004159826.td-b3lyp_6-31g+(d).log.xz

004159826.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159826.td-b3lyp_6-31+g(d).gjf (generated)

004159826.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159826.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159826.mol 004159826.PUBCHEM 004159826.mol (via Jmol)
004159908.b3lyp_6-31g(d).inp

004159908.b3lyp_6-31g(d).qchem.inp (generated)

004159908.b3lyp_6-31g(d).gjf (generated)

004159908.b3lyp_6-31g(d).firefly.inp (generated)

004159908.b3lyp_6-31g(d).smash.inp (generated)

004159908.b3lyp_6-31g(d).nwchem.inp (generated) 004159908.b3lyp_6-31g(d).log.xz 004159908.td-b3lyp_6-31g+(d).inp 004159908.td-b3lyp_6-31g+(d).log.xz

004159908.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159908.td-b3lyp_6-31+g(d).gjf (generated)

004159908.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159908.mol 004159908.PUBCHEM 004159908.mol (via Jmol)
004159942.b3lyp_6-31g(d).inp

004159942.b3lyp_6-31g(d).qchem.inp (generated)

004159942.b3lyp_6-31g(d).gjf (generated)

004159942.b3lyp_6-31g(d).firefly.inp (generated)

004159942.b3lyp_6-31g(d).smash.inp (generated)

004159942.b3lyp_6-31g(d).nwchem.inp (generated) 004159942.b3lyp_6-31g(d).log.xz 004159942.mol 004159942.PUBCHEM 004159942.mol (via Jmol)
004159943.b3lyp_6-31g(d).inp

004159943.b3lyp_6-31g(d).qchem.inp (generated)

004159943.b3lyp_6-31g(d).gjf (generated)

004159943.b3lyp_6-31g(d).firefly.inp (generated)

004159943.b3lyp_6-31g(d).smash.inp (generated)

004159943.b3lyp_6-31g(d).nwchem.inp (generated) 004159943.b3lyp_6-31g(d).log.xz 004159943.td-b3lyp_6-31g+(d).inp 004159943.td-b3lyp_6-31g+(d).log.xz

004159943.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159943.td-b3lyp_6-31+g(d).gjf (generated)

004159943.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159943.mol 004159943.PUBCHEM 004159943.mol (via Jmol)
004159944.b3lyp_6-31g(d).inp

004159944.b3lyp_6-31g(d).qchem.inp (generated)

004159944.b3lyp_6-31g(d).gjf (generated)

004159944.b3lyp_6-31g(d).firefly.inp (generated)

004159944.b3lyp_6-31g(d).smash.inp (generated)

004159944.b3lyp_6-31g(d).nwchem.inp (generated) 004159944.b3lyp_6-31g(d).log.xz 004159944.td-b3lyp_6-31g+(d).inp 004159944.td-b3lyp_6-31g+(d).log.xz

004159944.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159944.td-b3lyp_6-31+g(d).gjf (generated)

004159944.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159944.mol 004159944.PUBCHEM 004159944.mol (via Jmol)
004159948.b3lyp_6-31g(d).inp

004159948.b3lyp_6-31g(d).qchem.inp (generated)

004159948.b3lyp_6-31g(d).gjf (generated)

004159948.b3lyp_6-31g(d).firefly.inp (generated)

004159948.b3lyp_6-31g(d).smash.inp (generated)

004159948.b3lyp_6-31g(d).nwchem.inp (generated) 004159948.b3lyp_6-31g(d).log.xz 004159948.td-b3lyp_6-31g+(d).inp 004159948.td-b3lyp_6-31g+(d).log.xz

004159948.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159948.td-b3lyp_6-31+g(d).gjf (generated)

004159948.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159948.mol 004159948.PUBCHEM 004159948.mol (via Jmol)
004159979.b3lyp_6-31g(d).inp

004159979.b3lyp_6-31g(d).qchem.inp (generated)

004159979.b3lyp_6-31g(d).gjf (generated)

004159979.b3lyp_6-31g(d).firefly.inp (generated)

004159979.b3lyp_6-31g(d).smash.inp (generated)

004159979.b3lyp_6-31g(d).nwchem.inp (generated) 004159979.b3lyp_6-31g(d).log.xz 004159979.td-b3lyp_6-31g+(d).inp 004159979.td-b3lyp_6-31g+(d).log.xz

004159979.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159979.td-b3lyp_6-31+g(d).gjf (generated)

004159979.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159979.mol 004159979.PUBCHEM 004159979.mol (via Jmol)
004159981.b3lyp_6-31g(d).inp

004159981.b3lyp_6-31g(d).qchem.inp (generated)

004159981.b3lyp_6-31g(d).gjf (generated)

004159981.b3lyp_6-31g(d).firefly.inp (generated)

004159981.b3lyp_6-31g(d).smash.inp (generated)

004159981.b3lyp_6-31g(d).nwchem.inp (generated) 004159981.b3lyp_6-31g(d).log.xz 004159981.td-b3lyp_6-31g+(d).inp 004159981.td-b3lyp_6-31g+(d).log.xz

004159981.td-b3lyp_6-31+g(d).qchem.inp (generated)

004159981.td-b3lyp_6-31+g(d).gjf (generated)

004159981.td-b3lyp_6-31+g(d).firefly.inp (generated)

004159981.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004159981.mol 004159981.PUBCHEM 004159981.mol (via Jmol)
004160052.b3lyp_6-31g(d).inp

004160052.b3lyp_6-31g(d).qchem.inp (generated)

004160052.b3lyp_6-31g(d).gjf (generated)

004160052.b3lyp_6-31g(d).firefly.inp (generated)

004160052.b3lyp_6-31g(d).smash.inp (generated)

004160052.b3lyp_6-31g(d).nwchem.inp (generated) 004160052.b3lyp_6-31g(d).log.xz 004160052.mol 004160052.PUBCHEM 004160052.mol (via Jmol)
004160080.b3lyp_6-31g(d).inp

004160080.b3lyp_6-31g(d).qchem.inp (generated)

004160080.b3lyp_6-31g(d).gjf (generated)

004160080.b3lyp_6-31g(d).firefly.inp (generated)

004160080.b3lyp_6-31g(d).smash.inp (generated)

004160080.b3lyp_6-31g(d).nwchem.inp (generated) 004160080.b3lyp_6-31g(d).log.xz 004160080.td-b3lyp_6-31g+(d).inp 004160080.td-b3lyp_6-31g+(d).log.xz

004160080.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160080.td-b3lyp_6-31+g(d).gjf (generated)

004160080.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160080.mol 004160080.PUBCHEM 004160080.mol (via Jmol)
004160085.b3lyp_6-31g(d).inp

004160085.b3lyp_6-31g(d).qchem.inp (generated)

004160085.b3lyp_6-31g(d).gjf (generated)

004160085.b3lyp_6-31g(d).firefly.inp (generated)

004160085.b3lyp_6-31g(d).smash.inp (generated)

004160085.b3lyp_6-31g(d).nwchem.inp (generated) 004160085.b3lyp_6-31g(d).log.xz 004160085.td-b3lyp_6-31g+(d).inp 004160085.td-b3lyp_6-31g+(d).log.xz

004160085.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160085.td-b3lyp_6-31+g(d).gjf (generated)

004160085.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160085.mol 004160085.PUBCHEM 004160085.mol (via Jmol)
004160119.b3lyp_6-31g(d).inp

004160119.b3lyp_6-31g(d).qchem.inp (generated)

004160119.b3lyp_6-31g(d).gjf (generated)

004160119.b3lyp_6-31g(d).firefly.inp (generated)

004160119.b3lyp_6-31g(d).smash.inp (generated)

004160119.b3lyp_6-31g(d).nwchem.inp (generated) 004160119.b3lyp_6-31g(d).log.xz 004160119.td-b3lyp_6-31g+(d).inp 004160119.td-b3lyp_6-31g+(d).log.xz

004160119.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160119.td-b3lyp_6-31+g(d).gjf (generated)

004160119.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160119.mol 004160119.PUBCHEM 004160119.mol (via Jmol)
004160156.b3lyp_6-31g(d).inp

004160156.b3lyp_6-31g(d).qchem.inp (generated)

004160156.b3lyp_6-31g(d).gjf (generated)

004160156.b3lyp_6-31g(d).firefly.inp (generated)

004160156.b3lyp_6-31g(d).smash.inp (generated)

004160156.b3lyp_6-31g(d).nwchem.inp (generated) 004160156.b3lyp_6-31g(d).log.xz 004160156.mol 004160156.PUBCHEM 004160156.mol (via Jmol)
004160186.b3lyp_6-31g(d).inp

004160186.b3lyp_6-31g(d).qchem.inp (generated)

004160186.b3lyp_6-31g(d).gjf (generated)

004160186.b3lyp_6-31g(d).firefly.inp (generated)

004160186.b3lyp_6-31g(d).smash.inp (generated)

004160186.b3lyp_6-31g(d).nwchem.inp (generated) 004160186.b3lyp_6-31g(d).log.xz 004160186.td-b3lyp_6-31g+(d).inp 004160186.td-b3lyp_6-31g+(d).log.xz

004160186.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160186.td-b3lyp_6-31+g(d).gjf (generated)

004160186.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160186.mol 004160186.PUBCHEM 004160186.mol (via Jmol)
004160188.b3lyp_6-31g(d).inp

004160188.b3lyp_6-31g(d).qchem.inp (generated)

004160188.b3lyp_6-31g(d).gjf (generated)

004160188.b3lyp_6-31g(d).firefly.inp (generated)

004160188.b3lyp_6-31g(d).smash.inp (generated)

004160188.b3lyp_6-31g(d).nwchem.inp (generated) 004160188.b3lyp_6-31g(d).log.xz 004160188.td-b3lyp_6-31g+(d).inp 004160188.td-b3lyp_6-31g+(d).log.xz

004160188.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160188.td-b3lyp_6-31+g(d).gjf (generated)

004160188.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160188.mol 004160188.PUBCHEM 004160188.mol (via Jmol)
004160229.b3lyp_6-31g(d).inp

004160229.b3lyp_6-31g(d).qchem.inp (generated)

004160229.b3lyp_6-31g(d).gjf (generated)

004160229.b3lyp_6-31g(d).firefly.inp (generated)

004160229.b3lyp_6-31g(d).smash.inp (generated)

004160229.b3lyp_6-31g(d).nwchem.inp (generated) 004160229.b3lyp_6-31g(d).log.xz 004160229.td-b3lyp_6-31g+(d).inp 004160229.td-b3lyp_6-31g+(d).log.xz

004160229.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160229.td-b3lyp_6-31+g(d).gjf (generated)

004160229.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160229.mol 004160229.PUBCHEM 004160229.mol (via Jmol)
004160238.b3lyp_6-31g(d).inp

004160238.b3lyp_6-31g(d).qchem.inp (generated)

004160238.b3lyp_6-31g(d).gjf (generated)

004160238.b3lyp_6-31g(d).firefly.inp (generated)

004160238.b3lyp_6-31g(d).smash.inp (generated)

004160238.b3lyp_6-31g(d).nwchem.inp (generated) 004160238.b3lyp_6-31g(d).log.xz 004160238.td-b3lyp_6-31g+(d).inp 004160238.td-b3lyp_6-31g+(d).log.xz

004160238.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160238.td-b3lyp_6-31+g(d).gjf (generated)

004160238.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160238.mol 004160238.PUBCHEM 004160238.mol (via Jmol)
004160239.b3lyp_6-31g(d).inp

004160239.b3lyp_6-31g(d).qchem.inp (generated)

004160239.b3lyp_6-31g(d).gjf (generated)

004160239.b3lyp_6-31g(d).firefly.inp (generated)

004160239.b3lyp_6-31g(d).smash.inp (generated)

004160239.b3lyp_6-31g(d).nwchem.inp (generated) 004160239.b3lyp_6-31g(d).log.xz 004160239.td-b3lyp_6-31g+(d).inp 004160239.td-b3lyp_6-31g+(d).log.xz

004160239.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160239.td-b3lyp_6-31+g(d).gjf (generated)

004160239.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160239.mol 004160239.PUBCHEM 004160239.mol (via Jmol)
004160240.b3lyp_6-31g(d).inp

004160240.b3lyp_6-31g(d).qchem.inp (generated)

004160240.b3lyp_6-31g(d).gjf (generated)

004160240.b3lyp_6-31g(d).firefly.inp (generated)

004160240.b3lyp_6-31g(d).smash.inp (generated)

004160240.b3lyp_6-31g(d).nwchem.inp (generated) 004160240.b3lyp_6-31g(d).log.xz 004160240.td-b3lyp_6-31g+(d).inp 004160240.td-b3lyp_6-31g+(d).log.xz

004160240.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160240.td-b3lyp_6-31+g(d).gjf (generated)

004160240.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160240.mol 004160240.PUBCHEM 004160240.mol (via Jmol)
004160251.b3lyp_6-31g(d).inp

004160251.b3lyp_6-31g(d).qchem.inp (generated)

004160251.b3lyp_6-31g(d).gjf (generated)

004160251.b3lyp_6-31g(d).firefly.inp (generated)

004160251.b3lyp_6-31g(d).smash.inp (generated)

004160251.b3lyp_6-31g(d).nwchem.inp (generated) 004160251.b3lyp_6-31g(d).log.xz 004160251.td-b3lyp_6-31g+(d).inp 004160251.td-b3lyp_6-31g+(d).log.xz

004160251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160251.td-b3lyp_6-31+g(d).gjf (generated)

004160251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160251.mol 004160251.PUBCHEM 004160251.mol (via Jmol)
004160368.b3lyp_6-31g(d).inp

004160368.b3lyp_6-31g(d).qchem.inp (generated)

004160368.b3lyp_6-31g(d).gjf (generated)

004160368.b3lyp_6-31g(d).firefly.inp (generated)

004160368.b3lyp_6-31g(d).smash.inp (generated)

004160368.b3lyp_6-31g(d).nwchem.inp (generated) 004160368.b3lyp_6-31g(d).log.xz 004160368.td-b3lyp_6-31g+(d).inp 004160368.td-b3lyp_6-31g+(d).log.xz

004160368.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160368.td-b3lyp_6-31+g(d).gjf (generated)

004160368.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160368.mol 004160368.PUBCHEM 004160368.mol (via Jmol)
004160370.b3lyp_6-31g(d).inp

004160370.b3lyp_6-31g(d).qchem.inp (generated)

004160370.b3lyp_6-31g(d).gjf (generated)

004160370.b3lyp_6-31g(d).firefly.inp (generated)

004160370.b3lyp_6-31g(d).smash.inp (generated)

004160370.b3lyp_6-31g(d).nwchem.inp (generated) 004160370.b3lyp_6-31g(d).log.xz 004160370.mol 004160370.PUBCHEM 004160370.mol (via Jmol)
004160378.b3lyp_6-31g(d).inp

004160378.b3lyp_6-31g(d).qchem.inp (generated)

004160378.b3lyp_6-31g(d).gjf (generated)

004160378.b3lyp_6-31g(d).firefly.inp (generated)

004160378.b3lyp_6-31g(d).smash.inp (generated)

004160378.b3lyp_6-31g(d).nwchem.inp (generated) 004160378.b3lyp_6-31g(d).log.xz 004160378.td-b3lyp_6-31g+(d).inp 004160378.td-b3lyp_6-31g+(d).log.xz

004160378.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160378.td-b3lyp_6-31+g(d).gjf (generated)

004160378.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160378.mol 004160378.PUBCHEM 004160378.mol (via Jmol)
004160388.b3lyp_6-31g(d).inp

004160388.b3lyp_6-31g(d).qchem.inp (generated)

004160388.b3lyp_6-31g(d).gjf (generated)

004160388.b3lyp_6-31g(d).firefly.inp (generated)

004160388.b3lyp_6-31g(d).smash.inp (generated)

004160388.b3lyp_6-31g(d).nwchem.inp (generated) 004160388.b3lyp_6-31g(d).log.xz 004160388.td-b3lyp_6-31g+(d).inp 004160388.td-b3lyp_6-31g+(d).log.xz

004160388.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160388.td-b3lyp_6-31+g(d).gjf (generated)

004160388.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160388.mol 004160388.PUBCHEM 004160388.mol (via Jmol)
004160413.b3lyp_6-31g(d).inp

004160413.b3lyp_6-31g(d).qchem.inp (generated)

004160413.b3lyp_6-31g(d).gjf (generated)

004160413.b3lyp_6-31g(d).firefly.inp (generated)

004160413.b3lyp_6-31g(d).smash.inp (generated)

004160413.b3lyp_6-31g(d).nwchem.inp (generated) 004160413.b3lyp_6-31g(d).log.xz 004160413.td-b3lyp_6-31g+(d).inp 004160413.td-b3lyp_6-31g+(d).log.xz

004160413.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160413.td-b3lyp_6-31+g(d).gjf (generated)

004160413.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160413.mol 004160413.PUBCHEM 004160413.mol (via Jmol)
004160471.b3lyp_6-31g(d).inp

004160471.b3lyp_6-31g(d).qchem.inp (generated)

004160471.b3lyp_6-31g(d).gjf (generated)

004160471.b3lyp_6-31g(d).firefly.inp (generated)

004160471.b3lyp_6-31g(d).smash.inp (generated)

004160471.b3lyp_6-31g(d).nwchem.inp (generated) 004160471.b3lyp_6-31g(d).log.xz 004160471.td-b3lyp_6-31g+(d).inp 004160471.td-b3lyp_6-31g+(d).log.xz

004160471.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160471.td-b3lyp_6-31+g(d).gjf (generated)

004160471.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160471.mol 004160471.PUBCHEM 004160471.mol (via Jmol)
004160499.b3lyp_6-31g(d).inp

004160499.b3lyp_6-31g(d).qchem.inp (generated)

004160499.b3lyp_6-31g(d).gjf (generated)

004160499.b3lyp_6-31g(d).firefly.inp (generated)

004160499.b3lyp_6-31g(d).smash.inp (generated)

004160499.b3lyp_6-31g(d).nwchem.inp (generated) 004160499.b3lyp_6-31g(d).log.xz 004160499.td-b3lyp_6-31g+(d).inp 004160499.td-b3lyp_6-31g+(d).log.xz

004160499.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160499.td-b3lyp_6-31+g(d).gjf (generated)

004160499.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160499.mol 004160499.PUBCHEM 004160499.mol (via Jmol)
004160564.b3lyp_6-31g(d).inp

004160564.b3lyp_6-31g(d).qchem.inp (generated)

004160564.b3lyp_6-31g(d).gjf (generated)

004160564.b3lyp_6-31g(d).firefly.inp (generated)

004160564.b3lyp_6-31g(d).smash.inp (generated)

004160564.b3lyp_6-31g(d).nwchem.inp (generated) 004160564.b3lyp_6-31g(d).log.xz 004160564.td-b3lyp_6-31g+(d).inp 004160564.td-b3lyp_6-31g+(d).log.xz

004160564.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160564.td-b3lyp_6-31+g(d).gjf (generated)

004160564.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160564.mol 004160564.PUBCHEM 004160564.mol (via Jmol)
004160590.b3lyp_6-31g(d).inp

004160590.b3lyp_6-31g(d).qchem.inp (generated)

004160590.b3lyp_6-31g(d).gjf (generated)

004160590.b3lyp_6-31g(d).firefly.inp (generated)

004160590.b3lyp_6-31g(d).smash.inp (generated)

004160590.b3lyp_6-31g(d).nwchem.inp (generated) 004160590.b3lyp_6-31g(d).log.xz 004160590.td-b3lyp_6-31g+(d).inp 004160590.td-b3lyp_6-31g+(d).log.xz

004160590.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160590.td-b3lyp_6-31+g(d).gjf (generated)

004160590.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160590.mol 004160590.PUBCHEM 004160590.mol (via Jmol)
004160615.b3lyp_6-31g(d).inp

004160615.b3lyp_6-31g(d).qchem.inp (generated)

004160615.b3lyp_6-31g(d).gjf (generated)

004160615.b3lyp_6-31g(d).firefly.inp (generated)

004160615.b3lyp_6-31g(d).smash.inp (generated)

004160615.b3lyp_6-31g(d).nwchem.inp (generated) 004160615.b3lyp_6-31g(d).log.xz 004160615.td-b3lyp_6-31g+(d).inp 004160615.td-b3lyp_6-31g+(d).log.xz

004160615.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160615.td-b3lyp_6-31+g(d).gjf (generated)

004160615.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160615.mol 004160615.PUBCHEM 004160615.mol (via Jmol)
004160623.b3lyp_6-31g(d).inp

004160623.b3lyp_6-31g(d).qchem.inp (generated)

004160623.b3lyp_6-31g(d).gjf (generated)

004160623.b3lyp_6-31g(d).firefly.inp (generated)

004160623.b3lyp_6-31g(d).smash.inp (generated)

004160623.b3lyp_6-31g(d).nwchem.inp (generated) 004160623.b3lyp_6-31g(d).log.xz 004160623.td-b3lyp_6-31g+(d).inp 004160623.td-b3lyp_6-31g+(d).log.xz

004160623.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160623.td-b3lyp_6-31+g(d).gjf (generated)

004160623.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160623.mol 004160623.PUBCHEM 004160623.mol (via Jmol)
004160710.b3lyp_6-31g(d).inp

004160710.b3lyp_6-31g(d).qchem.inp (generated)

004160710.b3lyp_6-31g(d).gjf (generated)

004160710.b3lyp_6-31g(d).firefly.inp (generated)

004160710.b3lyp_6-31g(d).smash.inp (generated)

004160710.b3lyp_6-31g(d).nwchem.inp (generated) 004160710.b3lyp_6-31g(d).log.xz 004160710.td-b3lyp_6-31g+(d).inp 004160710.td-b3lyp_6-31g+(d).log.xz

004160710.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160710.td-b3lyp_6-31+g(d).gjf (generated)

004160710.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160710.mol 004160710.PUBCHEM 004160710.mol (via Jmol)
004160723.b3lyp_6-31g(d).inp

004160723.b3lyp_6-31g(d).qchem.inp (generated)

004160723.b3lyp_6-31g(d).gjf (generated)

004160723.b3lyp_6-31g(d).firefly.inp (generated)

004160723.b3lyp_6-31g(d).smash.inp (generated)

004160723.b3lyp_6-31g(d).nwchem.inp (generated) 004160723.b3lyp_6-31g(d).log.xz 004160723.td-b3lyp_6-31g+(d).inp 004160723.td-b3lyp_6-31g+(d).log.xz

004160723.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160723.td-b3lyp_6-31+g(d).gjf (generated)

004160723.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160723.mol 004160723.PUBCHEM 004160723.mol (via Jmol)
004160843.b3lyp_6-31g(d).inp

004160843.b3lyp_6-31g(d).qchem.inp (generated)

004160843.b3lyp_6-31g(d).gjf (generated)

004160843.b3lyp_6-31g(d).firefly.inp (generated)

004160843.b3lyp_6-31g(d).smash.inp (generated)

004160843.b3lyp_6-31g(d).nwchem.inp (generated) 004160843.b3lyp_6-31g(d).log.xz 004160843.td-b3lyp_6-31g+(d).inp 004160843.td-b3lyp_6-31g+(d).log.xz

004160843.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160843.td-b3lyp_6-31+g(d).gjf (generated)

004160843.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160843.mol 004160843.PUBCHEM 004160843.mol (via Jmol)
004160846.b3lyp_6-31g(d).inp

004160846.b3lyp_6-31g(d).qchem.inp (generated)

004160846.b3lyp_6-31g(d).gjf (generated)

004160846.b3lyp_6-31g(d).firefly.inp (generated)

004160846.b3lyp_6-31g(d).smash.inp (generated)

004160846.b3lyp_6-31g(d).nwchem.inp (generated) 004160846.b3lyp_6-31g(d).log.xz 004160846.td-b3lyp_6-31g+(d).inp 004160846.td-b3lyp_6-31g+(d).log.xz

004160846.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160846.td-b3lyp_6-31+g(d).gjf (generated)

004160846.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160846.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160846.mol 004160846.PUBCHEM 004160846.mol (via Jmol)
004160876.b3lyp_6-31g(d).inp

004160876.b3lyp_6-31g(d).qchem.inp (generated)

004160876.b3lyp_6-31g(d).gjf (generated)

004160876.b3lyp_6-31g(d).firefly.inp (generated)

004160876.b3lyp_6-31g(d).smash.inp (generated)

004160876.b3lyp_6-31g(d).nwchem.inp (generated) 004160876.b3lyp_6-31g(d).log.xz 004160876.td-b3lyp_6-31g+(d).inp 004160876.td-b3lyp_6-31g+(d).log.xz

004160876.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160876.td-b3lyp_6-31+g(d).gjf (generated)

004160876.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160876.mol 004160876.PUBCHEM 004160876.mol (via Jmol)
004160892.b3lyp_6-31g(d).inp

004160892.b3lyp_6-31g(d).qchem.inp (generated)

004160892.b3lyp_6-31g(d).gjf (generated)

004160892.b3lyp_6-31g(d).firefly.inp (generated)

004160892.b3lyp_6-31g(d).smash.inp (generated)

004160892.b3lyp_6-31g(d).nwchem.inp (generated) 004160892.b3lyp_6-31g(d).log.xz 004160892.td-b3lyp_6-31g+(d).inp 004160892.td-b3lyp_6-31g+(d).log.xz

004160892.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160892.td-b3lyp_6-31+g(d).gjf (generated)

004160892.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160892.mol 004160892.PUBCHEM 004160892.mol (via Jmol)
004160985.b3lyp_6-31g(d).inp

004160985.b3lyp_6-31g(d).qchem.inp (generated)

004160985.b3lyp_6-31g(d).gjf (generated)

004160985.b3lyp_6-31g(d).firefly.inp (generated)

004160985.b3lyp_6-31g(d).smash.inp (generated)

004160985.b3lyp_6-31g(d).nwchem.inp (generated) 004160985.b3lyp_6-31g(d).log.xz 004160985.td-b3lyp_6-31g+(d).inp 004160985.td-b3lyp_6-31g+(d).log.xz

004160985.td-b3lyp_6-31+g(d).qchem.inp (generated)

004160985.td-b3lyp_6-31+g(d).gjf (generated)

004160985.td-b3lyp_6-31+g(d).firefly.inp (generated)

004160985.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004160985.mol 004160985.PUBCHEM 004160985.mol (via Jmol)
004161046.b3lyp_6-31g(d).inp

004161046.b3lyp_6-31g(d).qchem.inp (generated)

004161046.b3lyp_6-31g(d).gjf (generated)

004161046.b3lyp_6-31g(d).firefly.inp (generated)

004161046.b3lyp_6-31g(d).smash.inp (generated)

004161046.b3lyp_6-31g(d).nwchem.inp (generated) 004161046.b3lyp_6-31g(d).log.xz 004161046.mol 004161046.PUBCHEM 004161046.mol (via Jmol)
004161048.b3lyp_6-31g(d).inp

004161048.b3lyp_6-31g(d).qchem.inp (generated)

004161048.b3lyp_6-31g(d).gjf (generated)

004161048.b3lyp_6-31g(d).firefly.inp (generated)

004161048.b3lyp_6-31g(d).smash.inp (generated)

004161048.b3lyp_6-31g(d).nwchem.inp (generated) 004161048.b3lyp_6-31g(d).log.xz 004161048.mol 004161048.PUBCHEM 004161048.mol (via Jmol)
004161102.b3lyp_6-31g(d).inp

004161102.b3lyp_6-31g(d).qchem.inp (generated)

004161102.b3lyp_6-31g(d).gjf (generated)

004161102.b3lyp_6-31g(d).firefly.inp (generated)

004161102.b3lyp_6-31g(d).smash.inp (generated)

004161102.b3lyp_6-31g(d).nwchem.inp (generated) 004161102.b3lyp_6-31g(d).log.xz 004161102.td-b3lyp_6-31g+(d).inp 004161102.td-b3lyp_6-31g+(d).log.xz

004161102.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161102.td-b3lyp_6-31+g(d).gjf (generated)

004161102.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161102.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161102.mol 004161102.PUBCHEM 004161102.mol (via Jmol)
004161142.b3lyp_6-31g(d).inp

004161142.b3lyp_6-31g(d).qchem.inp (generated)

004161142.b3lyp_6-31g(d).gjf (generated)

004161142.b3lyp_6-31g(d).firefly.inp (generated)

004161142.b3lyp_6-31g(d).smash.inp (generated)

004161142.b3lyp_6-31g(d).nwchem.inp (generated) 004161142.b3lyp_6-31g(d).log.xz 004161142.td-b3lyp_6-31g+(d).inp 004161142.td-b3lyp_6-31g+(d).log.xz

004161142.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161142.td-b3lyp_6-31+g(d).gjf (generated)

004161142.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161142.mol 004161142.PUBCHEM 004161142.mol (via Jmol)
004161168.b3lyp_6-31g(d).inp

004161168.b3lyp_6-31g(d).qchem.inp (generated)

004161168.b3lyp_6-31g(d).gjf (generated)

004161168.b3lyp_6-31g(d).firefly.inp (generated)

004161168.b3lyp_6-31g(d).smash.inp (generated)

004161168.b3lyp_6-31g(d).nwchem.inp (generated) 004161168.b3lyp_6-31g(d).log.xz 004161168.td-b3lyp_6-31g+(d).inp 004161168.td-b3lyp_6-31g+(d).log.xz

004161168.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161168.td-b3lyp_6-31+g(d).gjf (generated)

004161168.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161168.mol 004161168.PUBCHEM 004161168.mol (via Jmol)
004161205.b3lyp_6-31g(d).inp

004161205.b3lyp_6-31g(d).qchem.inp (generated)

004161205.b3lyp_6-31g(d).gjf (generated)

004161205.b3lyp_6-31g(d).firefly.inp (generated)

004161205.b3lyp_6-31g(d).smash.inp (generated)

004161205.b3lyp_6-31g(d).nwchem.inp (generated) 004161205.b3lyp_6-31g(d).log.xz 004161205.td-b3lyp_6-31g+(d).inp 004161205.td-b3lyp_6-31g+(d).log.xz

004161205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161205.td-b3lyp_6-31+g(d).gjf (generated)

004161205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161205.mol 004161205.PUBCHEM 004161205.mol (via Jmol)
004161249.b3lyp_6-31g(d).inp

004161249.b3lyp_6-31g(d).qchem.inp (generated)

004161249.b3lyp_6-31g(d).gjf (generated)

004161249.b3lyp_6-31g(d).firefly.inp (generated)

004161249.b3lyp_6-31g(d).smash.inp (generated)

004161249.b3lyp_6-31g(d).nwchem.inp (generated) 004161249.b3lyp_6-31g(d).log.xz 004161249.td-b3lyp_6-31g+(d).inp 004161249.td-b3lyp_6-31g+(d).log.xz

004161249.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161249.td-b3lyp_6-31+g(d).gjf (generated)

004161249.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161249.mol 004161249.PUBCHEM 004161249.mol (via Jmol)
004161274.b3lyp_6-31g(d).inp

004161274.b3lyp_6-31g(d).qchem.inp (generated)

004161274.b3lyp_6-31g(d).gjf (generated)

004161274.b3lyp_6-31g(d).firefly.inp (generated)

004161274.b3lyp_6-31g(d).smash.inp (generated)

004161274.b3lyp_6-31g(d).nwchem.inp (generated) 004161274.b3lyp_6-31g(d).log.xz 004161274.td-b3lyp_6-31g+(d).inp 004161274.td-b3lyp_6-31g+(d).log.xz

004161274.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161274.td-b3lyp_6-31+g(d).gjf (generated)

004161274.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161274.mol 004161274.PUBCHEM 004161274.mol (via Jmol)
004161286.b3lyp_6-31g(d).inp

004161286.b3lyp_6-31g(d).qchem.inp (generated)

004161286.b3lyp_6-31g(d).gjf (generated)

004161286.b3lyp_6-31g(d).firefly.inp (generated)

004161286.b3lyp_6-31g(d).smash.inp (generated)

004161286.b3lyp_6-31g(d).nwchem.inp (generated) 004161286.b3lyp_6-31g(d).log.xz 004161286.mol 004161286.PUBCHEM 004161286.mol (via Jmol)
004161309.b3lyp_6-31g(d).inp

004161309.b3lyp_6-31g(d).qchem.inp (generated)

004161309.b3lyp_6-31g(d).gjf (generated)

004161309.b3lyp_6-31g(d).firefly.inp (generated)

004161309.b3lyp_6-31g(d).smash.inp (generated)

004161309.b3lyp_6-31g(d).nwchem.inp (generated) 004161309.b3lyp_6-31g(d).log.xz 004161309.td-b3lyp_6-31g+(d).inp 004161309.td-b3lyp_6-31g+(d).log.xz

004161309.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161309.td-b3lyp_6-31+g(d).gjf (generated)

004161309.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161309.mol 004161309.PUBCHEM 004161309.mol (via Jmol)
004161393.b3lyp_6-31g(d).inp

004161393.b3lyp_6-31g(d).qchem.inp (generated)

004161393.b3lyp_6-31g(d).gjf (generated)

004161393.b3lyp_6-31g(d).firefly.inp (generated)

004161393.b3lyp_6-31g(d).smash.inp (generated)

004161393.b3lyp_6-31g(d).nwchem.inp (generated) 004161393.b3lyp_6-31g(d).log.xz 004161393.mol 004161393.PUBCHEM 004161393.mol (via Jmol)
004161407.b3lyp_6-31g(d).inp

004161407.b3lyp_6-31g(d).qchem.inp (generated)

004161407.b3lyp_6-31g(d).gjf (generated)

004161407.b3lyp_6-31g(d).firefly.inp (generated)

004161407.b3lyp_6-31g(d).smash.inp (generated)

004161407.b3lyp_6-31g(d).nwchem.inp (generated) 004161407.b3lyp_6-31g(d).log.xz 004161407.td-b3lyp_6-31g+(d).inp 004161407.td-b3lyp_6-31g+(d).log.xz

004161407.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161407.td-b3lyp_6-31+g(d).gjf (generated)

004161407.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161407.mol 004161407.PUBCHEM 004161407.mol (via Jmol)
004161412.b3lyp_6-31g(d).inp

004161412.b3lyp_6-31g(d).qchem.inp (generated)

004161412.b3lyp_6-31g(d).gjf (generated)

004161412.b3lyp_6-31g(d).firefly.inp (generated)

004161412.b3lyp_6-31g(d).smash.inp (generated)

004161412.b3lyp_6-31g(d).nwchem.inp (generated) 004161412.b3lyp_6-31g(d).log.xz 004161412.td-b3lyp_6-31g+(d).inp 004161412.td-b3lyp_6-31g+(d).log.xz

004161412.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161412.td-b3lyp_6-31+g(d).gjf (generated)

004161412.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161412.mol 004161412.PUBCHEM 004161412.mol (via Jmol)
004161445.b3lyp_6-31g(d).inp

004161445.b3lyp_6-31g(d).qchem.inp (generated)

004161445.b3lyp_6-31g(d).gjf (generated)

004161445.b3lyp_6-31g(d).firefly.inp (generated)

004161445.b3lyp_6-31g(d).smash.inp (generated)

004161445.b3lyp_6-31g(d).nwchem.inp (generated) 004161445.b3lyp_6-31g(d).log.xz 004161445.td-b3lyp_6-31g+(d).inp 004161445.td-b3lyp_6-31g+(d).log.xz

004161445.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161445.td-b3lyp_6-31+g(d).gjf (generated)

004161445.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161445.mol 004161445.PUBCHEM 004161445.mol (via Jmol)
004161473.b3lyp_6-31g(d).inp

004161473.b3lyp_6-31g(d).qchem.inp (generated)

004161473.b3lyp_6-31g(d).gjf (generated)

004161473.b3lyp_6-31g(d).firefly.inp (generated)

004161473.b3lyp_6-31g(d).smash.inp (generated)

004161473.b3lyp_6-31g(d).nwchem.inp (generated) 004161473.b3lyp_6-31g(d).log.xz 004161473.td-b3lyp_6-31g+(d).inp 004161473.td-b3lyp_6-31g+(d).log.xz

004161473.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161473.td-b3lyp_6-31+g(d).gjf (generated)

004161473.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161473.mol 004161473.PUBCHEM 004161473.mol (via Jmol)
004161474.b3lyp_6-31g(d).inp

004161474.b3lyp_6-31g(d).qchem.inp (generated)

004161474.b3lyp_6-31g(d).gjf (generated)

004161474.b3lyp_6-31g(d).firefly.inp (generated)

004161474.b3lyp_6-31g(d).smash.inp (generated)

004161474.b3lyp_6-31g(d).nwchem.inp (generated) 004161474.b3lyp_6-31g(d).log.xz 004161474.td-b3lyp_6-31g+(d).inp 004161474.td-b3lyp_6-31g+(d).log.xz

004161474.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161474.td-b3lyp_6-31+g(d).gjf (generated)

004161474.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161474.mol 004161474.PUBCHEM 004161474.mol (via Jmol)
004161478.b3lyp_6-31g(d).inp

004161478.b3lyp_6-31g(d).qchem.inp (generated)

004161478.b3lyp_6-31g(d).gjf (generated)

004161478.b3lyp_6-31g(d).firefly.inp (generated)

004161478.b3lyp_6-31g(d).smash.inp (generated)

004161478.b3lyp_6-31g(d).nwchem.inp (generated) 004161478.b3lyp_6-31g(d).log.xz 004161478.mol 004161478.PUBCHEM 004161478.mol (via Jmol)
004161520.b3lyp_6-31g(d).inp

004161520.b3lyp_6-31g(d).qchem.inp (generated)

004161520.b3lyp_6-31g(d).gjf (generated)

004161520.b3lyp_6-31g(d).firefly.inp (generated)

004161520.b3lyp_6-31g(d).smash.inp (generated)

004161520.b3lyp_6-31g(d).nwchem.inp (generated) 004161520.b3lyp_6-31g(d).log.xz 004161520.td-b3lyp_6-31g+(d).inp 004161520.td-b3lyp_6-31g+(d).log.xz

004161520.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161520.td-b3lyp_6-31+g(d).gjf (generated)

004161520.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161520.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161520.mol 004161520.PUBCHEM 004161520.mol (via Jmol)
004161539.b3lyp_6-31g(d).inp

004161539.b3lyp_6-31g(d).qchem.inp (generated)

004161539.b3lyp_6-31g(d).gjf (generated)

004161539.b3lyp_6-31g(d).firefly.inp (generated)

004161539.b3lyp_6-31g(d).smash.inp (generated)

004161539.b3lyp_6-31g(d).nwchem.inp (generated) 004161539.b3lyp_6-31g(d).log.xz 004161539.td-b3lyp_6-31g+(d).inp 004161539.td-b3lyp_6-31g+(d).log.xz

004161539.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161539.td-b3lyp_6-31+g(d).gjf (generated)

004161539.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161539.mol 004161539.PUBCHEM 004161539.mol (via Jmol)
004161568.b3lyp_6-31g(d).inp

004161568.b3lyp_6-31g(d).qchem.inp (generated)

004161568.b3lyp_6-31g(d).gjf (generated)

004161568.b3lyp_6-31g(d).firefly.inp (generated)

004161568.b3lyp_6-31g(d).smash.inp (generated)

004161568.b3lyp_6-31g(d).nwchem.inp (generated) 004161568.b3lyp_6-31g(d).log.xz 004161568.mol 004161568.PUBCHEM 004161568.mol (via Jmol)
004161580.b3lyp_6-31g(d).inp

004161580.b3lyp_6-31g(d).qchem.inp (generated)

004161580.b3lyp_6-31g(d).gjf (generated)

004161580.b3lyp_6-31g(d).firefly.inp (generated)

004161580.b3lyp_6-31g(d).smash.inp (generated)

004161580.b3lyp_6-31g(d).nwchem.inp (generated) 004161580.b3lyp_6-31g(d).log.xz 004161580.td-b3lyp_6-31g+(d).inp 004161580.td-b3lyp_6-31g+(d).log.xz

004161580.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161580.td-b3lyp_6-31+g(d).gjf (generated)

004161580.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161580.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161580.mol 004161580.PUBCHEM 004161580.mol (via Jmol)
004161581.b3lyp_6-31g(d).inp

004161581.b3lyp_6-31g(d).qchem.inp (generated)

004161581.b3lyp_6-31g(d).gjf (generated)

004161581.b3lyp_6-31g(d).firefly.inp (generated)

004161581.b3lyp_6-31g(d).smash.inp (generated)

004161581.b3lyp_6-31g(d).nwchem.inp (generated) 004161581.b3lyp_6-31g(d).log.xz 004161581.td-b3lyp_6-31g+(d).inp 004161581.td-b3lyp_6-31g+(d).log.xz

004161581.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161581.td-b3lyp_6-31+g(d).gjf (generated)

004161581.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161581.mol 004161581.PUBCHEM 004161581.mol (via Jmol)
004161592.b3lyp_6-31g(d).inp

004161592.b3lyp_6-31g(d).qchem.inp (generated)

004161592.b3lyp_6-31g(d).gjf (generated)

004161592.b3lyp_6-31g(d).firefly.inp (generated)

004161592.b3lyp_6-31g(d).smash.inp (generated)

004161592.b3lyp_6-31g(d).nwchem.inp (generated) 004161592.b3lyp_6-31g(d).log.xz 004161592.td-b3lyp_6-31g+(d).inp 004161592.td-b3lyp_6-31g+(d).log.xz

004161592.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161592.td-b3lyp_6-31+g(d).gjf (generated)

004161592.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161592.mol 004161592.PUBCHEM 004161592.mol (via Jmol)
004161594.b3lyp_6-31g(d).inp

004161594.b3lyp_6-31g(d).qchem.inp (generated)

004161594.b3lyp_6-31g(d).gjf (generated)

004161594.b3lyp_6-31g(d).firefly.inp (generated)

004161594.b3lyp_6-31g(d).smash.inp (generated)

004161594.b3lyp_6-31g(d).nwchem.inp (generated) 004161594.b3lyp_6-31g(d).log.xz 004161594.td-b3lyp_6-31g+(d).inp 004161594.td-b3lyp_6-31g+(d).log.xz

004161594.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161594.td-b3lyp_6-31+g(d).gjf (generated)

004161594.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161594.mol 004161594.PUBCHEM 004161594.mol (via Jmol)
004161712.b3lyp_6-31g(d).inp

004161712.b3lyp_6-31g(d).qchem.inp (generated)

004161712.b3lyp_6-31g(d).gjf (generated)

004161712.b3lyp_6-31g(d).firefly.inp (generated)

004161712.b3lyp_6-31g(d).smash.inp (generated)

004161712.b3lyp_6-31g(d).nwchem.inp (generated) 004161712.b3lyp_6-31g(d).log.xz 004161712.td-b3lyp_6-31g+(d).inp 004161712.td-b3lyp_6-31g+(d).log.xz

004161712.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161712.td-b3lyp_6-31+g(d).gjf (generated)

004161712.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161712.mol 004161712.PUBCHEM 004161712.mol (via Jmol)
004161716.b3lyp_6-31g(d).inp

004161716.b3lyp_6-31g(d).qchem.inp (generated)

004161716.b3lyp_6-31g(d).gjf (generated)

004161716.b3lyp_6-31g(d).firefly.inp (generated)

004161716.b3lyp_6-31g(d).smash.inp (generated)

004161716.b3lyp_6-31g(d).nwchem.inp (generated) 004161716.b3lyp_6-31g(d).log.xz 004161716.td-b3lyp_6-31g+(d).inp 004161716.td-b3lyp_6-31g+(d).log.xz

004161716.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161716.td-b3lyp_6-31+g(d).gjf (generated)

004161716.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161716.mol 004161716.PUBCHEM 004161716.mol (via Jmol)
004161788.b3lyp_6-31g(d).inp

004161788.b3lyp_6-31g(d).qchem.inp (generated)

004161788.b3lyp_6-31g(d).gjf (generated)

004161788.b3lyp_6-31g(d).firefly.inp (generated)

004161788.b3lyp_6-31g(d).smash.inp (generated)

004161788.b3lyp_6-31g(d).nwchem.inp (generated) 004161788.b3lyp_6-31g(d).log.xz 004161788.td-b3lyp_6-31g+(d).inp 004161788.td-b3lyp_6-31g+(d).log.xz

004161788.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161788.td-b3lyp_6-31+g(d).gjf (generated)

004161788.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161788.mol 004161788.PUBCHEM 004161788.mol (via Jmol)
004161789.b3lyp_6-31g(d).inp

004161789.b3lyp_6-31g(d).qchem.inp (generated)

004161789.b3lyp_6-31g(d).gjf (generated)

004161789.b3lyp_6-31g(d).firefly.inp (generated)

004161789.b3lyp_6-31g(d).smash.inp (generated)

004161789.b3lyp_6-31g(d).nwchem.inp (generated) 004161789.b3lyp_6-31g(d).log.xz 004161789.td-b3lyp_6-31g+(d).inp 004161789.td-b3lyp_6-31g+(d).log.xz

004161789.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161789.td-b3lyp_6-31+g(d).gjf (generated)

004161789.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161789.mol 004161789.PUBCHEM 004161789.mol (via Jmol)
004161809.b3lyp_6-31g(d).inp

004161809.b3lyp_6-31g(d).qchem.inp (generated)

004161809.b3lyp_6-31g(d).gjf (generated)

004161809.b3lyp_6-31g(d).firefly.inp (generated)

004161809.b3lyp_6-31g(d).smash.inp (generated)

004161809.b3lyp_6-31g(d).nwchem.inp (generated) 004161809.b3lyp_6-31g(d).log.xz 004161809.td-b3lyp_6-31g+(d).inp 004161809.td-b3lyp_6-31g+(d).log.xz

004161809.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161809.td-b3lyp_6-31+g(d).gjf (generated)

004161809.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161809.mol 004161809.PUBCHEM 004161809.mol (via Jmol)
004161817.b3lyp_6-31g(d).inp

004161817.b3lyp_6-31g(d).qchem.inp (generated)

004161817.b3lyp_6-31g(d).gjf (generated)

004161817.b3lyp_6-31g(d).firefly.inp (generated)

004161817.b3lyp_6-31g(d).smash.inp (generated)

004161817.b3lyp_6-31g(d).nwchem.inp (generated) 004161817.b3lyp_6-31g(d).log.xz 004161817.td-b3lyp_6-31g+(d).inp 004161817.td-b3lyp_6-31g+(d).log.xz

004161817.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161817.td-b3lyp_6-31+g(d).gjf (generated)

004161817.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161817.mol 004161817.PUBCHEM 004161817.mol (via Jmol)
004161818.b3lyp_6-31g(d).inp

004161818.b3lyp_6-31g(d).qchem.inp (generated)

004161818.b3lyp_6-31g(d).gjf (generated)

004161818.b3lyp_6-31g(d).firefly.inp (generated)

004161818.b3lyp_6-31g(d).smash.inp (generated)

004161818.b3lyp_6-31g(d).nwchem.inp (generated) 004161818.b3lyp_6-31g(d).log.xz 004161818.td-b3lyp_6-31g+(d).inp 004161818.td-b3lyp_6-31g+(d).log.xz

004161818.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161818.td-b3lyp_6-31+g(d).gjf (generated)

004161818.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161818.mol 004161818.PUBCHEM 004161818.mol (via Jmol)
004161850.b3lyp_6-31g(d).inp

004161850.b3lyp_6-31g(d).qchem.inp (generated)

004161850.b3lyp_6-31g(d).gjf (generated)

004161850.b3lyp_6-31g(d).firefly.inp (generated)

004161850.b3lyp_6-31g(d).smash.inp (generated)

004161850.b3lyp_6-31g(d).nwchem.inp (generated) 004161850.b3lyp_6-31g(d).log.xz 004161850.mol 004161850.PUBCHEM 004161850.mol (via Jmol)
004161877.b3lyp_6-31g(d).inp

004161877.b3lyp_6-31g(d).qchem.inp (generated)

004161877.b3lyp_6-31g(d).gjf (generated)

004161877.b3lyp_6-31g(d).firefly.inp (generated)

004161877.b3lyp_6-31g(d).smash.inp (generated)

004161877.b3lyp_6-31g(d).nwchem.inp (generated) 004161877.b3lyp_6-31g(d).log.xz 004161877.td-b3lyp_6-31g+(d).inp 004161877.td-b3lyp_6-31g+(d).log.xz

004161877.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161877.td-b3lyp_6-31+g(d).gjf (generated)

004161877.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161877.mol 004161877.PUBCHEM 004161877.mol (via Jmol)
004161946.b3lyp_6-31g(d).inp

004161946.b3lyp_6-31g(d).qchem.inp (generated)

004161946.b3lyp_6-31g(d).gjf (generated)

004161946.b3lyp_6-31g(d).firefly.inp (generated)

004161946.b3lyp_6-31g(d).smash.inp (generated)

004161946.b3lyp_6-31g(d).nwchem.inp (generated) 004161946.b3lyp_6-31g(d).log.xz 004161946.td-b3lyp_6-31g+(d).inp 004161946.td-b3lyp_6-31g+(d).log.xz

004161946.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161946.td-b3lyp_6-31+g(d).gjf (generated)

004161946.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161946.mol 004161946.PUBCHEM 004161946.mol (via Jmol)
004161953.b3lyp_6-31g(d).inp

004161953.b3lyp_6-31g(d).qchem.inp (generated)

004161953.b3lyp_6-31g(d).gjf (generated)

004161953.b3lyp_6-31g(d).firefly.inp (generated)

004161953.b3lyp_6-31g(d).smash.inp (generated)

004161953.b3lyp_6-31g(d).nwchem.inp (generated) 004161953.b3lyp_6-31g(d).log.xz 004161953.td-b3lyp_6-31g+(d).inp 004161953.td-b3lyp_6-31g+(d).log.xz

004161953.td-b3lyp_6-31+g(d).qchem.inp (generated)

004161953.td-b3lyp_6-31+g(d).gjf (generated)

004161953.td-b3lyp_6-31+g(d).firefly.inp (generated)

004161953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004161953.mol 004161953.PUBCHEM 004161953.mol (via Jmol)
004162013.b3lyp_6-31g(d).inp

004162013.b3lyp_6-31g(d).qchem.inp (generated)

004162013.b3lyp_6-31g(d).gjf (generated)

004162013.b3lyp_6-31g(d).firefly.inp (generated)

004162013.b3lyp_6-31g(d).smash.inp (generated)

004162013.b3lyp_6-31g(d).nwchem.inp (generated) 004162013.b3lyp_6-31g(d).log.xz 004162013.td-b3lyp_6-31g+(d).inp 004162013.td-b3lyp_6-31g+(d).log.xz

004162013.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162013.td-b3lyp_6-31+g(d).gjf (generated)

004162013.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162013.mol 004162013.PUBCHEM 004162013.mol (via Jmol)
004162029.b3lyp_6-31g(d).inp

004162029.b3lyp_6-31g(d).qchem.inp (generated)

004162029.b3lyp_6-31g(d).gjf (generated)

004162029.b3lyp_6-31g(d).firefly.inp (generated)

004162029.b3lyp_6-31g(d).smash.inp (generated)

004162029.b3lyp_6-31g(d).nwchem.inp (generated) 004162029.b3lyp_6-31g(d).log.xz 004162029.td-b3lyp_6-31g+(d).inp 004162029.td-b3lyp_6-31g+(d).log.xz

004162029.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162029.td-b3lyp_6-31+g(d).gjf (generated)

004162029.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162029.mol 004162029.PUBCHEM 004162029.mol (via Jmol)
004162141.b3lyp_6-31g(d).inp

004162141.b3lyp_6-31g(d).qchem.inp (generated)

004162141.b3lyp_6-31g(d).gjf (generated)

004162141.b3lyp_6-31g(d).firefly.inp (generated)

004162141.b3lyp_6-31g(d).smash.inp (generated)

004162141.b3lyp_6-31g(d).nwchem.inp (generated) 004162141.b3lyp_6-31g(d).log.xz 004162141.mol 004162141.PUBCHEM 004162141.mol (via Jmol)
004162179.b3lyp_6-31g(d).inp

004162179.b3lyp_6-31g(d).qchem.inp (generated)

004162179.b3lyp_6-31g(d).gjf (generated)

004162179.b3lyp_6-31g(d).firefly.inp (generated)

004162179.b3lyp_6-31g(d).smash.inp (generated)

004162179.b3lyp_6-31g(d).nwchem.inp (generated) 004162179.b3lyp_6-31g(d).log.xz 004162179.mol 004162179.PUBCHEM 004162179.mol (via Jmol)
004162186.b3lyp_6-31g(d).inp

004162186.b3lyp_6-31g(d).qchem.inp (generated)

004162186.b3lyp_6-31g(d).gjf (generated)

004162186.b3lyp_6-31g(d).firefly.inp (generated)

004162186.b3lyp_6-31g(d).smash.inp (generated)

004162186.b3lyp_6-31g(d).nwchem.inp (generated) 004162186.b3lyp_6-31g(d).log.xz 004162186.td-b3lyp_6-31g+(d).inp 004162186.td-b3lyp_6-31g+(d).log.xz

004162186.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162186.td-b3lyp_6-31+g(d).gjf (generated)

004162186.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162186.mol 004162186.PUBCHEM 004162186.mol (via Jmol)
004162187.b3lyp_6-31g(d).inp

004162187.b3lyp_6-31g(d).qchem.inp (generated)

004162187.b3lyp_6-31g(d).gjf (generated)

004162187.b3lyp_6-31g(d).firefly.inp (generated)

004162187.b3lyp_6-31g(d).smash.inp (generated)

004162187.b3lyp_6-31g(d).nwchem.inp (generated) 004162187.b3lyp_6-31g(d).log.xz 004162187.td-b3lyp_6-31g+(d).inp 004162187.td-b3lyp_6-31g+(d).log.xz

004162187.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162187.td-b3lyp_6-31+g(d).gjf (generated)

004162187.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162187.mol 004162187.PUBCHEM 004162187.mol (via Jmol)
004162190.b3lyp_6-31g(d).inp

004162190.b3lyp_6-31g(d).qchem.inp (generated)

004162190.b3lyp_6-31g(d).gjf (generated)

004162190.b3lyp_6-31g(d).firefly.inp (generated)

004162190.b3lyp_6-31g(d).smash.inp (generated)

004162190.b3lyp_6-31g(d).nwchem.inp (generated) 004162190.b3lyp_6-31g(d).log.xz 004162190.mol 004162190.PUBCHEM 004162190.mol (via Jmol)
004162219.b3lyp_6-31g(d).inp

004162219.b3lyp_6-31g(d).qchem.inp (generated)

004162219.b3lyp_6-31g(d).gjf (generated)

004162219.b3lyp_6-31g(d).firefly.inp (generated)

004162219.b3lyp_6-31g(d).smash.inp (generated)

004162219.b3lyp_6-31g(d).nwchem.inp (generated) 004162219.b3lyp_6-31g(d).log.xz 004162219.td-b3lyp_6-31g+(d).inp 004162219.td-b3lyp_6-31g+(d).log.xz

004162219.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162219.td-b3lyp_6-31+g(d).gjf (generated)

004162219.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162219.mol 004162219.PUBCHEM 004162219.mol (via Jmol)
004162250.b3lyp_6-31g(d).inp

004162250.b3lyp_6-31g(d).qchem.inp (generated)

004162250.b3lyp_6-31g(d).gjf (generated)

004162250.b3lyp_6-31g(d).firefly.inp (generated)

004162250.b3lyp_6-31g(d).smash.inp (generated)

004162250.b3lyp_6-31g(d).nwchem.inp (generated) 004162250.b3lyp_6-31g(d).log.xz 004162250.td-b3lyp_6-31g+(d).inp 004162250.td-b3lyp_6-31g+(d).log.xz

004162250.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162250.td-b3lyp_6-31+g(d).gjf (generated)

004162250.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162250.mol 004162250.PUBCHEM 004162250.mol (via Jmol)
004162316.b3lyp_6-31g(d).inp

004162316.b3lyp_6-31g(d).qchem.inp (generated)

004162316.b3lyp_6-31g(d).gjf (generated)

004162316.b3lyp_6-31g(d).firefly.inp (generated)

004162316.b3lyp_6-31g(d).smash.inp (generated)

004162316.b3lyp_6-31g(d).nwchem.inp (generated) 004162316.b3lyp_6-31g(d).log.xz 004162316.td-b3lyp_6-31g+(d).inp 004162316.td-b3lyp_6-31g+(d).log.xz

004162316.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162316.td-b3lyp_6-31+g(d).gjf (generated)

004162316.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162316.mol 004162316.PUBCHEM 004162316.mol (via Jmol)
004162372.b3lyp_6-31g(d).inp

004162372.b3lyp_6-31g(d).qchem.inp (generated)

004162372.b3lyp_6-31g(d).gjf (generated)

004162372.b3lyp_6-31g(d).firefly.inp (generated)

004162372.b3lyp_6-31g(d).smash.inp (generated)

004162372.b3lyp_6-31g(d).nwchem.inp (generated) 004162372.b3lyp_6-31g(d).log.xz 004162372.td-b3lyp_6-31g+(d).inp 004162372.td-b3lyp_6-31g+(d).log.xz

004162372.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162372.td-b3lyp_6-31+g(d).gjf (generated)

004162372.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162372.mol 004162372.PUBCHEM 004162372.mol (via Jmol)
004162420.b3lyp_6-31g(d).inp

004162420.b3lyp_6-31g(d).qchem.inp (generated)

004162420.b3lyp_6-31g(d).gjf (generated)

004162420.b3lyp_6-31g(d).firefly.inp (generated)

004162420.b3lyp_6-31g(d).smash.inp (generated)

004162420.b3lyp_6-31g(d).nwchem.inp (generated) 004162420.b3lyp_6-31g(d).log.xz 004162420.td-b3lyp_6-31g+(d).inp 004162420.td-b3lyp_6-31g+(d).log.xz

004162420.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162420.td-b3lyp_6-31+g(d).gjf (generated)

004162420.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162420.mol 004162420.PUBCHEM 004162420.mol (via Jmol)
004162434.b3lyp_6-31g(d).inp

004162434.b3lyp_6-31g(d).qchem.inp (generated)

004162434.b3lyp_6-31g(d).gjf (generated)

004162434.b3lyp_6-31g(d).firefly.inp (generated)

004162434.b3lyp_6-31g(d).smash.inp (generated)

004162434.b3lyp_6-31g(d).nwchem.inp (generated) 004162434.b3lyp_6-31g(d).log.xz 004162434.td-b3lyp_6-31g+(d).inp 004162434.td-b3lyp_6-31g+(d).log.xz

004162434.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162434.td-b3lyp_6-31+g(d).gjf (generated)

004162434.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162434.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162434.mol 004162434.PUBCHEM 004162434.mol (via Jmol)
004162480.b3lyp_6-31g(d).inp

004162480.b3lyp_6-31g(d).qchem.inp (generated)

004162480.b3lyp_6-31g(d).gjf (generated)

004162480.b3lyp_6-31g(d).firefly.inp (generated)

004162480.b3lyp_6-31g(d).smash.inp (generated)

004162480.b3lyp_6-31g(d).nwchem.inp (generated) 004162480.b3lyp_6-31g(d).log.xz 004162480.td-b3lyp_6-31g+(d).inp 004162480.td-b3lyp_6-31g+(d).log.xz

004162480.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162480.td-b3lyp_6-31+g(d).gjf (generated)

004162480.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162480.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162480.mol 004162480.PUBCHEM 004162480.mol (via Jmol)
004162485.b3lyp_6-31g(d).inp

004162485.b3lyp_6-31g(d).qchem.inp (generated)

004162485.b3lyp_6-31g(d).gjf (generated)

004162485.b3lyp_6-31g(d).firefly.inp (generated)

004162485.b3lyp_6-31g(d).smash.inp (generated)

004162485.b3lyp_6-31g(d).nwchem.inp (generated) 004162485.b3lyp_6-31g(d).log.xz 004162485.td-b3lyp_6-31g+(d).inp 004162485.td-b3lyp_6-31g+(d).log.xz

004162485.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162485.td-b3lyp_6-31+g(d).gjf (generated)

004162485.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162485.mol 004162485.PUBCHEM 004162485.mol (via Jmol)
004162495.b3lyp_6-31g(d).inp

004162495.b3lyp_6-31g(d).qchem.inp (generated)

004162495.b3lyp_6-31g(d).gjf (generated)

004162495.b3lyp_6-31g(d).firefly.inp (generated)

004162495.b3lyp_6-31g(d).smash.inp (generated)

004162495.b3lyp_6-31g(d).nwchem.inp (generated) 004162495.b3lyp_6-31g(d).log.xz 004162495.td-b3lyp_6-31g+(d).inp 004162495.td-b3lyp_6-31g+(d).log.xz

004162495.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162495.td-b3lyp_6-31+g(d).gjf (generated)

004162495.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162495.mol 004162495.PUBCHEM 004162495.mol (via Jmol)
004162515.b3lyp_6-31g(d).inp

004162515.b3lyp_6-31g(d).qchem.inp (generated)

004162515.b3lyp_6-31g(d).gjf (generated)

004162515.b3lyp_6-31g(d).firefly.inp (generated)

004162515.b3lyp_6-31g(d).smash.inp (generated)

004162515.b3lyp_6-31g(d).nwchem.inp (generated) 004162515.b3lyp_6-31g(d).log.xz 004162515.td-b3lyp_6-31g+(d).inp 004162515.td-b3lyp_6-31g+(d).log.xz

004162515.td-b3lyp_6-31+g(d).qchem.inp (generated)

004162515.td-b3lyp_6-31+g(d).gjf (generated)

004162515.td-b3lyp_6-31+g(d).firefly.inp (generated)

004162515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004162515.mol 004162515.PUBCHEM 004162515.mol (via Jmol)
004162534.b3lyp_6-31g(d).inp

004162534.b3lyp_6-31g(d).qchem.inp (generated)

004162534.b3lyp_6-31g(d).gjf (generated)

004162534.b3lyp_6-31g(d).firefly.inp (generated)

004162534.b3lyp_6-31g(d).smash.inp (generated)

004162534.b3lyp_6-31g(d).nwchem.inp (generated) 004162534.b3lyp_6-31g(d).log.xz 004162534.td-b3lyp_6-31g+(d).inp 004162534.td-b3lyp_6-31g+(d).log.xz