Index of

Last updated : Thu Jun 29 02:21:09 JST 2017
Total : 774 (644) in this page
004400033.b3lyp_6-31g(d).inp

004400033.b3lyp_6-31g(d).qchem.inp (generated)

004400033.b3lyp_6-31g(d).gjf (generated)

004400033.b3lyp_6-31g(d).firefly.inp (generated)

004400033.b3lyp_6-31g(d).smash.inp (generated)

004400033.b3lyp_6-31g(d).nwchem.inp (generated) 004400033.b3lyp_6-31g(d).log.xz 004400033.td-b3lyp_6-31g+(d).inp 004400033.td-b3lyp_6-31g+(d).log.xz

004400033.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400033.td-b3lyp_6-31+g(d).gjf (generated)

004400033.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400033.mol 004400033.PUBCHEM 004400033.mol (via Jmol)
004400034.b3lyp_6-31g(d).inp

004400034.b3lyp_6-31g(d).qchem.inp (generated)

004400034.b3lyp_6-31g(d).gjf (generated)

004400034.b3lyp_6-31g(d).firefly.inp (generated)

004400034.b3lyp_6-31g(d).smash.inp (generated)

004400034.b3lyp_6-31g(d).nwchem.inp (generated) 004400034.b3lyp_6-31g(d).log.xz 004400034.td-b3lyp_6-31g+(d).inp 004400034.td-b3lyp_6-31g+(d).log.xz

004400034.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400034.td-b3lyp_6-31+g(d).gjf (generated)

004400034.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400034.mol 004400034.PUBCHEM 004400034.mol (via Jmol)
004400035.b3lyp_6-31g(d).inp

004400035.b3lyp_6-31g(d).qchem.inp (generated)

004400035.b3lyp_6-31g(d).gjf (generated)

004400035.b3lyp_6-31g(d).firefly.inp (generated)

004400035.b3lyp_6-31g(d).smash.inp (generated)

004400035.b3lyp_6-31g(d).nwchem.inp (generated) 004400035.b3lyp_6-31g(d).log.xz 004400035.td-b3lyp_6-31g+(d).inp 004400035.td-b3lyp_6-31g+(d).log.xz

004400035.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400035.td-b3lyp_6-31+g(d).gjf (generated)

004400035.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400035.mol 004400035.PUBCHEM 004400035.mol (via Jmol)
004400037.b3lyp_6-31g(d).inp

004400037.b3lyp_6-31g(d).qchem.inp (generated)

004400037.b3lyp_6-31g(d).gjf (generated)

004400037.b3lyp_6-31g(d).firefly.inp (generated)

004400037.b3lyp_6-31g(d).smash.inp (generated)

004400037.b3lyp_6-31g(d).nwchem.inp (generated) 004400037.b3lyp_6-31g(d).log.xz 004400037.td-b3lyp_6-31g+(d).inp 004400037.td-b3lyp_6-31g+(d).log.xz

004400037.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400037.td-b3lyp_6-31+g(d).gjf (generated)

004400037.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400037.mol 004400037.PUBCHEM 004400037.mol (via Jmol)
004400039.b3lyp_6-31g(d).inp

004400039.b3lyp_6-31g(d).qchem.inp (generated)

004400039.b3lyp_6-31g(d).gjf (generated)

004400039.b3lyp_6-31g(d).firefly.inp (generated)

004400039.b3lyp_6-31g(d).smash.inp (generated)

004400039.b3lyp_6-31g(d).nwchem.inp (generated) 004400039.b3lyp_6-31g(d).log.xz 004400039.td-b3lyp_6-31g+(d).inp 004400039.td-b3lyp_6-31g+(d).log.xz

004400039.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400039.td-b3lyp_6-31+g(d).gjf (generated)

004400039.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400039.mol 004400039.PUBCHEM 004400039.mol (via Jmol)
004400087.b3lyp_6-31g(d).inp

004400087.b3lyp_6-31g(d).qchem.inp (generated)

004400087.b3lyp_6-31g(d).gjf (generated)

004400087.b3lyp_6-31g(d).firefly.inp (generated)

004400087.b3lyp_6-31g(d).smash.inp (generated)

004400087.b3lyp_6-31g(d).nwchem.inp (generated) 004400087.b3lyp_6-31g(d).log.xz 004400087.td-b3lyp_6-31g+(d).inp 004400087.td-b3lyp_6-31g+(d).log.xz

004400087.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400087.td-b3lyp_6-31+g(d).gjf (generated)

004400087.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400087.mol 004400087.PUBCHEM 004400087.mol (via Jmol)
004400090.b3lyp_6-31g(d).inp

004400090.b3lyp_6-31g(d).qchem.inp (generated)

004400090.b3lyp_6-31g(d).gjf (generated)

004400090.b3lyp_6-31g(d).firefly.inp (generated)

004400090.b3lyp_6-31g(d).smash.inp (generated)

004400090.b3lyp_6-31g(d).nwchem.inp (generated) 004400090.b3lyp_6-31g(d).log.xz 004400090.td-b3lyp_6-31g+(d).inp 004400090.td-b3lyp_6-31g+(d).log.xz

004400090.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400090.td-b3lyp_6-31+g(d).gjf (generated)

004400090.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400090.mol 004400090.PUBCHEM 004400090.mol (via Jmol)
004400092.b3lyp_6-31g(d).inp

004400092.b3lyp_6-31g(d).qchem.inp (generated)

004400092.b3lyp_6-31g(d).gjf (generated)

004400092.b3lyp_6-31g(d).firefly.inp (generated)

004400092.b3lyp_6-31g(d).smash.inp (generated)

004400092.b3lyp_6-31g(d).nwchem.inp (generated) 004400092.b3lyp_6-31g(d).log.xz 004400092.td-b3lyp_6-31g+(d).inp 004400092.td-b3lyp_6-31g+(d).log.xz

004400092.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400092.td-b3lyp_6-31+g(d).gjf (generated)

004400092.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400092.mol 004400092.PUBCHEM 004400092.mol (via Jmol)
004400103.b3lyp_6-31g(d).inp

004400103.b3lyp_6-31g(d).qchem.inp (generated)

004400103.b3lyp_6-31g(d).gjf (generated)

004400103.b3lyp_6-31g(d).firefly.inp (generated)

004400103.b3lyp_6-31g(d).smash.inp (generated)

004400103.b3lyp_6-31g(d).nwchem.inp (generated) 004400103.b3lyp_6-31g(d).log.xz 004400103.td-b3lyp_6-31g+(d).inp 004400103.td-b3lyp_6-31g+(d).log.xz

004400103.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400103.td-b3lyp_6-31+g(d).gjf (generated)

004400103.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400103.mol 004400103.PUBCHEM 004400103.mol (via Jmol)
004400105.b3lyp_6-31g(d).inp

004400105.b3lyp_6-31g(d).qchem.inp (generated)

004400105.b3lyp_6-31g(d).gjf (generated)

004400105.b3lyp_6-31g(d).firefly.inp (generated)

004400105.b3lyp_6-31g(d).smash.inp (generated)

004400105.b3lyp_6-31g(d).nwchem.inp (generated) 004400105.b3lyp_6-31g(d).log.xz 004400105.td-b3lyp_6-31g+(d).inp 004400105.td-b3lyp_6-31g+(d).log.xz

004400105.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400105.td-b3lyp_6-31+g(d).gjf (generated)

004400105.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400105.mol 004400105.PUBCHEM 004400105.mol (via Jmol)
004400106.b3lyp_6-31g(d).inp

004400106.b3lyp_6-31g(d).qchem.inp (generated)

004400106.b3lyp_6-31g(d).gjf (generated)

004400106.b3lyp_6-31g(d).firefly.inp (generated)

004400106.b3lyp_6-31g(d).smash.inp (generated)

004400106.b3lyp_6-31g(d).nwchem.inp (generated) 004400106.b3lyp_6-31g(d).log.xz 004400106.td-b3lyp_6-31g+(d).inp 004400106.td-b3lyp_6-31g+(d).log.xz

004400106.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400106.td-b3lyp_6-31+g(d).gjf (generated)

004400106.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400106.mol 004400106.PUBCHEM 004400106.mol (via Jmol)
004400204.b3lyp_6-31g(d).inp

004400204.b3lyp_6-31g(d).qchem.inp (generated)

004400204.b3lyp_6-31g(d).gjf (generated)

004400204.b3lyp_6-31g(d).firefly.inp (generated)

004400204.b3lyp_6-31g(d).smash.inp (generated)

004400204.b3lyp_6-31g(d).nwchem.inp (generated) 004400204.b3lyp_6-31g(d).log.xz 004400204.td-b3lyp_6-31g+(d).inp 004400204.td-b3lyp_6-31g+(d).log.xz

004400204.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400204.td-b3lyp_6-31+g(d).gjf (generated)

004400204.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400204.mol 004400204.PUBCHEM 004400204.mol (via Jmol)
004400205.b3lyp_6-31g(d).inp

004400205.b3lyp_6-31g(d).qchem.inp (generated)

004400205.b3lyp_6-31g(d).gjf (generated)

004400205.b3lyp_6-31g(d).firefly.inp (generated)

004400205.b3lyp_6-31g(d).smash.inp (generated)

004400205.b3lyp_6-31g(d).nwchem.inp (generated) 004400205.b3lyp_6-31g(d).log.xz 004400205.td-b3lyp_6-31g+(d).inp 004400205.td-b3lyp_6-31g+(d).log.xz

004400205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400205.td-b3lyp_6-31+g(d).gjf (generated)

004400205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400205.mol 004400205.PUBCHEM 004400205.mol (via Jmol)
004400212.b3lyp_6-31g(d).inp

004400212.b3lyp_6-31g(d).qchem.inp (generated)

004400212.b3lyp_6-31g(d).gjf (generated)

004400212.b3lyp_6-31g(d).firefly.inp (generated)

004400212.b3lyp_6-31g(d).smash.inp (generated)

004400212.b3lyp_6-31g(d).nwchem.inp (generated) 004400212.b3lyp_6-31g(d).log.xz 004400212.td-b3lyp_6-31g+(d).inp 004400212.td-b3lyp_6-31g+(d).log.xz

004400212.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400212.td-b3lyp_6-31+g(d).gjf (generated)

004400212.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400212.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400212.mol 004400212.PUBCHEM 004400212.mol (via Jmol)
004400230.b3lyp_6-31g(d).inp

004400230.b3lyp_6-31g(d).qchem.inp (generated)

004400230.b3lyp_6-31g(d).gjf (generated)

004400230.b3lyp_6-31g(d).firefly.inp (generated)

004400230.b3lyp_6-31g(d).smash.inp (generated)

004400230.b3lyp_6-31g(d).nwchem.inp (generated) 004400230.b3lyp_6-31g(d).log.xz 004400230.td-b3lyp_6-31g+(d).inp 004400230.td-b3lyp_6-31g+(d).log.xz

004400230.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400230.td-b3lyp_6-31+g(d).gjf (generated)

004400230.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400230.mol 004400230.PUBCHEM 004400230.mol (via Jmol)
004400322.b3lyp_6-31g(d).inp

004400322.b3lyp_6-31g(d).qchem.inp (generated)

004400322.b3lyp_6-31g(d).gjf (generated)

004400322.b3lyp_6-31g(d).firefly.inp (generated)

004400322.b3lyp_6-31g(d).smash.inp (generated)

004400322.b3lyp_6-31g(d).nwchem.inp (generated) 004400322.b3lyp_6-31g(d).log.xz 004400322.mol 004400322.PUBCHEM 004400322.mol (via Jmol)
004400324.b3lyp_6-31g(d).inp

004400324.b3lyp_6-31g(d).qchem.inp (generated)

004400324.b3lyp_6-31g(d).gjf (generated)

004400324.b3lyp_6-31g(d).firefly.inp (generated)

004400324.b3lyp_6-31g(d).smash.inp (generated)

004400324.b3lyp_6-31g(d).nwchem.inp (generated) 004400324.b3lyp_6-31g(d).log.xz 004400324.td-b3lyp_6-31g+(d).inp 004400324.td-b3lyp_6-31g+(d).log.xz

004400324.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400324.td-b3lyp_6-31+g(d).gjf (generated)

004400324.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400324.mol 004400324.PUBCHEM 004400324.mol (via Jmol)
004400495.b3lyp_6-31g(d).inp

004400495.b3lyp_6-31g(d).qchem.inp (generated)

004400495.b3lyp_6-31g(d).gjf (generated)

004400495.b3lyp_6-31g(d).firefly.inp (generated)

004400495.b3lyp_6-31g(d).smash.inp (generated)

004400495.b3lyp_6-31g(d).nwchem.inp (generated) 004400495.b3lyp_6-31g(d).log.xz 004400495.td-b3lyp_6-31g+(d).inp 004400495.td-b3lyp_6-31g+(d).log.xz

004400495.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400495.td-b3lyp_6-31+g(d).gjf (generated)

004400495.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400495.mol 004400495.PUBCHEM 004400495.mol (via Jmol)
004400496.b3lyp_6-31g(d).inp

004400496.b3lyp_6-31g(d).qchem.inp (generated)

004400496.b3lyp_6-31g(d).gjf (generated)

004400496.b3lyp_6-31g(d).firefly.inp (generated)

004400496.b3lyp_6-31g(d).smash.inp (generated)

004400496.b3lyp_6-31g(d).nwchem.inp (generated) 004400496.b3lyp_6-31g(d).log.xz 004400496.mol 004400496.PUBCHEM 004400496.mol (via Jmol)
004400579.b3lyp_6-31g(d).inp

004400579.b3lyp_6-31g(d).qchem.inp (generated)

004400579.b3lyp_6-31g(d).gjf (generated)

004400579.b3lyp_6-31g(d).firefly.inp (generated)

004400579.b3lyp_6-31g(d).smash.inp (generated)

004400579.b3lyp_6-31g(d).nwchem.inp (generated) 004400579.b3lyp_6-31g(d).log.xz 004400579.td-b3lyp_6-31g+(d).inp 004400579.td-b3lyp_6-31g+(d).log.xz

004400579.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400579.td-b3lyp_6-31+g(d).gjf (generated)

004400579.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400579.mol 004400579.PUBCHEM 004400579.mol (via Jmol)
004400623.b3lyp_6-31g(d).inp

004400623.b3lyp_6-31g(d).qchem.inp (generated)

004400623.b3lyp_6-31g(d).gjf (generated)

004400623.b3lyp_6-31g(d).firefly.inp (generated)

004400623.b3lyp_6-31g(d).smash.inp (generated)

004400623.b3lyp_6-31g(d).nwchem.inp (generated) 004400623.b3lyp_6-31g(d).log.xz 004400623.td-b3lyp_6-31g+(d).inp 004400623.td-b3lyp_6-31g+(d).log.xz

004400623.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400623.td-b3lyp_6-31+g(d).gjf (generated)

004400623.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400623.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400623.mol 004400623.PUBCHEM 004400623.mol (via Jmol)
004400625.b3lyp_6-31g(d).inp

004400625.b3lyp_6-31g(d).qchem.inp (generated)

004400625.b3lyp_6-31g(d).gjf (generated)

004400625.b3lyp_6-31g(d).firefly.inp (generated)

004400625.b3lyp_6-31g(d).smash.inp (generated)

004400625.b3lyp_6-31g(d).nwchem.inp (generated) 004400625.b3lyp_6-31g(d).log.xz 004400625.mol 004400625.PUBCHEM 004400625.mol (via Jmol)
004400631.b3lyp_6-31g(d).inp

004400631.b3lyp_6-31g(d).qchem.inp (generated)

004400631.b3lyp_6-31g(d).gjf (generated)

004400631.b3lyp_6-31g(d).firefly.inp (generated)

004400631.b3lyp_6-31g(d).smash.inp (generated)

004400631.b3lyp_6-31g(d).nwchem.inp (generated) 004400631.b3lyp_6-31g(d).log.xz 004400631.td-b3lyp_6-31g+(d).inp 004400631.td-b3lyp_6-31g+(d).log.xz

004400631.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400631.td-b3lyp_6-31+g(d).gjf (generated)

004400631.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400631.mol 004400631.PUBCHEM 004400631.mol (via Jmol)
004400661.b3lyp_6-31g(d).inp

004400661.b3lyp_6-31g(d).qchem.inp (generated)

004400661.b3lyp_6-31g(d).gjf (generated)

004400661.b3lyp_6-31g(d).firefly.inp (generated)

004400661.b3lyp_6-31g(d).smash.inp (generated)

004400661.b3lyp_6-31g(d).nwchem.inp (generated) 004400661.b3lyp_6-31g(d).log.xz 004400661.td-b3lyp_6-31g+(d).inp 004400661.td-b3lyp_6-31g+(d).log.xz

004400661.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400661.td-b3lyp_6-31+g(d).gjf (generated)

004400661.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400661.mol 004400661.PUBCHEM 004400661.mol (via Jmol)
004400665.b3lyp_6-31g(d).inp

004400665.b3lyp_6-31g(d).qchem.inp (generated)

004400665.b3lyp_6-31g(d).gjf (generated)

004400665.b3lyp_6-31g(d).firefly.inp (generated)

004400665.b3lyp_6-31g(d).smash.inp (generated)

004400665.b3lyp_6-31g(d).nwchem.inp (generated) 004400665.b3lyp_6-31g(d).log.xz 004400665.td-b3lyp_6-31g+(d).inp 004400665.td-b3lyp_6-31g+(d).log.xz

004400665.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400665.td-b3lyp_6-31+g(d).gjf (generated)

004400665.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400665.mol 004400665.PUBCHEM 004400665.mol (via Jmol)
004400679.b3lyp_6-31g(d).inp

004400679.b3lyp_6-31g(d).qchem.inp (generated)

004400679.b3lyp_6-31g(d).gjf (generated)

004400679.b3lyp_6-31g(d).firefly.inp (generated)

004400679.b3lyp_6-31g(d).smash.inp (generated)

004400679.b3lyp_6-31g(d).nwchem.inp (generated) 004400679.b3lyp_6-31g(d).log.xz 004400679.td-b3lyp_6-31g+(d).inp 004400679.td-b3lyp_6-31g+(d).log.xz

004400679.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400679.td-b3lyp_6-31+g(d).gjf (generated)

004400679.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400679.mol 004400679.PUBCHEM 004400679.mol (via Jmol)
004400704.b3lyp_6-31g(d).inp

004400704.b3lyp_6-31g(d).qchem.inp (generated)

004400704.b3lyp_6-31g(d).gjf (generated)

004400704.b3lyp_6-31g(d).firefly.inp (generated)

004400704.b3lyp_6-31g(d).smash.inp (generated)

004400704.b3lyp_6-31g(d).nwchem.inp (generated) 004400704.b3lyp_6-31g(d).log.xz 004400704.td-b3lyp_6-31g+(d).inp 004400704.td-b3lyp_6-31g+(d).log.xz

004400704.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400704.td-b3lyp_6-31+g(d).gjf (generated)

004400704.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400704.mol 004400704.PUBCHEM 004400704.mol (via Jmol)
004400752.b3lyp_6-31g(d).inp

004400752.b3lyp_6-31g(d).qchem.inp (generated)

004400752.b3lyp_6-31g(d).gjf (generated)

004400752.b3lyp_6-31g(d).firefly.inp (generated)

004400752.b3lyp_6-31g(d).smash.inp (generated)

004400752.b3lyp_6-31g(d).nwchem.inp (generated) 004400752.b3lyp_6-31g(d).log.xz 004400752.mol 004400752.PUBCHEM 004400752.mol (via Jmol)
004400782.b3lyp_6-31g(d).inp

004400782.b3lyp_6-31g(d).qchem.inp (generated)

004400782.b3lyp_6-31g(d).gjf (generated)

004400782.b3lyp_6-31g(d).firefly.inp (generated)

004400782.b3lyp_6-31g(d).smash.inp (generated)

004400782.b3lyp_6-31g(d).nwchem.inp (generated) 004400782.b3lyp_6-31g(d).log.xz 004400782.td-b3lyp_6-31g+(d).inp 004400782.td-b3lyp_6-31g+(d).log.xz

004400782.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400782.td-b3lyp_6-31+g(d).gjf (generated)

004400782.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400782.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400782.mol 004400782.PUBCHEM 004400782.mol (via Jmol)
004400819.b3lyp_6-31g(d).inp

004400819.b3lyp_6-31g(d).qchem.inp (generated)

004400819.b3lyp_6-31g(d).gjf (generated)

004400819.b3lyp_6-31g(d).firefly.inp (generated)

004400819.b3lyp_6-31g(d).smash.inp (generated)

004400819.b3lyp_6-31g(d).nwchem.inp (generated) 004400819.b3lyp_6-31g(d).log.xz 004400819.td-b3lyp_6-31g+(d).inp 004400819.td-b3lyp_6-31g+(d).log.xz

004400819.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400819.td-b3lyp_6-31+g(d).gjf (generated)

004400819.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400819.mol 004400819.PUBCHEM 004400819.mol (via Jmol)
004400966.b3lyp_6-31g(d).inp

004400966.b3lyp_6-31g(d).qchem.inp (generated)

004400966.b3lyp_6-31g(d).gjf (generated)

004400966.b3lyp_6-31g(d).firefly.inp (generated)

004400966.b3lyp_6-31g(d).smash.inp (generated)

004400966.b3lyp_6-31g(d).nwchem.inp (generated) 004400966.b3lyp_6-31g(d).log.xz 004400966.td-b3lyp_6-31g+(d).inp 004400966.td-b3lyp_6-31g+(d).log.xz

004400966.td-b3lyp_6-31+g(d).qchem.inp (generated)

004400966.td-b3lyp_6-31+g(d).gjf (generated)

004400966.td-b3lyp_6-31+g(d).firefly.inp (generated)

004400966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004400966.mol 004400966.PUBCHEM 004400966.mol (via Jmol)
004401012.b3lyp_6-31g(d).inp

004401012.b3lyp_6-31g(d).qchem.inp (generated)

004401012.b3lyp_6-31g(d).gjf (generated)

004401012.b3lyp_6-31g(d).firefly.inp (generated)

004401012.b3lyp_6-31g(d).smash.inp (generated)

004401012.b3lyp_6-31g(d).nwchem.inp (generated) 004401012.b3lyp_6-31g(d).log.xz 004401012.mol 004401012.PUBCHEM 004401012.mol (via Jmol)
004401104.b3lyp_6-31g(d).inp

004401104.b3lyp_6-31g(d).qchem.inp (generated)

004401104.b3lyp_6-31g(d).gjf (generated)

004401104.b3lyp_6-31g(d).firefly.inp (generated)

004401104.b3lyp_6-31g(d).smash.inp (generated)

004401104.b3lyp_6-31g(d).nwchem.inp (generated) 004401104.b3lyp_6-31g(d).log.xz 004401104.td-b3lyp_6-31g+(d).inp 004401104.td-b3lyp_6-31g+(d).log.xz

004401104.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401104.td-b3lyp_6-31+g(d).gjf (generated)

004401104.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401104.mol 004401104.PUBCHEM 004401104.mol (via Jmol)
004401118.b3lyp_6-31g(d).inp

004401118.b3lyp_6-31g(d).qchem.inp (generated)

004401118.b3lyp_6-31g(d).gjf (generated)

004401118.b3lyp_6-31g(d).firefly.inp (generated)

004401118.b3lyp_6-31g(d).smash.inp (generated)

004401118.b3lyp_6-31g(d).nwchem.inp (generated) 004401118.b3lyp_6-31g(d).log.xz 004401118.td-b3lyp_6-31g+(d).inp 004401118.td-b3lyp_6-31g+(d).log.xz

004401118.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401118.td-b3lyp_6-31+g(d).gjf (generated)

004401118.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401118.mol 004401118.PUBCHEM 004401118.mol (via Jmol)
004401288.b3lyp_6-31g(d).inp

004401288.b3lyp_6-31g(d).qchem.inp (generated)

004401288.b3lyp_6-31g(d).gjf (generated)

004401288.b3lyp_6-31g(d).firefly.inp (generated)

004401288.b3lyp_6-31g(d).smash.inp (generated)

004401288.b3lyp_6-31g(d).nwchem.inp (generated) 004401288.b3lyp_6-31g(d).log.xz 004401288.td-b3lyp_6-31g+(d).inp 004401288.td-b3lyp_6-31g+(d).log.xz

004401288.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401288.td-b3lyp_6-31+g(d).gjf (generated)

004401288.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401288.mol 004401288.PUBCHEM 004401288.mol (via Jmol)
004401315.b3lyp_6-31g(d).inp

004401315.b3lyp_6-31g(d).qchem.inp (generated)

004401315.b3lyp_6-31g(d).gjf (generated)

004401315.b3lyp_6-31g(d).firefly.inp (generated)

004401315.b3lyp_6-31g(d).smash.inp (generated)

004401315.b3lyp_6-31g(d).nwchem.inp (generated) 004401315.b3lyp_6-31g(d).log.xz 004401315.td-b3lyp_6-31g+(d).inp 004401315.td-b3lyp_6-31g+(d).log.xz

004401315.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401315.td-b3lyp_6-31+g(d).gjf (generated)

004401315.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401315.mol 004401315.PUBCHEM 004401315.mol (via Jmol)
004401316.b3lyp_6-31g(d).inp

004401316.b3lyp_6-31g(d).qchem.inp (generated)

004401316.b3lyp_6-31g(d).gjf (generated)

004401316.b3lyp_6-31g(d).firefly.inp (generated)

004401316.b3lyp_6-31g(d).smash.inp (generated)

004401316.b3lyp_6-31g(d).nwchem.inp (generated) 004401316.b3lyp_6-31g(d).log.xz 004401316.td-b3lyp_6-31g+(d).inp 004401316.td-b3lyp_6-31g+(d).log.xz

004401316.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401316.td-b3lyp_6-31+g(d).gjf (generated)

004401316.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401316.mol 004401316.PUBCHEM 004401316.mol (via Jmol)
004401398.b3lyp_6-31g(d).inp

004401398.b3lyp_6-31g(d).qchem.inp (generated)

004401398.b3lyp_6-31g(d).gjf (generated)

004401398.b3lyp_6-31g(d).firefly.inp (generated)

004401398.b3lyp_6-31g(d).smash.inp (generated)

004401398.b3lyp_6-31g(d).nwchem.inp (generated) 004401398.b3lyp_6-31g(d).log.xz 004401398.td-b3lyp_6-31g+(d).inp 004401398.td-b3lyp_6-31g+(d).log.xz

004401398.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401398.td-b3lyp_6-31+g(d).gjf (generated)

004401398.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401398.mol 004401398.PUBCHEM 004401398.mol (via Jmol)
004401430.b3lyp_6-31g(d).inp

004401430.b3lyp_6-31g(d).qchem.inp (generated)

004401430.b3lyp_6-31g(d).gjf (generated)

004401430.b3lyp_6-31g(d).firefly.inp (generated)

004401430.b3lyp_6-31g(d).smash.inp (generated)

004401430.b3lyp_6-31g(d).nwchem.inp (generated) 004401430.b3lyp_6-31g(d).log.xz 004401430.td-b3lyp_6-31g+(d).inp 004401430.td-b3lyp_6-31g+(d).log.xz

004401430.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401430.td-b3lyp_6-31+g(d).gjf (generated)

004401430.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401430.mol 004401430.PUBCHEM 004401430.mol (via Jmol)
004401462.b3lyp_6-31g(d).inp

004401462.b3lyp_6-31g(d).qchem.inp (generated)

004401462.b3lyp_6-31g(d).gjf (generated)

004401462.b3lyp_6-31g(d).firefly.inp (generated)

004401462.b3lyp_6-31g(d).smash.inp (generated)

004401462.b3lyp_6-31g(d).nwchem.inp (generated) 004401462.b3lyp_6-31g(d).log.xz 004401462.td-b3lyp_6-31g+(d).inp 004401462.td-b3lyp_6-31g+(d).log.xz

004401462.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401462.td-b3lyp_6-31+g(d).gjf (generated)

004401462.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401462.mol 004401462.PUBCHEM 004401462.mol (via Jmol)
004401472.b3lyp_6-31g(d).inp

004401472.b3lyp_6-31g(d).qchem.inp (generated)

004401472.b3lyp_6-31g(d).gjf (generated)

004401472.b3lyp_6-31g(d).firefly.inp (generated)

004401472.b3lyp_6-31g(d).smash.inp (generated)

004401472.b3lyp_6-31g(d).nwchem.inp (generated) 004401472.b3lyp_6-31g(d).log.xz 004401472.mol 004401472.PUBCHEM 004401472.mol (via Jmol)
004401474.b3lyp_6-31g(d).inp

004401474.b3lyp_6-31g(d).qchem.inp (generated)

004401474.b3lyp_6-31g(d).gjf (generated)

004401474.b3lyp_6-31g(d).firefly.inp (generated)

004401474.b3lyp_6-31g(d).smash.inp (generated)

004401474.b3lyp_6-31g(d).nwchem.inp (generated) 004401474.b3lyp_6-31g(d).log.xz 004401474.td-b3lyp_6-31g+(d).inp 004401474.td-b3lyp_6-31g+(d).log.xz

004401474.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401474.td-b3lyp_6-31+g(d).gjf (generated)

004401474.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401474.mol 004401474.PUBCHEM 004401474.mol (via Jmol)
004401494.b3lyp_6-31g(d).inp

004401494.b3lyp_6-31g(d).qchem.inp (generated)

004401494.b3lyp_6-31g(d).gjf (generated)

004401494.b3lyp_6-31g(d).firefly.inp (generated)

004401494.b3lyp_6-31g(d).smash.inp (generated)

004401494.b3lyp_6-31g(d).nwchem.inp (generated) 004401494.b3lyp_6-31g(d).log.xz 004401494.td-b3lyp_6-31g+(d).inp 004401494.td-b3lyp_6-31g+(d).log.xz

004401494.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401494.td-b3lyp_6-31+g(d).gjf (generated)

004401494.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401494.mol 004401494.PUBCHEM 004401494.mol (via Jmol)
004401495.b3lyp_6-31g(d).inp

004401495.b3lyp_6-31g(d).qchem.inp (generated)

004401495.b3lyp_6-31g(d).gjf (generated)

004401495.b3lyp_6-31g(d).firefly.inp (generated)

004401495.b3lyp_6-31g(d).smash.inp (generated)

004401495.b3lyp_6-31g(d).nwchem.inp (generated) 004401495.b3lyp_6-31g(d).log.xz 004401495.td-b3lyp_6-31g+(d).inp 004401495.td-b3lyp_6-31g+(d).log.xz

004401495.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401495.td-b3lyp_6-31+g(d).gjf (generated)

004401495.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401495.mol 004401495.PUBCHEM 004401495.mol (via Jmol)
004401526.b3lyp_6-31g(d).inp

004401526.b3lyp_6-31g(d).qchem.inp (generated)

004401526.b3lyp_6-31g(d).gjf (generated)

004401526.b3lyp_6-31g(d).firefly.inp (generated)

004401526.b3lyp_6-31g(d).smash.inp (generated)

004401526.b3lyp_6-31g(d).nwchem.inp (generated) 004401526.b3lyp_6-31g(d).log.xz 004401526.mol 004401526.PUBCHEM 004401526.mol (via Jmol)
004401570.b3lyp_6-31g(d).inp

004401570.b3lyp_6-31g(d).qchem.inp (generated)

004401570.b3lyp_6-31g(d).gjf (generated)

004401570.b3lyp_6-31g(d).firefly.inp (generated)

004401570.b3lyp_6-31g(d).smash.inp (generated)

004401570.b3lyp_6-31g(d).nwchem.inp (generated) 004401570.b3lyp_6-31g(d).log.xz 004401570.td-b3lyp_6-31g+(d).inp 004401570.td-b3lyp_6-31g+(d).log.xz

004401570.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401570.td-b3lyp_6-31+g(d).gjf (generated)

004401570.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401570.mol 004401570.PUBCHEM 004401570.mol (via Jmol)
004401583.b3lyp_6-31g(d).inp

004401583.b3lyp_6-31g(d).qchem.inp (generated)

004401583.b3lyp_6-31g(d).gjf (generated)

004401583.b3lyp_6-31g(d).firefly.inp (generated)

004401583.b3lyp_6-31g(d).smash.inp (generated)

004401583.b3lyp_6-31g(d).nwchem.inp (generated) 004401583.b3lyp_6-31g(d).log.xz 004401583.td-b3lyp_6-31g+(d).inp 004401583.td-b3lyp_6-31g+(d).log.xz

004401583.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401583.td-b3lyp_6-31+g(d).gjf (generated)

004401583.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401583.mol 004401583.PUBCHEM 004401583.mol (via Jmol)
004401609.b3lyp_6-31g(d).inp

004401609.b3lyp_6-31g(d).qchem.inp (generated)

004401609.b3lyp_6-31g(d).gjf (generated)

004401609.b3lyp_6-31g(d).firefly.inp (generated)

004401609.b3lyp_6-31g(d).smash.inp (generated)

004401609.b3lyp_6-31g(d).nwchem.inp (generated) 004401609.b3lyp_6-31g(d).log.xz 004401609.td-b3lyp_6-31g+(d).inp 004401609.td-b3lyp_6-31g+(d).log.xz

004401609.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401609.td-b3lyp_6-31+g(d).gjf (generated)

004401609.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401609.mol 004401609.PUBCHEM 004401609.mol (via Jmol)
004401614.b3lyp_6-31g(d).inp

004401614.b3lyp_6-31g(d).qchem.inp (generated)

004401614.b3lyp_6-31g(d).gjf (generated)

004401614.b3lyp_6-31g(d).firefly.inp (generated)

004401614.b3lyp_6-31g(d).smash.inp (generated)

004401614.b3lyp_6-31g(d).nwchem.inp (generated) 004401614.b3lyp_6-31g(d).log.xz 004401614.td-b3lyp_6-31g+(d).inp 004401614.td-b3lyp_6-31g+(d).log.xz

004401614.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401614.td-b3lyp_6-31+g(d).gjf (generated)

004401614.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401614.mol 004401614.PUBCHEM 004401614.mol (via Jmol)
004401616.b3lyp_6-31g(d).inp

004401616.b3lyp_6-31g(d).qchem.inp (generated)

004401616.b3lyp_6-31g(d).gjf (generated)

004401616.b3lyp_6-31g(d).firefly.inp (generated)

004401616.b3lyp_6-31g(d).smash.inp (generated)

004401616.b3lyp_6-31g(d).nwchem.inp (generated) 004401616.b3lyp_6-31g(d).log.xz 004401616.td-b3lyp_6-31g+(d).inp 004401616.td-b3lyp_6-31g+(d).log.xz

004401616.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401616.td-b3lyp_6-31+g(d).gjf (generated)

004401616.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401616.mol 004401616.PUBCHEM 004401616.mol (via Jmol)
004401629.b3lyp_6-31g(d).inp

004401629.b3lyp_6-31g(d).qchem.inp (generated)

004401629.b3lyp_6-31g(d).gjf (generated)

004401629.b3lyp_6-31g(d).firefly.inp (generated)

004401629.b3lyp_6-31g(d).smash.inp (generated)

004401629.b3lyp_6-31g(d).nwchem.inp (generated) 004401629.b3lyp_6-31g(d).log.xz 004401629.td-b3lyp_6-31g+(d).inp 004401629.td-b3lyp_6-31g+(d).log.xz

004401629.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401629.td-b3lyp_6-31+g(d).gjf (generated)

004401629.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401629.mol 004401629.PUBCHEM 004401629.mol (via Jmol)
004401630.b3lyp_6-31g(d).inp

004401630.b3lyp_6-31g(d).qchem.inp (generated)

004401630.b3lyp_6-31g(d).gjf (generated)

004401630.b3lyp_6-31g(d).firefly.inp (generated)

004401630.b3lyp_6-31g(d).smash.inp (generated)

004401630.b3lyp_6-31g(d).nwchem.inp (generated) 004401630.b3lyp_6-31g(d).log.xz 004401630.td-b3lyp_6-31g+(d).inp 004401630.td-b3lyp_6-31g+(d).log.xz

004401630.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401630.td-b3lyp_6-31+g(d).gjf (generated)

004401630.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401630.mol 004401630.PUBCHEM 004401630.mol (via Jmol)
004401657.b3lyp_6-31g(d).inp

004401657.b3lyp_6-31g(d).qchem.inp (generated)

004401657.b3lyp_6-31g(d).gjf (generated)

004401657.b3lyp_6-31g(d).firefly.inp (generated)

004401657.b3lyp_6-31g(d).smash.inp (generated)

004401657.b3lyp_6-31g(d).nwchem.inp (generated) 004401657.b3lyp_6-31g(d).log.xz 004401657.td-b3lyp_6-31g+(d).inp 004401657.td-b3lyp_6-31g+(d).log.xz

004401657.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401657.td-b3lyp_6-31+g(d).gjf (generated)

004401657.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401657.mol 004401657.PUBCHEM 004401657.mol (via Jmol)
004401698.b3lyp_6-31g(d).inp

004401698.b3lyp_6-31g(d).qchem.inp (generated)

004401698.b3lyp_6-31g(d).gjf (generated)

004401698.b3lyp_6-31g(d).firefly.inp (generated)

004401698.b3lyp_6-31g(d).smash.inp (generated)

004401698.b3lyp_6-31g(d).nwchem.inp (generated) 004401698.b3lyp_6-31g(d).log.xz 004401698.td-b3lyp_6-31g+(d).inp 004401698.td-b3lyp_6-31g+(d).log.xz

004401698.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401698.td-b3lyp_6-31+g(d).gjf (generated)

004401698.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401698.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401698.mol 004401698.PUBCHEM 004401698.mol (via Jmol)
004401708.b3lyp_6-31g(d).inp

004401708.b3lyp_6-31g(d).qchem.inp (generated)

004401708.b3lyp_6-31g(d).gjf (generated)

004401708.b3lyp_6-31g(d).firefly.inp (generated)

004401708.b3lyp_6-31g(d).smash.inp (generated)

004401708.b3lyp_6-31g(d).nwchem.inp (generated) 004401708.b3lyp_6-31g(d).log.xz 004401708.mol 004401708.PUBCHEM 004401708.mol (via Jmol)
004401754.b3lyp_6-31g(d).inp

004401754.b3lyp_6-31g(d).qchem.inp (generated)

004401754.b3lyp_6-31g(d).gjf (generated)

004401754.b3lyp_6-31g(d).firefly.inp (generated)

004401754.b3lyp_6-31g(d).smash.inp (generated)

004401754.b3lyp_6-31g(d).nwchem.inp (generated) 004401754.b3lyp_6-31g(d).log.xz 004401754.td-b3lyp_6-31g+(d).inp 004401754.td-b3lyp_6-31g+(d).log.xz

004401754.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401754.td-b3lyp_6-31+g(d).gjf (generated)

004401754.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401754.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401754.mol 004401754.PUBCHEM 004401754.mol (via Jmol)
004401768.b3lyp_6-31g(d).inp

004401768.b3lyp_6-31g(d).qchem.inp (generated)

004401768.b3lyp_6-31g(d).gjf (generated)

004401768.b3lyp_6-31g(d).firefly.inp (generated)

004401768.b3lyp_6-31g(d).smash.inp (generated)

004401768.b3lyp_6-31g(d).nwchem.inp (generated) 004401768.b3lyp_6-31g(d).log.xz 004401768.td-b3lyp_6-31g+(d).inp 004401768.td-b3lyp_6-31g+(d).log.xz

004401768.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401768.td-b3lyp_6-31+g(d).gjf (generated)

004401768.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401768.mol 004401768.PUBCHEM 004401768.mol (via Jmol)
004401783.b3lyp_6-31g(d).inp

004401783.b3lyp_6-31g(d).qchem.inp (generated)

004401783.b3lyp_6-31g(d).gjf (generated)

004401783.b3lyp_6-31g(d).firefly.inp (generated)

004401783.b3lyp_6-31g(d).smash.inp (generated)

004401783.b3lyp_6-31g(d).nwchem.inp (generated) 004401783.b3lyp_6-31g(d).log.xz 004401783.mol 004401783.PUBCHEM 004401783.mol (via Jmol)
004401784.b3lyp_6-31g(d).inp

004401784.b3lyp_6-31g(d).qchem.inp (generated)

004401784.b3lyp_6-31g(d).gjf (generated)

004401784.b3lyp_6-31g(d).firefly.inp (generated)

004401784.b3lyp_6-31g(d).smash.inp (generated)

004401784.b3lyp_6-31g(d).nwchem.inp (generated) 004401784.b3lyp_6-31g(d).log.xz 004401784.td-b3lyp_6-31g+(d).inp 004401784.td-b3lyp_6-31g+(d).log.xz

004401784.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401784.td-b3lyp_6-31+g(d).gjf (generated)

004401784.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401784.mol 004401784.PUBCHEM 004401784.mol (via Jmol)
004401790.b3lyp_6-31g(d).inp

004401790.b3lyp_6-31g(d).qchem.inp (generated)

004401790.b3lyp_6-31g(d).gjf (generated)

004401790.b3lyp_6-31g(d).firefly.inp (generated)

004401790.b3lyp_6-31g(d).smash.inp (generated)

004401790.b3lyp_6-31g(d).nwchem.inp (generated) 004401790.b3lyp_6-31g(d).log.xz 004401790.td-b3lyp_6-31g+(d).inp 004401790.td-b3lyp_6-31g+(d).log.xz

004401790.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401790.td-b3lyp_6-31+g(d).gjf (generated)

004401790.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401790.mol 004401790.PUBCHEM 004401790.mol (via Jmol)
004401811.b3lyp_6-31g(d).inp

004401811.b3lyp_6-31g(d).qchem.inp (generated)

004401811.b3lyp_6-31g(d).gjf (generated)

004401811.b3lyp_6-31g(d).firefly.inp (generated)

004401811.b3lyp_6-31g(d).smash.inp (generated)

004401811.b3lyp_6-31g(d).nwchem.inp (generated) 004401811.b3lyp_6-31g(d).log.xz 004401811.td-b3lyp_6-31g+(d).inp 004401811.td-b3lyp_6-31g+(d).log.xz

004401811.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401811.td-b3lyp_6-31+g(d).gjf (generated)

004401811.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401811.mol 004401811.PUBCHEM 004401811.mol (via Jmol)
004401812.b3lyp_6-31g(d).inp

004401812.b3lyp_6-31g(d).qchem.inp (generated)

004401812.b3lyp_6-31g(d).gjf (generated)

004401812.b3lyp_6-31g(d).firefly.inp (generated)

004401812.b3lyp_6-31g(d).smash.inp (generated)

004401812.b3lyp_6-31g(d).nwchem.inp (generated) 004401812.b3lyp_6-31g(d).log.xz 004401812.td-b3lyp_6-31g+(d).inp 004401812.td-b3lyp_6-31g+(d).log.xz

004401812.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401812.td-b3lyp_6-31+g(d).gjf (generated)

004401812.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401812.mol 004401812.PUBCHEM 004401812.mol (via Jmol)
004401814.b3lyp_6-31g(d).inp

004401814.b3lyp_6-31g(d).qchem.inp (generated)

004401814.b3lyp_6-31g(d).gjf (generated)

004401814.b3lyp_6-31g(d).firefly.inp (generated)

004401814.b3lyp_6-31g(d).smash.inp (generated)

004401814.b3lyp_6-31g(d).nwchem.inp (generated) 004401814.b3lyp_6-31g(d).log.xz 004401814.td-b3lyp_6-31g+(d).inp 004401814.td-b3lyp_6-31g+(d).log.xz

004401814.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401814.td-b3lyp_6-31+g(d).gjf (generated)

004401814.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401814.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401814.mol 004401814.PUBCHEM 004401814.mol (via Jmol)
004401816.b3lyp_6-31g(d).inp

004401816.b3lyp_6-31g(d).qchem.inp (generated)

004401816.b3lyp_6-31g(d).gjf (generated)

004401816.b3lyp_6-31g(d).firefly.inp (generated)

004401816.b3lyp_6-31g(d).smash.inp (generated)

004401816.b3lyp_6-31g(d).nwchem.inp (generated) 004401816.b3lyp_6-31g(d).log.xz 004401816.td-b3lyp_6-31g+(d).inp 004401816.td-b3lyp_6-31g+(d).log.xz

004401816.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401816.td-b3lyp_6-31+g(d).gjf (generated)

004401816.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401816.mol 004401816.PUBCHEM 004401816.mol (via Jmol)
004401817.b3lyp_6-31g(d).inp

004401817.b3lyp_6-31g(d).qchem.inp (generated)

004401817.b3lyp_6-31g(d).gjf (generated)

004401817.b3lyp_6-31g(d).firefly.inp (generated)

004401817.b3lyp_6-31g(d).smash.inp (generated)

004401817.b3lyp_6-31g(d).nwchem.inp (generated) 004401817.b3lyp_6-31g(d).log.xz 004401817.td-b3lyp_6-31g+(d).inp 004401817.td-b3lyp_6-31g+(d).log.xz

004401817.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401817.td-b3lyp_6-31+g(d).gjf (generated)

004401817.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401817.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401817.mol 004401817.PUBCHEM 004401817.mol (via Jmol)
004401850.b3lyp_6-31g(d).inp

004401850.b3lyp_6-31g(d).qchem.inp (generated)

004401850.b3lyp_6-31g(d).gjf (generated)

004401850.b3lyp_6-31g(d).firefly.inp (generated)

004401850.b3lyp_6-31g(d).smash.inp (generated)

004401850.b3lyp_6-31g(d).nwchem.inp (generated) 004401850.b3lyp_6-31g(d).log.xz 004401850.td-b3lyp_6-31g+(d).inp 004401850.td-b3lyp_6-31g+(d).log.xz

004401850.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401850.td-b3lyp_6-31+g(d).gjf (generated)

004401850.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401850.mol 004401850.PUBCHEM 004401850.mol (via Jmol)
004401869.b3lyp_6-31g(d).inp

004401869.b3lyp_6-31g(d).qchem.inp (generated)

004401869.b3lyp_6-31g(d).gjf (generated)

004401869.b3lyp_6-31g(d).firefly.inp (generated)

004401869.b3lyp_6-31g(d).smash.inp (generated)

004401869.b3lyp_6-31g(d).nwchem.inp (generated) 004401869.b3lyp_6-31g(d).log.xz 004401869.td-b3lyp_6-31g+(d).inp 004401869.td-b3lyp_6-31g+(d).log.xz

004401869.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401869.td-b3lyp_6-31+g(d).gjf (generated)

004401869.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401869.mol 004401869.PUBCHEM 004401869.mol (via Jmol)
004401879.b3lyp_6-31g(d).inp

004401879.b3lyp_6-31g(d).qchem.inp (generated)

004401879.b3lyp_6-31g(d).gjf (generated)

004401879.b3lyp_6-31g(d).firefly.inp (generated)

004401879.b3lyp_6-31g(d).smash.inp (generated)

004401879.b3lyp_6-31g(d).nwchem.inp (generated) 004401879.b3lyp_6-31g(d).log.xz 004401879.td-b3lyp_6-31g+(d).inp 004401879.td-b3lyp_6-31g+(d).log.xz

004401879.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401879.td-b3lyp_6-31+g(d).gjf (generated)

004401879.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401879.mol 004401879.PUBCHEM 004401879.mol (via Jmol)
004401880.b3lyp_6-31g(d).inp

004401880.b3lyp_6-31g(d).qchem.inp (generated)

004401880.b3lyp_6-31g(d).gjf (generated)

004401880.b3lyp_6-31g(d).firefly.inp (generated)

004401880.b3lyp_6-31g(d).smash.inp (generated)

004401880.b3lyp_6-31g(d).nwchem.inp (generated) 004401880.b3lyp_6-31g(d).log.xz 004401880.td-b3lyp_6-31g+(d).inp 004401880.td-b3lyp_6-31g+(d).log.xz

004401880.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401880.td-b3lyp_6-31+g(d).gjf (generated)

004401880.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401880.mol 004401880.PUBCHEM 004401880.mol (via Jmol)
004401885.b3lyp_6-31g(d).inp

004401885.b3lyp_6-31g(d).qchem.inp (generated)

004401885.b3lyp_6-31g(d).gjf (generated)

004401885.b3lyp_6-31g(d).firefly.inp (generated)

004401885.b3lyp_6-31g(d).smash.inp (generated)

004401885.b3lyp_6-31g(d).nwchem.inp (generated) 004401885.b3lyp_6-31g(d).log.xz 004401885.td-b3lyp_6-31g+(d).inp 004401885.td-b3lyp_6-31g+(d).log.xz

004401885.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401885.td-b3lyp_6-31+g(d).gjf (generated)

004401885.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401885.mol 004401885.PUBCHEM 004401885.mol (via Jmol)
004401906.b3lyp_6-31g(d).inp

004401906.b3lyp_6-31g(d).qchem.inp (generated)

004401906.b3lyp_6-31g(d).gjf (generated)

004401906.b3lyp_6-31g(d).firefly.inp (generated)

004401906.b3lyp_6-31g(d).smash.inp (generated)

004401906.b3lyp_6-31g(d).nwchem.inp (generated) 004401906.b3lyp_6-31g(d).log.xz 004401906.td-b3lyp_6-31g+(d).inp 004401906.td-b3lyp_6-31g+(d).log.xz

004401906.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401906.td-b3lyp_6-31+g(d).gjf (generated)

004401906.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401906.mol 004401906.PUBCHEM 004401906.mol (via Jmol)
004401928.b3lyp_6-31g(d).inp

004401928.b3lyp_6-31g(d).qchem.inp (generated)

004401928.b3lyp_6-31g(d).gjf (generated)

004401928.b3lyp_6-31g(d).firefly.inp (generated)

004401928.b3lyp_6-31g(d).smash.inp (generated)

004401928.b3lyp_6-31g(d).nwchem.inp (generated) 004401928.b3lyp_6-31g(d).log.xz 004401928.td-b3lyp_6-31g+(d).inp 004401928.td-b3lyp_6-31g+(d).log.xz

004401928.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401928.td-b3lyp_6-31+g(d).gjf (generated)

004401928.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401928.mol 004401928.PUBCHEM 004401928.mol (via Jmol)
004401951.b3lyp_6-31g(d).inp

004401951.b3lyp_6-31g(d).qchem.inp (generated)

004401951.b3lyp_6-31g(d).gjf (generated)

004401951.b3lyp_6-31g(d).firefly.inp (generated)

004401951.b3lyp_6-31g(d).smash.inp (generated)

004401951.b3lyp_6-31g(d).nwchem.inp (generated) 004401951.b3lyp_6-31g(d).log.xz 004401951.td-b3lyp_6-31g+(d).inp 004401951.td-b3lyp_6-31g+(d).log.xz

004401951.td-b3lyp_6-31+g(d).qchem.inp (generated)

004401951.td-b3lyp_6-31+g(d).gjf (generated)

004401951.td-b3lyp_6-31+g(d).firefly.inp (generated)

004401951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004401951.mol 004401951.PUBCHEM 004401951.mol (via Jmol)
004402096.b3lyp_6-31g(d).inp

004402096.b3lyp_6-31g(d).qchem.inp (generated)

004402096.b3lyp_6-31g(d).gjf (generated)

004402096.b3lyp_6-31g(d).firefly.inp (generated)

004402096.b3lyp_6-31g(d).smash.inp (generated)

004402096.b3lyp_6-31g(d).nwchem.inp (generated) 004402096.b3lyp_6-31g(d).log.xz 004402096.td-b3lyp_6-31g+(d).inp 004402096.td-b3lyp_6-31g+(d).log.xz

004402096.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402096.td-b3lyp_6-31+g(d).gjf (generated)

004402096.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402096.mol 004402096.PUBCHEM 004402096.mol (via Jmol)
004402118.b3lyp_6-31g(d).inp

004402118.b3lyp_6-31g(d).qchem.inp (generated)

004402118.b3lyp_6-31g(d).gjf (generated)

004402118.b3lyp_6-31g(d).firefly.inp (generated)

004402118.b3lyp_6-31g(d).smash.inp (generated)

004402118.b3lyp_6-31g(d).nwchem.inp (generated) 004402118.b3lyp_6-31g(d).log.xz 004402118.td-b3lyp_6-31g+(d).inp 004402118.td-b3lyp_6-31g+(d).log.xz

004402118.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402118.td-b3lyp_6-31+g(d).gjf (generated)

004402118.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402118.mol 004402118.PUBCHEM 004402118.mol (via Jmol)
004402226.b3lyp_6-31g(d).inp

004402226.b3lyp_6-31g(d).qchem.inp (generated)

004402226.b3lyp_6-31g(d).gjf (generated)

004402226.b3lyp_6-31g(d).firefly.inp (generated)

004402226.b3lyp_6-31g(d).smash.inp (generated)

004402226.b3lyp_6-31g(d).nwchem.inp (generated) 004402226.b3lyp_6-31g(d).log.xz 004402226.td-b3lyp_6-31g+(d).inp 004402226.td-b3lyp_6-31g+(d).log.xz

004402226.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402226.td-b3lyp_6-31+g(d).gjf (generated)

004402226.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402226.mol 004402226.PUBCHEM 004402226.mol (via Jmol)
004402369.b3lyp_6-31g(d).inp

004402369.b3lyp_6-31g(d).qchem.inp (generated)

004402369.b3lyp_6-31g(d).gjf (generated)

004402369.b3lyp_6-31g(d).firefly.inp (generated)

004402369.b3lyp_6-31g(d).smash.inp (generated)

004402369.b3lyp_6-31g(d).nwchem.inp (generated) 004402369.b3lyp_6-31g(d).log.xz 004402369.td-b3lyp_6-31g+(d).inp 004402369.td-b3lyp_6-31g+(d).log.xz

004402369.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402369.td-b3lyp_6-31+g(d).gjf (generated)

004402369.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402369.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402369.mol 004402369.PUBCHEM 004402369.mol (via Jmol)
004402382.b3lyp_6-31g(d).inp

004402382.b3lyp_6-31g(d).qchem.inp (generated)

004402382.b3lyp_6-31g(d).gjf (generated)

004402382.b3lyp_6-31g(d).firefly.inp (generated)

004402382.b3lyp_6-31g(d).smash.inp (generated)

004402382.b3lyp_6-31g(d).nwchem.inp (generated) 004402382.b3lyp_6-31g(d).log.xz 004402382.mol 004402382.PUBCHEM 004402382.mol (via Jmol)
004402385.b3lyp_6-31g(d).inp

004402385.b3lyp_6-31g(d).qchem.inp (generated)

004402385.b3lyp_6-31g(d).gjf (generated)

004402385.b3lyp_6-31g(d).firefly.inp (generated)

004402385.b3lyp_6-31g(d).smash.inp (generated)

004402385.b3lyp_6-31g(d).nwchem.inp (generated) 004402385.b3lyp_6-31g(d).log.xz 004402385.mol 004402385.PUBCHEM 004402385.mol (via Jmol)
004402417.b3lyp_6-31g(d).inp

004402417.b3lyp_6-31g(d).qchem.inp (generated)

004402417.b3lyp_6-31g(d).gjf (generated)

004402417.b3lyp_6-31g(d).firefly.inp (generated)

004402417.b3lyp_6-31g(d).smash.inp (generated)

004402417.b3lyp_6-31g(d).nwchem.inp (generated) 004402417.b3lyp_6-31g(d).log.xz 004402417.td-b3lyp_6-31g+(d).inp 004402417.td-b3lyp_6-31g+(d).log.xz

004402417.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402417.td-b3lyp_6-31+g(d).gjf (generated)

004402417.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402417.mol 004402417.PUBCHEM 004402417.mol (via Jmol)
004402443.b3lyp_6-31g(d).inp

004402443.b3lyp_6-31g(d).qchem.inp (generated)

004402443.b3lyp_6-31g(d).gjf (generated)

004402443.b3lyp_6-31g(d).firefly.inp (generated)

004402443.b3lyp_6-31g(d).smash.inp (generated)

004402443.b3lyp_6-31g(d).nwchem.inp (generated) 004402443.b3lyp_6-31g(d).log.xz 004402443.td-b3lyp_6-31g+(d).inp 004402443.td-b3lyp_6-31g+(d).log.xz

004402443.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402443.td-b3lyp_6-31+g(d).gjf (generated)

004402443.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402443.mol 004402443.PUBCHEM 004402443.mol (via Jmol)
004402444.b3lyp_6-31g(d).inp

004402444.b3lyp_6-31g(d).qchem.inp (generated)

004402444.b3lyp_6-31g(d).gjf (generated)

004402444.b3lyp_6-31g(d).firefly.inp (generated)

004402444.b3lyp_6-31g(d).smash.inp (generated)

004402444.b3lyp_6-31g(d).nwchem.inp (generated) 004402444.b3lyp_6-31g(d).log.xz 004402444.td-b3lyp_6-31g+(d).inp 004402444.td-b3lyp_6-31g+(d).log.xz

004402444.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402444.td-b3lyp_6-31+g(d).gjf (generated)

004402444.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402444.mol 004402444.PUBCHEM 004402444.mol (via Jmol)
004402618.b3lyp_6-31g(d).inp

004402618.b3lyp_6-31g(d).qchem.inp (generated)

004402618.b3lyp_6-31g(d).gjf (generated)

004402618.b3lyp_6-31g(d).firefly.inp (generated)

004402618.b3lyp_6-31g(d).smash.inp (generated)

004402618.b3lyp_6-31g(d).nwchem.inp (generated) 004402618.b3lyp_6-31g(d).log.xz 004402618.td-b3lyp_6-31g+(d).inp 004402618.td-b3lyp_6-31g+(d).log.xz

004402618.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402618.td-b3lyp_6-31+g(d).gjf (generated)

004402618.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402618.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402618.mol 004402618.PUBCHEM 004402618.mol (via Jmol)
004402627.b3lyp_6-31g(d).inp

004402627.b3lyp_6-31g(d).qchem.inp (generated)

004402627.b3lyp_6-31g(d).gjf (generated)

004402627.b3lyp_6-31g(d).firefly.inp (generated)

004402627.b3lyp_6-31g(d).smash.inp (generated)

004402627.b3lyp_6-31g(d).nwchem.inp (generated) 004402627.b3lyp_6-31g(d).log.xz 004402627.td-b3lyp_6-31g+(d).inp 004402627.td-b3lyp_6-31g+(d).log.xz

004402627.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402627.td-b3lyp_6-31+g(d).gjf (generated)

004402627.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402627.mol 004402627.PUBCHEM 004402627.mol (via Jmol)
004402631.b3lyp_6-31g(d).inp

004402631.b3lyp_6-31g(d).qchem.inp (generated)

004402631.b3lyp_6-31g(d).gjf (generated)

004402631.b3lyp_6-31g(d).firefly.inp (generated)

004402631.b3lyp_6-31g(d).smash.inp (generated)

004402631.b3lyp_6-31g(d).nwchem.inp (generated) 004402631.b3lyp_6-31g(d).log.xz 004402631.td-b3lyp_6-31g+(d).inp 004402631.td-b3lyp_6-31g+(d).log.xz

004402631.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402631.td-b3lyp_6-31+g(d).gjf (generated)

004402631.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402631.mol 004402631.PUBCHEM 004402631.mol (via Jmol)
004402651.b3lyp_6-31g(d).inp

004402651.b3lyp_6-31g(d).qchem.inp (generated)

004402651.b3lyp_6-31g(d).gjf (generated)

004402651.b3lyp_6-31g(d).firefly.inp (generated)

004402651.b3lyp_6-31g(d).smash.inp (generated)

004402651.b3lyp_6-31g(d).nwchem.inp (generated) 004402651.b3lyp_6-31g(d).log.xz 004402651.td-b3lyp_6-31g+(d).inp 004402651.td-b3lyp_6-31g+(d).log.xz

004402651.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402651.td-b3lyp_6-31+g(d).gjf (generated)

004402651.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402651.mol 004402651.PUBCHEM 004402651.mol (via Jmol)
004402710.b3lyp_6-31g(d).inp

004402710.b3lyp_6-31g(d).qchem.inp (generated)

004402710.b3lyp_6-31g(d).gjf (generated)

004402710.b3lyp_6-31g(d).firefly.inp (generated)

004402710.b3lyp_6-31g(d).smash.inp (generated)

004402710.b3lyp_6-31g(d).nwchem.inp (generated) 004402710.b3lyp_6-31g(d).log.xz 004402710.td-b3lyp_6-31g+(d).inp 004402710.td-b3lyp_6-31g+(d).log.xz

004402710.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402710.td-b3lyp_6-31+g(d).gjf (generated)

004402710.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402710.mol 004402710.PUBCHEM 004402710.mol (via Jmol)
004402711.b3lyp_6-31g(d).inp

004402711.b3lyp_6-31g(d).qchem.inp (generated)

004402711.b3lyp_6-31g(d).gjf (generated)

004402711.b3lyp_6-31g(d).firefly.inp (generated)

004402711.b3lyp_6-31g(d).smash.inp (generated)

004402711.b3lyp_6-31g(d).nwchem.inp (generated) 004402711.b3lyp_6-31g(d).log.xz 004402711.td-b3lyp_6-31g+(d).inp 004402711.td-b3lyp_6-31g+(d).log.xz

004402711.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402711.td-b3lyp_6-31+g(d).gjf (generated)

004402711.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402711.mol 004402711.PUBCHEM 004402711.mol (via Jmol)
004402742.b3lyp_6-31g(d).inp

004402742.b3lyp_6-31g(d).qchem.inp (generated)

004402742.b3lyp_6-31g(d).gjf (generated)

004402742.b3lyp_6-31g(d).firefly.inp (generated)

004402742.b3lyp_6-31g(d).smash.inp (generated)

004402742.b3lyp_6-31g(d).nwchem.inp (generated) 004402742.b3lyp_6-31g(d).log.xz 004402742.td-b3lyp_6-31g+(d).inp 004402742.td-b3lyp_6-31g+(d).log.xz

004402742.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402742.td-b3lyp_6-31+g(d).gjf (generated)

004402742.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402742.mol 004402742.PUBCHEM 004402742.mol (via Jmol)
004402745.b3lyp_6-31g(d).inp

004402745.b3lyp_6-31g(d).qchem.inp (generated)

004402745.b3lyp_6-31g(d).gjf (generated)

004402745.b3lyp_6-31g(d).firefly.inp (generated)

004402745.b3lyp_6-31g(d).smash.inp (generated)

004402745.b3lyp_6-31g(d).nwchem.inp (generated) 004402745.b3lyp_6-31g(d).log.xz 004402745.td-b3lyp_6-31g+(d).inp 004402745.td-b3lyp_6-31g+(d).log.xz

004402745.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402745.td-b3lyp_6-31+g(d).gjf (generated)

004402745.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402745.mol 004402745.PUBCHEM 004402745.mol (via Jmol)
004402783.b3lyp_6-31g(d).inp

004402783.b3lyp_6-31g(d).qchem.inp (generated)

004402783.b3lyp_6-31g(d).gjf (generated)

004402783.b3lyp_6-31g(d).firefly.inp (generated)

004402783.b3lyp_6-31g(d).smash.inp (generated)

004402783.b3lyp_6-31g(d).nwchem.inp (generated) 004402783.b3lyp_6-31g(d).log.xz 004402783.mol 004402783.PUBCHEM 004402783.mol (via Jmol)
004402799.b3lyp_6-31g(d).inp

004402799.b3lyp_6-31g(d).qchem.inp (generated)

004402799.b3lyp_6-31g(d).gjf (generated)

004402799.b3lyp_6-31g(d).firefly.inp (generated)

004402799.b3lyp_6-31g(d).smash.inp (generated)

004402799.b3lyp_6-31g(d).nwchem.inp (generated) 004402799.b3lyp_6-31g(d).log.xz 004402799.td-b3lyp_6-31g+(d).inp 004402799.td-b3lyp_6-31g+(d).log.xz

004402799.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402799.td-b3lyp_6-31+g(d).gjf (generated)

004402799.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402799.mol 004402799.PUBCHEM 004402799.mol (via Jmol)
004402818.b3lyp_6-31g(d).inp

004402818.b3lyp_6-31g(d).qchem.inp (generated)

004402818.b3lyp_6-31g(d).gjf (generated)

004402818.b3lyp_6-31g(d).firefly.inp (generated)

004402818.b3lyp_6-31g(d).smash.inp (generated)

004402818.b3lyp_6-31g(d).nwchem.inp (generated) 004402818.b3lyp_6-31g(d).log.xz 004402818.td-b3lyp_6-31g+(d).inp 004402818.td-b3lyp_6-31g+(d).log.xz

004402818.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402818.td-b3lyp_6-31+g(d).gjf (generated)

004402818.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402818.mol 004402818.PUBCHEM 004402818.mol (via Jmol)
004402840.b3lyp_6-31g(d).inp

004402840.b3lyp_6-31g(d).qchem.inp (generated)

004402840.b3lyp_6-31g(d).gjf (generated)

004402840.b3lyp_6-31g(d).firefly.inp (generated)

004402840.b3lyp_6-31g(d).smash.inp (generated)

004402840.b3lyp_6-31g(d).nwchem.inp (generated) 004402840.b3lyp_6-31g(d).log.xz 004402840.td-b3lyp_6-31g+(d).inp 004402840.td-b3lyp_6-31g+(d).log.xz

004402840.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402840.td-b3lyp_6-31+g(d).gjf (generated)

004402840.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402840.mol 004402840.PUBCHEM 004402840.mol (via Jmol)
004402843.b3lyp_6-31g(d).inp

004402843.b3lyp_6-31g(d).qchem.inp (generated)

004402843.b3lyp_6-31g(d).gjf (generated)

004402843.b3lyp_6-31g(d).firefly.inp (generated)

004402843.b3lyp_6-31g(d).smash.inp (generated)

004402843.b3lyp_6-31g(d).nwchem.inp (generated) 004402843.b3lyp_6-31g(d).log.xz 004402843.td-b3lyp_6-31g+(d).inp 004402843.td-b3lyp_6-31g+(d).log.xz

004402843.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402843.td-b3lyp_6-31+g(d).gjf (generated)

004402843.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402843.mol 004402843.PUBCHEM 004402843.mol (via Jmol)
004402868.b3lyp_6-31g(d).inp

004402868.b3lyp_6-31g(d).qchem.inp (generated)

004402868.b3lyp_6-31g(d).gjf (generated)

004402868.b3lyp_6-31g(d).firefly.inp (generated)

004402868.b3lyp_6-31g(d).smash.inp (generated)

004402868.b3lyp_6-31g(d).nwchem.inp (generated) 004402868.b3lyp_6-31g(d).log.xz 004402868.td-b3lyp_6-31g+(d).inp 004402868.td-b3lyp_6-31g+(d).log.xz

004402868.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402868.td-b3lyp_6-31+g(d).gjf (generated)

004402868.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402868.mol 004402868.PUBCHEM 004402868.mol (via Jmol)
004402884.b3lyp_6-31g(d).inp

004402884.b3lyp_6-31g(d).qchem.inp (generated)

004402884.b3lyp_6-31g(d).gjf (generated)

004402884.b3lyp_6-31g(d).firefly.inp (generated)

004402884.b3lyp_6-31g(d).smash.inp (generated)

004402884.b3lyp_6-31g(d).nwchem.inp (generated) 004402884.b3lyp_6-31g(d).log.xz 004402884.td-b3lyp_6-31g+(d).inp 004402884.td-b3lyp_6-31g+(d).log.xz

004402884.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402884.td-b3lyp_6-31+g(d).gjf (generated)

004402884.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402884.mol 004402884.PUBCHEM 004402884.mol (via Jmol)
004402956.b3lyp_6-31g(d).inp

004402956.b3lyp_6-31g(d).qchem.inp (generated)

004402956.b3lyp_6-31g(d).gjf (generated)

004402956.b3lyp_6-31g(d).firefly.inp (generated)

004402956.b3lyp_6-31g(d).smash.inp (generated)

004402956.b3lyp_6-31g(d).nwchem.inp (generated) 004402956.b3lyp_6-31g(d).log.xz 004402956.td-b3lyp_6-31g+(d).inp 004402956.td-b3lyp_6-31g+(d).log.xz

004402956.td-b3lyp_6-31+g(d).qchem.inp (generated)

004402956.td-b3lyp_6-31+g(d).gjf (generated)

004402956.td-b3lyp_6-31+g(d).firefly.inp (generated)

004402956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004402956.mol 004402956.PUBCHEM 004402956.mol (via Jmol)
004403023.b3lyp_6-31g(d).inp

004403023.b3lyp_6-31g(d).qchem.inp (generated)

004403023.b3lyp_6-31g(d).gjf (generated)

004403023.b3lyp_6-31g(d).firefly.inp (generated)

004403023.b3lyp_6-31g(d).smash.inp (generated)

004403023.b3lyp_6-31g(d).nwchem.inp (generated) 004403023.b3lyp_6-31g(d).log.xz 004403023.mol 004403023.PUBCHEM 004403023.mol (via Jmol)
004403048.b3lyp_6-31g(d).inp

004403048.b3lyp_6-31g(d).qchem.inp (generated)

004403048.b3lyp_6-31g(d).gjf (generated)

004403048.b3lyp_6-31g(d).firefly.inp (generated)

004403048.b3lyp_6-31g(d).smash.inp (generated)

004403048.b3lyp_6-31g(d).nwchem.inp (generated) 004403048.b3lyp_6-31g(d).log.xz 004403048.mol 004403048.PUBCHEM 004403048.mol (via Jmol)
004403088.b3lyp_6-31g(d).inp

004403088.b3lyp_6-31g(d).qchem.inp (generated)

004403088.b3lyp_6-31g(d).gjf (generated)

004403088.b3lyp_6-31g(d).firefly.inp (generated)

004403088.b3lyp_6-31g(d).smash.inp (generated)

004403088.b3lyp_6-31g(d).nwchem.inp (generated) 004403088.b3lyp_6-31g(d).log.xz 004403088.td-b3lyp_6-31g+(d).inp 004403088.td-b3lyp_6-31g+(d).log.xz

004403088.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403088.td-b3lyp_6-31+g(d).gjf (generated)

004403088.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403088.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403088.mol 004403088.PUBCHEM 004403088.mol (via Jmol)
004403272.b3lyp_6-31g(d).inp

004403272.b3lyp_6-31g(d).qchem.inp (generated)

004403272.b3lyp_6-31g(d).gjf (generated)

004403272.b3lyp_6-31g(d).firefly.inp (generated)

004403272.b3lyp_6-31g(d).smash.inp (generated)

004403272.b3lyp_6-31g(d).nwchem.inp (generated) 004403272.b3lyp_6-31g(d).log.xz 004403272.td-b3lyp_6-31g+(d).inp 004403272.td-b3lyp_6-31g+(d).log.xz

004403272.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403272.td-b3lyp_6-31+g(d).gjf (generated)

004403272.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403272.mol 004403272.PUBCHEM 004403272.mol (via Jmol)
004403407.b3lyp_6-31g(d).inp

004403407.b3lyp_6-31g(d).qchem.inp (generated)

004403407.b3lyp_6-31g(d).gjf (generated)

004403407.b3lyp_6-31g(d).firefly.inp (generated)

004403407.b3lyp_6-31g(d).smash.inp (generated)

004403407.b3lyp_6-31g(d).nwchem.inp (generated) 004403407.b3lyp_6-31g(d).log.xz 004403407.td-b3lyp_6-31g+(d).inp 004403407.td-b3lyp_6-31g+(d).log.xz

004403407.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403407.td-b3lyp_6-31+g(d).gjf (generated)

004403407.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403407.mol 004403407.PUBCHEM 004403407.mol (via Jmol)
004403546.b3lyp_6-31g(d).inp

004403546.b3lyp_6-31g(d).qchem.inp (generated)

004403546.b3lyp_6-31g(d).gjf (generated)

004403546.b3lyp_6-31g(d).firefly.inp (generated)

004403546.b3lyp_6-31g(d).smash.inp (generated)

004403546.b3lyp_6-31g(d).nwchem.inp (generated) 004403546.b3lyp_6-31g(d).log.xz 004403546.mol 004403546.PUBCHEM 004403546.mol (via Jmol)
004403714.b3lyp_6-31g(d).inp

004403714.b3lyp_6-31g(d).qchem.inp (generated)

004403714.b3lyp_6-31g(d).gjf (generated)

004403714.b3lyp_6-31g(d).firefly.inp (generated)

004403714.b3lyp_6-31g(d).smash.inp (generated)

004403714.b3lyp_6-31g(d).nwchem.inp (generated) 004403714.b3lyp_6-31g(d).log.xz 004403714.mol 004403714.PUBCHEM 004403714.mol (via Jmol)
004403724.b3lyp_6-31g(d).inp

004403724.b3lyp_6-31g(d).qchem.inp (generated)

004403724.b3lyp_6-31g(d).gjf (generated)

004403724.b3lyp_6-31g(d).firefly.inp (generated)

004403724.b3lyp_6-31g(d).smash.inp (generated)

004403724.b3lyp_6-31g(d).nwchem.inp (generated) 004403724.b3lyp_6-31g(d).log.xz 004403724.td-b3lyp_6-31g+(d).inp 004403724.td-b3lyp_6-31g+(d).log.xz

004403724.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403724.td-b3lyp_6-31+g(d).gjf (generated)

004403724.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403724.mol 004403724.PUBCHEM 004403724.mol (via Jmol)
004403735.b3lyp_6-31g(d).inp

004403735.b3lyp_6-31g(d).qchem.inp (generated)

004403735.b3lyp_6-31g(d).gjf (generated)

004403735.b3lyp_6-31g(d).firefly.inp (generated)

004403735.b3lyp_6-31g(d).smash.inp (generated)

004403735.b3lyp_6-31g(d).nwchem.inp (generated) 004403735.b3lyp_6-31g(d).log.xz 004403735.td-b3lyp_6-31g+(d).inp 004403735.td-b3lyp_6-31g+(d).log.xz

004403735.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403735.td-b3lyp_6-31+g(d).gjf (generated)

004403735.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403735.mol 004403735.PUBCHEM 004403735.mol (via Jmol)
004403814.b3lyp_6-31g(d).inp

004403814.b3lyp_6-31g(d).qchem.inp (generated)

004403814.b3lyp_6-31g(d).gjf (generated)

004403814.b3lyp_6-31g(d).firefly.inp (generated)

004403814.b3lyp_6-31g(d).smash.inp (generated)

004403814.b3lyp_6-31g(d).nwchem.inp (generated) 004403814.b3lyp_6-31g(d).log.xz 004403814.mol 004403814.PUBCHEM 004403814.mol (via Jmol)
004403861.b3lyp_6-31g(d).inp

004403861.b3lyp_6-31g(d).qchem.inp (generated)

004403861.b3lyp_6-31g(d).gjf (generated)

004403861.b3lyp_6-31g(d).firefly.inp (generated)

004403861.b3lyp_6-31g(d).smash.inp (generated)

004403861.b3lyp_6-31g(d).nwchem.inp (generated) 004403861.b3lyp_6-31g(d).log.xz 004403861.td-b3lyp_6-31g+(d).inp 004403861.td-b3lyp_6-31g+(d).log.xz

004403861.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403861.td-b3lyp_6-31+g(d).gjf (generated)

004403861.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403861.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403861.mol 004403861.PUBCHEM 004403861.mol (via Jmol)
004403871.b3lyp_6-31g(d).inp

004403871.b3lyp_6-31g(d).qchem.inp (generated)

004403871.b3lyp_6-31g(d).gjf (generated)

004403871.b3lyp_6-31g(d).firefly.inp (generated)

004403871.b3lyp_6-31g(d).smash.inp (generated)

004403871.b3lyp_6-31g(d).nwchem.inp (generated) 004403871.b3lyp_6-31g(d).log.xz 004403871.td-b3lyp_6-31g+(d).inp 004403871.td-b3lyp_6-31g+(d).log.xz

004403871.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403871.td-b3lyp_6-31+g(d).gjf (generated)

004403871.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403871.mol 004403871.PUBCHEM 004403871.mol (via Jmol)
004403896.b3lyp_6-31g(d).inp

004403896.b3lyp_6-31g(d).qchem.inp (generated)

004403896.b3lyp_6-31g(d).gjf (generated)

004403896.b3lyp_6-31g(d).firefly.inp (generated)

004403896.b3lyp_6-31g(d).smash.inp (generated)

004403896.b3lyp_6-31g(d).nwchem.inp (generated) 004403896.b3lyp_6-31g(d).log.xz 004403896.td-b3lyp_6-31g+(d).inp 004403896.td-b3lyp_6-31g+(d).log.xz

004403896.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403896.td-b3lyp_6-31+g(d).gjf (generated)

004403896.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403896.mol 004403896.PUBCHEM 004403896.mol (via Jmol)
004403900.b3lyp_6-31g(d).inp

004403900.b3lyp_6-31g(d).qchem.inp (generated)

004403900.b3lyp_6-31g(d).gjf (generated)

004403900.b3lyp_6-31g(d).firefly.inp (generated)

004403900.b3lyp_6-31g(d).smash.inp (generated)

004403900.b3lyp_6-31g(d).nwchem.inp (generated) 004403900.b3lyp_6-31g(d).log.xz 004403900.td-b3lyp_6-31g+(d).inp 004403900.td-b3lyp_6-31g+(d).log.xz

004403900.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403900.td-b3lyp_6-31+g(d).gjf (generated)

004403900.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403900.mol 004403900.PUBCHEM 004403900.mol (via Jmol)
004403905.b3lyp_6-31g(d).inp

004403905.b3lyp_6-31g(d).qchem.inp (generated)

004403905.b3lyp_6-31g(d).gjf (generated)

004403905.b3lyp_6-31g(d).firefly.inp (generated)

004403905.b3lyp_6-31g(d).smash.inp (generated)

004403905.b3lyp_6-31g(d).nwchem.inp (generated) 004403905.b3lyp_6-31g(d).log.xz 004403905.td-b3lyp_6-31g+(d).inp 004403905.td-b3lyp_6-31g+(d).log.xz

004403905.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403905.td-b3lyp_6-31+g(d).gjf (generated)

004403905.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403905.mol 004403905.PUBCHEM 004403905.mol (via Jmol)
004403915.b3lyp_6-31g(d).inp

004403915.b3lyp_6-31g(d).qchem.inp (generated)

004403915.b3lyp_6-31g(d).gjf (generated)

004403915.b3lyp_6-31g(d).firefly.inp (generated)

004403915.b3lyp_6-31g(d).smash.inp (generated)

004403915.b3lyp_6-31g(d).nwchem.inp (generated) 004403915.b3lyp_6-31g(d).log.xz 004403915.td-b3lyp_6-31g+(d).inp 004403915.td-b3lyp_6-31g+(d).log.xz

004403915.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403915.td-b3lyp_6-31+g(d).gjf (generated)

004403915.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403915.mol 004403915.PUBCHEM 004403915.mol (via Jmol)
004403919.b3lyp_6-31g(d).inp

004403919.b3lyp_6-31g(d).qchem.inp (generated)

004403919.b3lyp_6-31g(d).gjf (generated)

004403919.b3lyp_6-31g(d).firefly.inp (generated)

004403919.b3lyp_6-31g(d).smash.inp (generated)

004403919.b3lyp_6-31g(d).nwchem.inp (generated) 004403919.b3lyp_6-31g(d).log.xz 004403919.td-b3lyp_6-31g+(d).inp 004403919.td-b3lyp_6-31g+(d).log.xz

004403919.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403919.td-b3lyp_6-31+g(d).gjf (generated)

004403919.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403919.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403919.mol 004403919.PUBCHEM 004403919.mol (via Jmol)
004403931.b3lyp_6-31g(d).inp

004403931.b3lyp_6-31g(d).qchem.inp (generated)

004403931.b3lyp_6-31g(d).gjf (generated)

004403931.b3lyp_6-31g(d).firefly.inp (generated)

004403931.b3lyp_6-31g(d).smash.inp (generated)

004403931.b3lyp_6-31g(d).nwchem.inp (generated) 004403931.b3lyp_6-31g(d).log.xz 004403931.td-b3lyp_6-31g+(d).inp 004403931.td-b3lyp_6-31g+(d).log.xz

004403931.td-b3lyp_6-31+g(d).qchem.inp (generated)

004403931.td-b3lyp_6-31+g(d).gjf (generated)

004403931.td-b3lyp_6-31+g(d).firefly.inp (generated)

004403931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004403931.mol 004403931.PUBCHEM 004403931.mol (via Jmol)
004404066.b3lyp_6-31g(d).inp

004404066.b3lyp_6-31g(d).qchem.inp (generated)

004404066.b3lyp_6-31g(d).gjf (generated)

004404066.b3lyp_6-31g(d).firefly.inp (generated)

004404066.b3lyp_6-31g(d).smash.inp (generated)

004404066.b3lyp_6-31g(d).nwchem.inp (generated) 004404066.b3lyp_6-31g(d).log.xz 004404066.td-b3lyp_6-31g+(d).inp 004404066.td-b3lyp_6-31g+(d).log.xz

004404066.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404066.td-b3lyp_6-31+g(d).gjf (generated)

004404066.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404066.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404066.mol 004404066.PUBCHEM 004404066.mol (via Jmol)
004404134.b3lyp_6-31g(d).inp

004404134.b3lyp_6-31g(d).qchem.inp (generated)

004404134.b3lyp_6-31g(d).gjf (generated)

004404134.b3lyp_6-31g(d).firefly.inp (generated)

004404134.b3lyp_6-31g(d).smash.inp (generated)

004404134.b3lyp_6-31g(d).nwchem.inp (generated) 004404134.b3lyp_6-31g(d).log.xz 004404134.td-b3lyp_6-31g+(d).inp 004404134.td-b3lyp_6-31g+(d).log.xz

004404134.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404134.td-b3lyp_6-31+g(d).gjf (generated)

004404134.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404134.mol 004404134.PUBCHEM 004404134.mol (via Jmol)
004404135.b3lyp_6-31g(d).inp

004404135.b3lyp_6-31g(d).qchem.inp (generated)

004404135.b3lyp_6-31g(d).gjf (generated)

004404135.b3lyp_6-31g(d).firefly.inp (generated)

004404135.b3lyp_6-31g(d).smash.inp (generated)

004404135.b3lyp_6-31g(d).nwchem.inp (generated) 004404135.b3lyp_6-31g(d).log.xz 004404135.mol 004404135.PUBCHEM 004404135.mol (via Jmol)
004404138.b3lyp_6-31g(d).inp

004404138.b3lyp_6-31g(d).qchem.inp (generated)

004404138.b3lyp_6-31g(d).gjf (generated)

004404138.b3lyp_6-31g(d).firefly.inp (generated)

004404138.b3lyp_6-31g(d).smash.inp (generated)

004404138.b3lyp_6-31g(d).nwchem.inp (generated) 004404138.b3lyp_6-31g(d).log.xz 004404138.td-b3lyp_6-31g+(d).inp 004404138.td-b3lyp_6-31g+(d).log.xz

004404138.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404138.td-b3lyp_6-31+g(d).gjf (generated)

004404138.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404138.mol 004404138.PUBCHEM 004404138.mol (via Jmol)
004404139.b3lyp_6-31g(d).inp

004404139.b3lyp_6-31g(d).qchem.inp (generated)

004404139.b3lyp_6-31g(d).gjf (generated)

004404139.b3lyp_6-31g(d).firefly.inp (generated)

004404139.b3lyp_6-31g(d).smash.inp (generated)

004404139.b3lyp_6-31g(d).nwchem.inp (generated) 004404139.b3lyp_6-31g(d).log.xz 004404139.td-b3lyp_6-31g+(d).inp 004404139.td-b3lyp_6-31g+(d).log.xz

004404139.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404139.td-b3lyp_6-31+g(d).gjf (generated)

004404139.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404139.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404139.mol 004404139.PUBCHEM 004404139.mol (via Jmol)
004404165.b3lyp_6-31g(d).inp

004404165.b3lyp_6-31g(d).qchem.inp (generated)

004404165.b3lyp_6-31g(d).gjf (generated)

004404165.b3lyp_6-31g(d).firefly.inp (generated)

004404165.b3lyp_6-31g(d).smash.inp (generated)

004404165.b3lyp_6-31g(d).nwchem.inp (generated) 004404165.b3lyp_6-31g(d).log.xz 004404165.td-b3lyp_6-31g+(d).inp 004404165.td-b3lyp_6-31g+(d).log.xz

004404165.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404165.td-b3lyp_6-31+g(d).gjf (generated)

004404165.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404165.mol 004404165.PUBCHEM 004404165.mol (via Jmol)
004404192.b3lyp_6-31g(d).inp

004404192.b3lyp_6-31g(d).qchem.inp (generated)

004404192.b3lyp_6-31g(d).gjf (generated)

004404192.b3lyp_6-31g(d).firefly.inp (generated)

004404192.b3lyp_6-31g(d).smash.inp (generated)

004404192.b3lyp_6-31g(d).nwchem.inp (generated) 004404192.b3lyp_6-31g(d).log.xz 004404192.td-b3lyp_6-31g+(d).inp 004404192.td-b3lyp_6-31g+(d).log.xz

004404192.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404192.td-b3lyp_6-31+g(d).gjf (generated)

004404192.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404192.mol 004404192.PUBCHEM 004404192.mol (via Jmol)
004404255.b3lyp_6-31g(d).inp

004404255.b3lyp_6-31g(d).qchem.inp (generated)

004404255.b3lyp_6-31g(d).gjf (generated)

004404255.b3lyp_6-31g(d).firefly.inp (generated)

004404255.b3lyp_6-31g(d).smash.inp (generated)

004404255.b3lyp_6-31g(d).nwchem.inp (generated) 004404255.b3lyp_6-31g(d).log.xz 004404255.td-b3lyp_6-31g+(d).inp 004404255.td-b3lyp_6-31g+(d).log.xz

004404255.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404255.td-b3lyp_6-31+g(d).gjf (generated)

004404255.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404255.mol 004404255.PUBCHEM 004404255.mol (via Jmol)
004404260.b3lyp_6-31g(d).inp

004404260.b3lyp_6-31g(d).qchem.inp (generated)

004404260.b3lyp_6-31g(d).gjf (generated)

004404260.b3lyp_6-31g(d).firefly.inp (generated)

004404260.b3lyp_6-31g(d).smash.inp (generated)

004404260.b3lyp_6-31g(d).nwchem.inp (generated) 004404260.b3lyp_6-31g(d).log.xz 004404260.td-b3lyp_6-31g+(d).inp 004404260.td-b3lyp_6-31g+(d).log.xz

004404260.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404260.td-b3lyp_6-31+g(d).gjf (generated)

004404260.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404260.mol 004404260.PUBCHEM 004404260.mol (via Jmol)
004404280.b3lyp_6-31g(d).inp

004404280.b3lyp_6-31g(d).qchem.inp (generated)

004404280.b3lyp_6-31g(d).gjf (generated)

004404280.b3lyp_6-31g(d).firefly.inp (generated)

004404280.b3lyp_6-31g(d).smash.inp (generated)

004404280.b3lyp_6-31g(d).nwchem.inp (generated) 004404280.b3lyp_6-31g(d).log.xz 004404280.td-b3lyp_6-31g+(d).inp 004404280.td-b3lyp_6-31g+(d).log.xz

004404280.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404280.td-b3lyp_6-31+g(d).gjf (generated)

004404280.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404280.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404280.mol 004404280.PUBCHEM 004404280.mol (via Jmol)
004404322.b3lyp_6-31g(d).inp

004404322.b3lyp_6-31g(d).qchem.inp (generated)

004404322.b3lyp_6-31g(d).gjf (generated)

004404322.b3lyp_6-31g(d).firefly.inp (generated)

004404322.b3lyp_6-31g(d).smash.inp (generated)

004404322.b3lyp_6-31g(d).nwchem.inp (generated) 004404322.b3lyp_6-31g(d).log.xz 004404322.td-b3lyp_6-31g+(d).inp 004404322.td-b3lyp_6-31g+(d).log.xz

004404322.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404322.td-b3lyp_6-31+g(d).gjf (generated)

004404322.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404322.mol 004404322.PUBCHEM 004404322.mol (via Jmol)
004404376.b3lyp_6-31g(d).inp

004404376.b3lyp_6-31g(d).qchem.inp (generated)

004404376.b3lyp_6-31g(d).gjf (generated)

004404376.b3lyp_6-31g(d).firefly.inp (generated)

004404376.b3lyp_6-31g(d).smash.inp (generated)

004404376.b3lyp_6-31g(d).nwchem.inp (generated) 004404376.b3lyp_6-31g(d).log.xz 004404376.mol 004404376.PUBCHEM 004404376.mol (via Jmol)
004404381.b3lyp_6-31g(d).inp

004404381.b3lyp_6-31g(d).qchem.inp (generated)

004404381.b3lyp_6-31g(d).gjf (generated)

004404381.b3lyp_6-31g(d).firefly.inp (generated)

004404381.b3lyp_6-31g(d).smash.inp (generated)

004404381.b3lyp_6-31g(d).nwchem.inp (generated) 004404381.b3lyp_6-31g(d).log.xz 004404381.td-b3lyp_6-31g+(d).inp 004404381.td-b3lyp_6-31g+(d).log.xz

004404381.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404381.td-b3lyp_6-31+g(d).gjf (generated)

004404381.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404381.mol 004404381.PUBCHEM 004404381.mol (via Jmol)
004404399.b3lyp_6-31g(d).inp

004404399.b3lyp_6-31g(d).qchem.inp (generated)

004404399.b3lyp_6-31g(d).gjf (generated)

004404399.b3lyp_6-31g(d).firefly.inp (generated)

004404399.b3lyp_6-31g(d).smash.inp (generated)

004404399.b3lyp_6-31g(d).nwchem.inp (generated) 004404399.b3lyp_6-31g(d).log.xz 004404399.mol 004404399.PUBCHEM 004404399.mol (via Jmol)
004404408.b3lyp_6-31g(d).inp

004404408.b3lyp_6-31g(d).qchem.inp (generated)

004404408.b3lyp_6-31g(d).gjf (generated)

004404408.b3lyp_6-31g(d).firefly.inp (generated)

004404408.b3lyp_6-31g(d).smash.inp (generated)

004404408.b3lyp_6-31g(d).nwchem.inp (generated) 004404408.b3lyp_6-31g(d).log.xz 004404408.mol 004404408.PUBCHEM 004404408.mol (via Jmol)
004404445.b3lyp_6-31g(d).inp

004404445.b3lyp_6-31g(d).qchem.inp (generated)

004404445.b3lyp_6-31g(d).gjf (generated)

004404445.b3lyp_6-31g(d).firefly.inp (generated)

004404445.b3lyp_6-31g(d).smash.inp (generated)

004404445.b3lyp_6-31g(d).nwchem.inp (generated) 004404445.b3lyp_6-31g(d).log.xz 004404445.td-b3lyp_6-31g+(d).inp 004404445.td-b3lyp_6-31g+(d).log.xz

004404445.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404445.td-b3lyp_6-31+g(d).gjf (generated)

004404445.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404445.mol 004404445.PUBCHEM 004404445.mol (via Jmol)
004404460.b3lyp_6-31g(d).inp

004404460.b3lyp_6-31g(d).qchem.inp (generated)

004404460.b3lyp_6-31g(d).gjf (generated)

004404460.b3lyp_6-31g(d).firefly.inp (generated)

004404460.b3lyp_6-31g(d).smash.inp (generated)

004404460.b3lyp_6-31g(d).nwchem.inp (generated) 004404460.b3lyp_6-31g(d).log.xz 004404460.td-b3lyp_6-31g+(d).inp 004404460.td-b3lyp_6-31g+(d).log.xz

004404460.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404460.td-b3lyp_6-31+g(d).gjf (generated)

004404460.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404460.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404460.mol 004404460.PUBCHEM 004404460.mol (via Jmol)
004404463.b3lyp_6-31g(d).inp

004404463.b3lyp_6-31g(d).qchem.inp (generated)

004404463.b3lyp_6-31g(d).gjf (generated)

004404463.b3lyp_6-31g(d).firefly.inp (generated)

004404463.b3lyp_6-31g(d).smash.inp (generated)

004404463.b3lyp_6-31g(d).nwchem.inp (generated) 004404463.b3lyp_6-31g(d).log.xz 004404463.mol 004404463.PUBCHEM 004404463.mol (via Jmol)
004404512.b3lyp_6-31g(d).inp

004404512.b3lyp_6-31g(d).qchem.inp (generated)

004404512.b3lyp_6-31g(d).gjf (generated)

004404512.b3lyp_6-31g(d).firefly.inp (generated)

004404512.b3lyp_6-31g(d).smash.inp (generated)

004404512.b3lyp_6-31g(d).nwchem.inp (generated) 004404512.b3lyp_6-31g(d).log.xz 004404512.td-b3lyp_6-31g+(d).inp 004404512.td-b3lyp_6-31g+(d).log.xz

004404512.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404512.td-b3lyp_6-31+g(d).gjf (generated)

004404512.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404512.mol 004404512.PUBCHEM 004404512.mol (via Jmol)
004404516.b3lyp_6-31g(d).inp

004404516.b3lyp_6-31g(d).qchem.inp (generated)

004404516.b3lyp_6-31g(d).gjf (generated)

004404516.b3lyp_6-31g(d).firefly.inp (generated)

004404516.b3lyp_6-31g(d).smash.inp (generated)

004404516.b3lyp_6-31g(d).nwchem.inp (generated) 004404516.b3lyp_6-31g(d).log.xz 004404516.td-b3lyp_6-31g+(d).inp 004404516.td-b3lyp_6-31g+(d).log.xz

004404516.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404516.td-b3lyp_6-31+g(d).gjf (generated)

004404516.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404516.mol 004404516.PUBCHEM 004404516.mol (via Jmol)
004404524.b3lyp_6-31g(d).inp

004404524.b3lyp_6-31g(d).qchem.inp (generated)

004404524.b3lyp_6-31g(d).gjf (generated)

004404524.b3lyp_6-31g(d).firefly.inp (generated)

004404524.b3lyp_6-31g(d).smash.inp (generated)

004404524.b3lyp_6-31g(d).nwchem.inp (generated) 004404524.b3lyp_6-31g(d).log.xz 004404524.td-b3lyp_6-31g+(d).inp 004404524.td-b3lyp_6-31g+(d).log.xz

004404524.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404524.td-b3lyp_6-31+g(d).gjf (generated)

004404524.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404524.mol 004404524.PUBCHEM 004404524.mol (via Jmol)
004404559.b3lyp_6-31g(d).inp

004404559.b3lyp_6-31g(d).qchem.inp (generated)

004404559.b3lyp_6-31g(d).gjf (generated)

004404559.b3lyp_6-31g(d).firefly.inp (generated)

004404559.b3lyp_6-31g(d).smash.inp (generated)

004404559.b3lyp_6-31g(d).nwchem.inp (generated) 004404559.b3lyp_6-31g(d).log.xz 004404559.td-b3lyp_6-31g+(d).inp 004404559.td-b3lyp_6-31g+(d).log.xz

004404559.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404559.td-b3lyp_6-31+g(d).gjf (generated)

004404559.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404559.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404559.mol 004404559.PUBCHEM 004404559.mol (via Jmol)
004404637.b3lyp_6-31g(d).inp

004404637.b3lyp_6-31g(d).qchem.inp (generated)

004404637.b3lyp_6-31g(d).gjf (generated)

004404637.b3lyp_6-31g(d).firefly.inp (generated)

004404637.b3lyp_6-31g(d).smash.inp (generated)

004404637.b3lyp_6-31g(d).nwchem.inp (generated) 004404637.b3lyp_6-31g(d).log.xz 004404637.td-b3lyp_6-31g+(d).inp 004404637.td-b3lyp_6-31g+(d).log.xz

004404637.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404637.td-b3lyp_6-31+g(d).gjf (generated)

004404637.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404637.mol 004404637.PUBCHEM 004404637.mol (via Jmol)
004404715.b3lyp_6-31g(d).inp

004404715.b3lyp_6-31g(d).qchem.inp (generated)

004404715.b3lyp_6-31g(d).gjf (generated)

004404715.b3lyp_6-31g(d).firefly.inp (generated)

004404715.b3lyp_6-31g(d).smash.inp (generated)

004404715.b3lyp_6-31g(d).nwchem.inp (generated) 004404715.b3lyp_6-31g(d).log.xz 004404715.mol 004404715.PUBCHEM 004404715.mol (via Jmol)
004404717.b3lyp_6-31g(d).inp

004404717.b3lyp_6-31g(d).qchem.inp (generated)

004404717.b3lyp_6-31g(d).gjf (generated)

004404717.b3lyp_6-31g(d).firefly.inp (generated)

004404717.b3lyp_6-31g(d).smash.inp (generated)

004404717.b3lyp_6-31g(d).nwchem.inp (generated) 004404717.b3lyp_6-31g(d).log.xz 004404717.td-b3lyp_6-31g+(d).inp 004404717.td-b3lyp_6-31g+(d).log.xz

004404717.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404717.td-b3lyp_6-31+g(d).gjf (generated)

004404717.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404717.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404717.mol 004404717.PUBCHEM 004404717.mol (via Jmol)
004404751.b3lyp_6-31g(d).inp

004404751.b3lyp_6-31g(d).qchem.inp (generated)

004404751.b3lyp_6-31g(d).gjf (generated)

004404751.b3lyp_6-31g(d).firefly.inp (generated)

004404751.b3lyp_6-31g(d).smash.inp (generated)

004404751.b3lyp_6-31g(d).nwchem.inp (generated) 004404751.b3lyp_6-31g(d).log.xz 004404751.mol 004404751.PUBCHEM 004404751.mol (via Jmol)
004404770.b3lyp_6-31g(d).inp

004404770.b3lyp_6-31g(d).qchem.inp (generated)

004404770.b3lyp_6-31g(d).gjf (generated)

004404770.b3lyp_6-31g(d).firefly.inp (generated)

004404770.b3lyp_6-31g(d).smash.inp (generated)

004404770.b3lyp_6-31g(d).nwchem.inp (generated) 004404770.b3lyp_6-31g(d).log.xz 004404770.td-b3lyp_6-31g+(d).inp 004404770.td-b3lyp_6-31g+(d).log.xz

004404770.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404770.td-b3lyp_6-31+g(d).gjf (generated)

004404770.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404770.mol 004404770.PUBCHEM 004404770.mol (via Jmol)
004404779.b3lyp_6-31g(d).inp

004404779.b3lyp_6-31g(d).qchem.inp (generated)

004404779.b3lyp_6-31g(d).gjf (generated)

004404779.b3lyp_6-31g(d).firefly.inp (generated)

004404779.b3lyp_6-31g(d).smash.inp (generated)

004404779.b3lyp_6-31g(d).nwchem.inp (generated) 004404779.b3lyp_6-31g(d).log.xz 004404779.td-b3lyp_6-31g+(d).inp 004404779.td-b3lyp_6-31g+(d).log.xz

004404779.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404779.td-b3lyp_6-31+g(d).gjf (generated)

004404779.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404779.mol 004404779.PUBCHEM 004404779.mol (via Jmol)
004404820.b3lyp_6-31g(d).inp

004404820.b3lyp_6-31g(d).qchem.inp (generated)

004404820.b3lyp_6-31g(d).gjf (generated)

004404820.b3lyp_6-31g(d).firefly.inp (generated)

004404820.b3lyp_6-31g(d).smash.inp (generated)

004404820.b3lyp_6-31g(d).nwchem.inp (generated) 004404820.b3lyp_6-31g(d).log.xz 004404820.mol 004404820.PUBCHEM 004404820.mol (via Jmol)
004404853.b3lyp_6-31g(d).inp

004404853.b3lyp_6-31g(d).qchem.inp (generated)

004404853.b3lyp_6-31g(d).gjf (generated)

004404853.b3lyp_6-31g(d).firefly.inp (generated)

004404853.b3lyp_6-31g(d).smash.inp (generated)

004404853.b3lyp_6-31g(d).nwchem.inp (generated) 004404853.b3lyp_6-31g(d).log.xz 004404853.mol 004404853.PUBCHEM 004404853.mol (via Jmol)
004404885.b3lyp_6-31g(d).inp

004404885.b3lyp_6-31g(d).qchem.inp (generated)

004404885.b3lyp_6-31g(d).gjf (generated)

004404885.b3lyp_6-31g(d).firefly.inp (generated)

004404885.b3lyp_6-31g(d).smash.inp (generated)

004404885.b3lyp_6-31g(d).nwchem.inp (generated) 004404885.b3lyp_6-31g(d).log.xz 004404885.td-b3lyp_6-31g+(d).inp 004404885.td-b3lyp_6-31g+(d).log.xz

004404885.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404885.td-b3lyp_6-31+g(d).gjf (generated)

004404885.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404885.mol 004404885.PUBCHEM 004404885.mol (via Jmol)
004404937.b3lyp_6-31g(d).inp

004404937.b3lyp_6-31g(d).qchem.inp (generated)

004404937.b3lyp_6-31g(d).gjf (generated)

004404937.b3lyp_6-31g(d).firefly.inp (generated)

004404937.b3lyp_6-31g(d).smash.inp (generated)

004404937.b3lyp_6-31g(d).nwchem.inp (generated) 004404937.b3lyp_6-31g(d).log.xz 004404937.mol 004404937.PUBCHEM 004404937.mol (via Jmol)
004404940.b3lyp_6-31g(d).inp

004404940.b3lyp_6-31g(d).qchem.inp (generated)

004404940.b3lyp_6-31g(d).gjf (generated)

004404940.b3lyp_6-31g(d).firefly.inp (generated)

004404940.b3lyp_6-31g(d).smash.inp (generated)

004404940.b3lyp_6-31g(d).nwchem.inp (generated) 004404940.b3lyp_6-31g(d).log.xz 004404940.td-b3lyp_6-31g+(d).inp 004404940.td-b3lyp_6-31g+(d).log.xz

004404940.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404940.td-b3lyp_6-31+g(d).gjf (generated)

004404940.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404940.mol 004404940.PUBCHEM 004404940.mol (via Jmol)
004404943.b3lyp_6-31g(d).inp

004404943.b3lyp_6-31g(d).qchem.inp (generated)

004404943.b3lyp_6-31g(d).gjf (generated)

004404943.b3lyp_6-31g(d).firefly.inp (generated)

004404943.b3lyp_6-31g(d).smash.inp (generated)

004404943.b3lyp_6-31g(d).nwchem.inp (generated) 004404943.b3lyp_6-31g(d).log.xz 004404943.td-b3lyp_6-31g+(d).inp 004404943.td-b3lyp_6-31g+(d).log.xz

004404943.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404943.td-b3lyp_6-31+g(d).gjf (generated)

004404943.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404943.mol 004404943.PUBCHEM 004404943.mol (via Jmol)
004404947.b3lyp_6-31g(d).inp

004404947.b3lyp_6-31g(d).qchem.inp (generated)

004404947.b3lyp_6-31g(d).gjf (generated)

004404947.b3lyp_6-31g(d).firefly.inp (generated)

004404947.b3lyp_6-31g(d).smash.inp (generated)

004404947.b3lyp_6-31g(d).nwchem.inp (generated) 004404947.b3lyp_6-31g(d).log.xz 004404947.td-b3lyp_6-31g+(d).inp 004404947.td-b3lyp_6-31g+(d).log.xz

004404947.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404947.td-b3lyp_6-31+g(d).gjf (generated)

004404947.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404947.mol 004404947.PUBCHEM 004404947.mol (via Jmol)
004404985.b3lyp_6-31g(d).inp

004404985.b3lyp_6-31g(d).qchem.inp (generated)

004404985.b3lyp_6-31g(d).gjf (generated)

004404985.b3lyp_6-31g(d).firefly.inp (generated)

004404985.b3lyp_6-31g(d).smash.inp (generated)

004404985.b3lyp_6-31g(d).nwchem.inp (generated) 004404985.b3lyp_6-31g(d).log.xz 004404985.mol 004404985.PUBCHEM 004404985.mol (via Jmol)
004404986.b3lyp_6-31g(d).inp

004404986.b3lyp_6-31g(d).qchem.inp (generated)

004404986.b3lyp_6-31g(d).gjf (generated)

004404986.b3lyp_6-31g(d).firefly.inp (generated)

004404986.b3lyp_6-31g(d).smash.inp (generated)

004404986.b3lyp_6-31g(d).nwchem.inp (generated) 004404986.b3lyp_6-31g(d).log.xz 004404986.td-b3lyp_6-31g+(d).inp 004404986.td-b3lyp_6-31g+(d).log.xz

004404986.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404986.td-b3lyp_6-31+g(d).gjf (generated)

004404986.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404986.mol 004404986.PUBCHEM 004404986.mol (via Jmol)
004404999.b3lyp_6-31g(d).inp

004404999.b3lyp_6-31g(d).qchem.inp (generated)

004404999.b3lyp_6-31g(d).gjf (generated)

004404999.b3lyp_6-31g(d).firefly.inp (generated)

004404999.b3lyp_6-31g(d).smash.inp (generated)

004404999.b3lyp_6-31g(d).nwchem.inp (generated) 004404999.b3lyp_6-31g(d).log.xz 004404999.td-b3lyp_6-31g+(d).inp 004404999.td-b3lyp_6-31g+(d).log.xz

004404999.td-b3lyp_6-31+g(d).qchem.inp (generated)

004404999.td-b3lyp_6-31+g(d).gjf (generated)

004404999.td-b3lyp_6-31+g(d).firefly.inp (generated)

004404999.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004404999.mol 004404999.PUBCHEM 004404999.mol (via Jmol)
004405006.b3lyp_6-31g(d).inp

004405006.b3lyp_6-31g(d).qchem.inp (generated)

004405006.b3lyp_6-31g(d).gjf (generated)

004405006.b3lyp_6-31g(d).firefly.inp (generated)

004405006.b3lyp_6-31g(d).smash.inp (generated)

004405006.b3lyp_6-31g(d).nwchem.inp (generated) 004405006.b3lyp_6-31g(d).log.xz 004405006.td-b3lyp_6-31g+(d).inp 004405006.td-b3lyp_6-31g+(d).log.xz

004405006.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405006.td-b3lyp_6-31+g(d).gjf (generated)

004405006.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405006.mol 004405006.PUBCHEM 004405006.mol (via Jmol)
004405011.b3lyp_6-31g(d).inp

004405011.b3lyp_6-31g(d).qchem.inp (generated)

004405011.b3lyp_6-31g(d).gjf (generated)

004405011.b3lyp_6-31g(d).firefly.inp (generated)

004405011.b3lyp_6-31g(d).smash.inp (generated)

004405011.b3lyp_6-31g(d).nwchem.inp (generated) 004405011.b3lyp_6-31g(d).log.xz 004405011.td-b3lyp_6-31g+(d).inp 004405011.td-b3lyp_6-31g+(d).log.xz

004405011.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405011.td-b3lyp_6-31+g(d).gjf (generated)

004405011.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405011.mol 004405011.PUBCHEM 004405011.mol (via Jmol)
004405061.b3lyp_6-31g(d).inp

004405061.b3lyp_6-31g(d).qchem.inp (generated)

004405061.b3lyp_6-31g(d).gjf (generated)

004405061.b3lyp_6-31g(d).firefly.inp (generated)

004405061.b3lyp_6-31g(d).smash.inp (generated)

004405061.b3lyp_6-31g(d).nwchem.inp (generated) 004405061.b3lyp_6-31g(d).log.xz 004405061.td-b3lyp_6-31g+(d).inp 004405061.td-b3lyp_6-31g+(d).log.xz

004405061.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405061.td-b3lyp_6-31+g(d).gjf (generated)

004405061.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405061.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405061.mol 004405061.PUBCHEM 004405061.mol (via Jmol)
004405145.b3lyp_6-31g(d).inp

004405145.b3lyp_6-31g(d).qchem.inp (generated)

004405145.b3lyp_6-31g(d).gjf (generated)

004405145.b3lyp_6-31g(d).firefly.inp (generated)

004405145.b3lyp_6-31g(d).smash.inp (generated)

004405145.b3lyp_6-31g(d).nwchem.inp (generated) 004405145.b3lyp_6-31g(d).log.xz 004405145.td-b3lyp_6-31g+(d).inp 004405145.td-b3lyp_6-31g+(d).log.xz

004405145.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405145.td-b3lyp_6-31+g(d).gjf (generated)

004405145.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405145.mol 004405145.PUBCHEM 004405145.mol (via Jmol)
004405213.b3lyp_6-31g(d).inp

004405213.b3lyp_6-31g(d).qchem.inp (generated)

004405213.b3lyp_6-31g(d).gjf (generated)

004405213.b3lyp_6-31g(d).firefly.inp (generated)

004405213.b3lyp_6-31g(d).smash.inp (generated)

004405213.b3lyp_6-31g(d).nwchem.inp (generated) 004405213.b3lyp_6-31g(d).log.xz 004405213.mol 004405213.PUBCHEM 004405213.mol (via Jmol)
004405251.b3lyp_6-31g(d).inp

004405251.b3lyp_6-31g(d).qchem.inp (generated)

004405251.b3lyp_6-31g(d).gjf (generated)

004405251.b3lyp_6-31g(d).firefly.inp (generated)

004405251.b3lyp_6-31g(d).smash.inp (generated)

004405251.b3lyp_6-31g(d).nwchem.inp (generated) 004405251.b3lyp_6-31g(d).log.xz 004405251.td-b3lyp_6-31g+(d).inp 004405251.td-b3lyp_6-31g+(d).log.xz

004405251.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405251.td-b3lyp_6-31+g(d).gjf (generated)

004405251.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405251.mol 004405251.PUBCHEM 004405251.mol (via Jmol)
004405255.b3lyp_6-31g(d).inp

004405255.b3lyp_6-31g(d).qchem.inp (generated)

004405255.b3lyp_6-31g(d).gjf (generated)

004405255.b3lyp_6-31g(d).firefly.inp (generated)

004405255.b3lyp_6-31g(d).smash.inp (generated)

004405255.b3lyp_6-31g(d).nwchem.inp (generated) 004405255.b3lyp_6-31g(d).log.xz 004405255.mol 004405255.PUBCHEM 004405255.mol (via Jmol)
004405259.b3lyp_6-31g(d).inp

004405259.b3lyp_6-31g(d).qchem.inp (generated)

004405259.b3lyp_6-31g(d).gjf (generated)

004405259.b3lyp_6-31g(d).firefly.inp (generated)

004405259.b3lyp_6-31g(d).smash.inp (generated)

004405259.b3lyp_6-31g(d).nwchem.inp (generated) 004405259.b3lyp_6-31g(d).log.xz 004405259.td-b3lyp_6-31g+(d).inp 004405259.td-b3lyp_6-31g+(d).log.xz

004405259.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405259.td-b3lyp_6-31+g(d).gjf (generated)

004405259.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405259.mol 004405259.PUBCHEM 004405259.mol (via Jmol)
004405406.b3lyp_6-31g(d).inp

004405406.b3lyp_6-31g(d).qchem.inp (generated)

004405406.b3lyp_6-31g(d).gjf (generated)

004405406.b3lyp_6-31g(d).firefly.inp (generated)

004405406.b3lyp_6-31g(d).smash.inp (generated)

004405406.b3lyp_6-31g(d).nwchem.inp (generated) 004405406.b3lyp_6-31g(d).log.xz 004405406.td-b3lyp_6-31g+(d).inp 004405406.td-b3lyp_6-31g+(d).log.xz

004405406.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405406.td-b3lyp_6-31+g(d).gjf (generated)

004405406.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405406.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405406.mol 004405406.PUBCHEM 004405406.mol (via Jmol)
004405454.b3lyp_6-31g(d).inp

004405454.b3lyp_6-31g(d).qchem.inp (generated)

004405454.b3lyp_6-31g(d).gjf (generated)

004405454.b3lyp_6-31g(d).firefly.inp (generated)

004405454.b3lyp_6-31g(d).smash.inp (generated)

004405454.b3lyp_6-31g(d).nwchem.inp (generated) 004405454.b3lyp_6-31g(d).log.xz 004405454.td-b3lyp_6-31g+(d).inp 004405454.td-b3lyp_6-31g+(d).log.xz

004405454.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405454.td-b3lyp_6-31+g(d).gjf (generated)

004405454.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405454.mol 004405454.PUBCHEM 004405454.mol (via Jmol)
004405455.b3lyp_6-31g(d).inp

004405455.b3lyp_6-31g(d).qchem.inp (generated)

004405455.b3lyp_6-31g(d).gjf (generated)

004405455.b3lyp_6-31g(d).firefly.inp (generated)

004405455.b3lyp_6-31g(d).smash.inp (generated)

004405455.b3lyp_6-31g(d).nwchem.inp (generated) 004405455.b3lyp_6-31g(d).log.xz 004405455.td-b3lyp_6-31g+(d).inp 004405455.td-b3lyp_6-31g+(d).log.xz

004405455.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405455.td-b3lyp_6-31+g(d).gjf (generated)

004405455.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405455.mol 004405455.PUBCHEM 004405455.mol (via Jmol)
004405457.b3lyp_6-31g(d).inp

004405457.b3lyp_6-31g(d).qchem.inp (generated)

004405457.b3lyp_6-31g(d).gjf (generated)

004405457.b3lyp_6-31g(d).firefly.inp (generated)

004405457.b3lyp_6-31g(d).smash.inp (generated)

004405457.b3lyp_6-31g(d).nwchem.inp (generated) 004405457.b3lyp_6-31g(d).log.xz 004405457.mol 004405457.PUBCHEM 004405457.mol (via Jmol)
004405458.b3lyp_6-31g(d).inp

004405458.b3lyp_6-31g(d).qchem.inp (generated)

004405458.b3lyp_6-31g(d).gjf (generated)

004405458.b3lyp_6-31g(d).firefly.inp (generated)

004405458.b3lyp_6-31g(d).smash.inp (generated)

004405458.b3lyp_6-31g(d).nwchem.inp (generated) 004405458.b3lyp_6-31g(d).log.xz 004405458.mol 004405458.PUBCHEM 004405458.mol (via Jmol)
004405528.b3lyp_6-31g(d).inp

004405528.b3lyp_6-31g(d).qchem.inp (generated)

004405528.b3lyp_6-31g(d).gjf (generated)

004405528.b3lyp_6-31g(d).firefly.inp (generated)

004405528.b3lyp_6-31g(d).smash.inp (generated)

004405528.b3lyp_6-31g(d).nwchem.inp (generated) 004405528.b3lyp_6-31g(d).log.xz 004405528.mol 004405528.PUBCHEM 004405528.mol (via Jmol)
004405542.b3lyp_6-31g(d).inp

004405542.b3lyp_6-31g(d).qchem.inp (generated)

004405542.b3lyp_6-31g(d).gjf (generated)

004405542.b3lyp_6-31g(d).firefly.inp (generated)

004405542.b3lyp_6-31g(d).smash.inp (generated)

004405542.b3lyp_6-31g(d).nwchem.inp (generated) 004405542.b3lyp_6-31g(d).log.xz 004405542.td-b3lyp_6-31g+(d).inp 004405542.td-b3lyp_6-31g+(d).log.xz

004405542.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405542.td-b3lyp_6-31+g(d).gjf (generated)

004405542.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405542.mol 004405542.PUBCHEM 004405542.mol (via Jmol)
004405641.b3lyp_6-31g(d).inp

004405641.b3lyp_6-31g(d).qchem.inp (generated)

004405641.b3lyp_6-31g(d).gjf (generated)

004405641.b3lyp_6-31g(d).firefly.inp (generated)

004405641.b3lyp_6-31g(d).smash.inp (generated)

004405641.b3lyp_6-31g(d).nwchem.inp (generated) 004405641.b3lyp_6-31g(d).log.xz 004405641.td-b3lyp_6-31g+(d).inp 004405641.td-b3lyp_6-31g+(d).log.xz

004405641.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405641.td-b3lyp_6-31+g(d).gjf (generated)

004405641.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405641.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405641.mol 004405641.PUBCHEM 004405641.mol (via Jmol)
004405653.b3lyp_6-31g(d).inp

004405653.b3lyp_6-31g(d).qchem.inp (generated)

004405653.b3lyp_6-31g(d).gjf (generated)

004405653.b3lyp_6-31g(d).firefly.inp (generated)

004405653.b3lyp_6-31g(d).smash.inp (generated)

004405653.b3lyp_6-31g(d).nwchem.inp (generated) 004405653.b3lyp_6-31g(d).log.xz 004405653.td-b3lyp_6-31g+(d).inp 004405653.td-b3lyp_6-31g+(d).log.xz

004405653.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405653.td-b3lyp_6-31+g(d).gjf (generated)

004405653.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405653.mol 004405653.PUBCHEM 004405653.mol (via Jmol)
004405657.b3lyp_6-31g(d).inp

004405657.b3lyp_6-31g(d).qchem.inp (generated)

004405657.b3lyp_6-31g(d).gjf (generated)

004405657.b3lyp_6-31g(d).firefly.inp (generated)

004405657.b3lyp_6-31g(d).smash.inp (generated)

004405657.b3lyp_6-31g(d).nwchem.inp (generated) 004405657.b3lyp_6-31g(d).log.xz 004405657.td-b3lyp_6-31g+(d).inp 004405657.td-b3lyp_6-31g+(d).log.xz

004405657.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405657.td-b3lyp_6-31+g(d).gjf (generated)

004405657.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405657.mol 004405657.PUBCHEM 004405657.mol (via Jmol)
004405669.b3lyp_6-31g(d).inp

004405669.b3lyp_6-31g(d).qchem.inp (generated)

004405669.b3lyp_6-31g(d).gjf (generated)

004405669.b3lyp_6-31g(d).firefly.inp (generated)

004405669.b3lyp_6-31g(d).smash.inp (generated)

004405669.b3lyp_6-31g(d).nwchem.inp (generated) 004405669.b3lyp_6-31g(d).log.xz 004405669.mol 004405669.PUBCHEM 004405669.mol (via Jmol)
004405716.b3lyp_6-31g(d).inp

004405716.b3lyp_6-31g(d).qchem.inp (generated)

004405716.b3lyp_6-31g(d).gjf (generated)

004405716.b3lyp_6-31g(d).firefly.inp (generated)

004405716.b3lyp_6-31g(d).smash.inp (generated)

004405716.b3lyp_6-31g(d).nwchem.inp (generated) 004405716.b3lyp_6-31g(d).log.xz 004405716.td-b3lyp_6-31g+(d).inp 004405716.td-b3lyp_6-31g+(d).log.xz

004405716.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405716.td-b3lyp_6-31+g(d).gjf (generated)

004405716.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405716.mol 004405716.PUBCHEM 004405716.mol (via Jmol)
004405788.b3lyp_6-31g(d).inp

004405788.b3lyp_6-31g(d).qchem.inp (generated)

004405788.b3lyp_6-31g(d).gjf (generated)

004405788.b3lyp_6-31g(d).firefly.inp (generated)

004405788.b3lyp_6-31g(d).smash.inp (generated)

004405788.b3lyp_6-31g(d).nwchem.inp (generated) 004405788.b3lyp_6-31g(d).log.xz 004405788.td-b3lyp_6-31g+(d).inp 004405788.td-b3lyp_6-31g+(d).log.xz

004405788.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405788.td-b3lyp_6-31+g(d).gjf (generated)

004405788.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405788.mol 004405788.PUBCHEM 004405788.mol (via Jmol)
004405876.b3lyp_6-31g(d).inp

004405876.b3lyp_6-31g(d).qchem.inp (generated)

004405876.b3lyp_6-31g(d).gjf (generated)

004405876.b3lyp_6-31g(d).firefly.inp (generated)

004405876.b3lyp_6-31g(d).smash.inp (generated)

004405876.b3lyp_6-31g(d).nwchem.inp (generated) 004405876.b3lyp_6-31g(d).log.xz 004405876.td-b3lyp_6-31g+(d).inp 004405876.td-b3lyp_6-31g+(d).log.xz

004405876.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405876.td-b3lyp_6-31+g(d).gjf (generated)

004405876.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405876.mol 004405876.PUBCHEM 004405876.mol (via Jmol)
004405878.b3lyp_6-31g(d).inp

004405878.b3lyp_6-31g(d).qchem.inp (generated)

004405878.b3lyp_6-31g(d).gjf (generated)

004405878.b3lyp_6-31g(d).firefly.inp (generated)

004405878.b3lyp_6-31g(d).smash.inp (generated)

004405878.b3lyp_6-31g(d).nwchem.inp (generated) 004405878.b3lyp_6-31g(d).log.xz 004405878.td-b3lyp_6-31g+(d).inp 004405878.td-b3lyp_6-31g+(d).log.xz

004405878.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405878.td-b3lyp_6-31+g(d).gjf (generated)

004405878.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405878.mol 004405878.PUBCHEM 004405878.mol (via Jmol)
004405942.b3lyp_6-31g(d).inp

004405942.b3lyp_6-31g(d).qchem.inp (generated)

004405942.b3lyp_6-31g(d).gjf (generated)

004405942.b3lyp_6-31g(d).firefly.inp (generated)

004405942.b3lyp_6-31g(d).smash.inp (generated)

004405942.b3lyp_6-31g(d).nwchem.inp (generated) 004405942.b3lyp_6-31g(d).log.xz 004405942.mol 004405942.PUBCHEM 004405942.mol (via Jmol)
004405990.b3lyp_6-31g(d).inp

004405990.b3lyp_6-31g(d).qchem.inp (generated)

004405990.b3lyp_6-31g(d).gjf (generated)

004405990.b3lyp_6-31g(d).firefly.inp (generated)

004405990.b3lyp_6-31g(d).smash.inp (generated)

004405990.b3lyp_6-31g(d).nwchem.inp (generated) 004405990.b3lyp_6-31g(d).log.xz 004405990.td-b3lyp_6-31g+(d).inp 004405990.td-b3lyp_6-31g+(d).log.xz

004405990.td-b3lyp_6-31+g(d).qchem.inp (generated)

004405990.td-b3lyp_6-31+g(d).gjf (generated)

004405990.td-b3lyp_6-31+g(d).firefly.inp (generated)

004405990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004405990.mol 004405990.PUBCHEM 004405990.mol (via Jmol)
004406009.b3lyp_6-31g(d).inp

004406009.b3lyp_6-31g(d).qchem.inp (generated)

004406009.b3lyp_6-31g(d).gjf (generated)

004406009.b3lyp_6-31g(d).firefly.inp (generated)

004406009.b3lyp_6-31g(d).smash.inp (generated)

004406009.b3lyp_6-31g(d).nwchem.inp (generated) 004406009.b3lyp_6-31g(d).log.xz 004406009.mol 004406009.PUBCHEM 004406009.mol (via Jmol)
004406013.b3lyp_6-31g(d).inp

004406013.b3lyp_6-31g(d).qchem.inp (generated)

004406013.b3lyp_6-31g(d).gjf (generated)

004406013.b3lyp_6-31g(d).firefly.inp (generated)

004406013.b3lyp_6-31g(d).smash.inp (generated)

004406013.b3lyp_6-31g(d).nwchem.inp (generated) 004406013.b3lyp_6-31g(d).log.xz 004406013.td-b3lyp_6-31g+(d).inp 004406013.td-b3lyp_6-31g+(d).log.xz

004406013.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406013.td-b3lyp_6-31+g(d).gjf (generated)

004406013.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406013.mol 004406013.PUBCHEM 004406013.mol (via Jmol)
004406062.b3lyp_6-31g(d).inp

004406062.b3lyp_6-31g(d).qchem.inp (generated)

004406062.b3lyp_6-31g(d).gjf (generated)

004406062.b3lyp_6-31g(d).firefly.inp (generated)

004406062.b3lyp_6-31g(d).smash.inp (generated)

004406062.b3lyp_6-31g(d).nwchem.inp (generated) 004406062.b3lyp_6-31g(d).log.xz 004406062.mol 004406062.PUBCHEM 004406062.mol (via Jmol)
004406113.b3lyp_6-31g(d).inp

004406113.b3lyp_6-31g(d).qchem.inp (generated)

004406113.b3lyp_6-31g(d).gjf (generated)

004406113.b3lyp_6-31g(d).firefly.inp (generated)

004406113.b3lyp_6-31g(d).smash.inp (generated)

004406113.b3lyp_6-31g(d).nwchem.inp (generated) 004406113.b3lyp_6-31g(d).log.xz 004406113.td-b3lyp_6-31g+(d).inp 004406113.td-b3lyp_6-31g+(d).log.xz

004406113.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406113.td-b3lyp_6-31+g(d).gjf (generated)

004406113.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406113.mol 004406113.PUBCHEM 004406113.mol (via Jmol)
004406114.b3lyp_6-31g(d).inp

004406114.b3lyp_6-31g(d).qchem.inp (generated)

004406114.b3lyp_6-31g(d).gjf (generated)

004406114.b3lyp_6-31g(d).firefly.inp (generated)

004406114.b3lyp_6-31g(d).smash.inp (generated)

004406114.b3lyp_6-31g(d).nwchem.inp (generated) 004406114.b3lyp_6-31g(d).log.xz 004406114.td-b3lyp_6-31g+(d).inp 004406114.td-b3lyp_6-31g+(d).log.xz

004406114.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406114.td-b3lyp_6-31+g(d).gjf (generated)

004406114.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406114.mol 004406114.PUBCHEM 004406114.mol (via Jmol)
004406116.b3lyp_6-31g(d).inp

004406116.b3lyp_6-31g(d).qchem.inp (generated)

004406116.b3lyp_6-31g(d).gjf (generated)

004406116.b3lyp_6-31g(d).firefly.inp (generated)

004406116.b3lyp_6-31g(d).smash.inp (generated)

004406116.b3lyp_6-31g(d).nwchem.inp (generated) 004406116.b3lyp_6-31g(d).log.xz 004406116.td-b3lyp_6-31g+(d).inp 004406116.td-b3lyp_6-31g+(d).log.xz

004406116.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406116.td-b3lyp_6-31+g(d).gjf (generated)

004406116.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406116.mol 004406116.PUBCHEM 004406116.mol (via Jmol)
004406134.b3lyp_6-31g(d).inp

004406134.b3lyp_6-31g(d).qchem.inp (generated)

004406134.b3lyp_6-31g(d).gjf (generated)

004406134.b3lyp_6-31g(d).firefly.inp (generated)

004406134.b3lyp_6-31g(d).smash.inp (generated)

004406134.b3lyp_6-31g(d).nwchem.inp (generated) 004406134.b3lyp_6-31g(d).log.xz 004406134.td-b3lyp_6-31g+(d).inp 004406134.td-b3lyp_6-31g+(d).log.xz

004406134.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406134.td-b3lyp_6-31+g(d).gjf (generated)

004406134.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406134.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406134.mol 004406134.PUBCHEM 004406134.mol (via Jmol)
004406147.b3lyp_6-31g(d).inp

004406147.b3lyp_6-31g(d).qchem.inp (generated)

004406147.b3lyp_6-31g(d).gjf (generated)

004406147.b3lyp_6-31g(d).firefly.inp (generated)

004406147.b3lyp_6-31g(d).smash.inp (generated)

004406147.b3lyp_6-31g(d).nwchem.inp (generated) 004406147.b3lyp_6-31g(d).log.xz 004406147.mol 004406147.PUBCHEM 004406147.mol (via Jmol)
004406196.b3lyp_6-31g(d).inp

004406196.b3lyp_6-31g(d).qchem.inp (generated)

004406196.b3lyp_6-31g(d).gjf (generated)

004406196.b3lyp_6-31g(d).firefly.inp (generated)

004406196.b3lyp_6-31g(d).smash.inp (generated)

004406196.b3lyp_6-31g(d).nwchem.inp (generated) 004406196.b3lyp_6-31g(d).log.xz 004406196.mol 004406196.PUBCHEM 004406196.mol (via Jmol)
004406200.b3lyp_6-31g(d).inp

004406200.b3lyp_6-31g(d).qchem.inp (generated)

004406200.b3lyp_6-31g(d).gjf (generated)

004406200.b3lyp_6-31g(d).firefly.inp (generated)

004406200.b3lyp_6-31g(d).smash.inp (generated)

004406200.b3lyp_6-31g(d).nwchem.inp (generated) 004406200.b3lyp_6-31g(d).log.xz 004406200.td-b3lyp_6-31g+(d).inp 004406200.td-b3lyp_6-31g+(d).log.xz

004406200.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406200.td-b3lyp_6-31+g(d).gjf (generated)

004406200.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406200.mol 004406200.PUBCHEM 004406200.mol (via Jmol)
004406256.b3lyp_6-31g(d).inp

004406256.b3lyp_6-31g(d).qchem.inp (generated)

004406256.b3lyp_6-31g(d).gjf (generated)

004406256.b3lyp_6-31g(d).firefly.inp (generated)

004406256.b3lyp_6-31g(d).smash.inp (generated)

004406256.b3lyp_6-31g(d).nwchem.inp (generated) 004406256.b3lyp_6-31g(d).log.xz 004406256.td-b3lyp_6-31g+(d).inp 004406256.td-b3lyp_6-31g+(d).log.xz

004406256.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406256.td-b3lyp_6-31+g(d).gjf (generated)

004406256.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406256.mol 004406256.PUBCHEM 004406256.mol (via Jmol)
004406425.b3lyp_6-31g(d).inp

004406425.b3lyp_6-31g(d).qchem.inp (generated)

004406425.b3lyp_6-31g(d).gjf (generated)

004406425.b3lyp_6-31g(d).firefly.inp (generated)

004406425.b3lyp_6-31g(d).smash.inp (generated)

004406425.b3lyp_6-31g(d).nwchem.inp (generated) 004406425.b3lyp_6-31g(d).log.xz 004406425.td-b3lyp_6-31g+(d).inp 004406425.td-b3lyp_6-31g+(d).log.xz

004406425.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406425.td-b3lyp_6-31+g(d).gjf (generated)

004406425.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406425.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406425.mol 004406425.PUBCHEM 004406425.mol (via Jmol)
004406624.b3lyp_6-31g(d).inp

004406624.b3lyp_6-31g(d).qchem.inp (generated)

004406624.b3lyp_6-31g(d).gjf (generated)

004406624.b3lyp_6-31g(d).firefly.inp (generated)

004406624.b3lyp_6-31g(d).smash.inp (generated)

004406624.b3lyp_6-31g(d).nwchem.inp (generated) 004406624.b3lyp_6-31g(d).log.xz 004406624.mol 004406624.PUBCHEM 004406624.mol (via Jmol)
004406781.b3lyp_6-31g(d).inp

004406781.b3lyp_6-31g(d).qchem.inp (generated)

004406781.b3lyp_6-31g(d).gjf (generated)

004406781.b3lyp_6-31g(d).firefly.inp (generated)

004406781.b3lyp_6-31g(d).smash.inp (generated)

004406781.b3lyp_6-31g(d).nwchem.inp (generated) 004406781.b3lyp_6-31g(d).log.xz 004406781.mol 004406781.PUBCHEM 004406781.mol (via Jmol)
004406789.b3lyp_6-31g(d).inp

004406789.b3lyp_6-31g(d).qchem.inp (generated)

004406789.b3lyp_6-31g(d).gjf (generated)

004406789.b3lyp_6-31g(d).firefly.inp (generated)

004406789.b3lyp_6-31g(d).smash.inp (generated)

004406789.b3lyp_6-31g(d).nwchem.inp (generated) 004406789.b3lyp_6-31g(d).log.xz 004406789.mol 004406789.PUBCHEM 004406789.mol (via Jmol)
004406818.b3lyp_6-31g(d).inp

004406818.b3lyp_6-31g(d).qchem.inp (generated)

004406818.b3lyp_6-31g(d).gjf (generated)

004406818.b3lyp_6-31g(d).firefly.inp (generated)

004406818.b3lyp_6-31g(d).smash.inp (generated)

004406818.b3lyp_6-31g(d).nwchem.inp (generated) 004406818.b3lyp_6-31g(d).log.xz 004406818.td-b3lyp_6-31g+(d).inp 004406818.td-b3lyp_6-31g+(d).log.xz

004406818.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406818.td-b3lyp_6-31+g(d).gjf (generated)

004406818.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406818.mol 004406818.PUBCHEM 004406818.mol (via Jmol)
004406829.b3lyp_6-31g(d).inp

004406829.b3lyp_6-31g(d).qchem.inp (generated)

004406829.b3lyp_6-31g(d).gjf (generated)

004406829.b3lyp_6-31g(d).firefly.inp (generated)

004406829.b3lyp_6-31g(d).smash.inp (generated)

004406829.b3lyp_6-31g(d).nwchem.inp (generated) 004406829.b3lyp_6-31g(d).log.xz 004406829.mol 004406829.PUBCHEM 004406829.mol (via Jmol)
004406849.b3lyp_6-31g(d).inp

004406849.b3lyp_6-31g(d).qchem.inp (generated)

004406849.b3lyp_6-31g(d).gjf (generated)

004406849.b3lyp_6-31g(d).firefly.inp (generated)

004406849.b3lyp_6-31g(d).smash.inp (generated)

004406849.b3lyp_6-31g(d).nwchem.inp (generated) 004406849.b3lyp_6-31g(d).log.xz 004406849.td-b3lyp_6-31g+(d).inp 004406849.td-b3lyp_6-31g+(d).log.xz

004406849.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406849.td-b3lyp_6-31+g(d).gjf (generated)

004406849.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406849.mol 004406849.PUBCHEM 004406849.mol (via Jmol)
004406916.b3lyp_6-31g(d).inp

004406916.b3lyp_6-31g(d).qchem.inp (generated)

004406916.b3lyp_6-31g(d).gjf (generated)

004406916.b3lyp_6-31g(d).firefly.inp (generated)

004406916.b3lyp_6-31g(d).smash.inp (generated)

004406916.b3lyp_6-31g(d).nwchem.inp (generated) 004406916.b3lyp_6-31g(d).log.xz 004406916.td-b3lyp_6-31g+(d).inp 004406916.td-b3lyp_6-31g+(d).log.xz

004406916.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406916.td-b3lyp_6-31+g(d).gjf (generated)

004406916.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406916.mol 004406916.PUBCHEM 004406916.mol (via Jmol)
004406926.b3lyp_6-31g(d).inp

004406926.b3lyp_6-31g(d).qchem.inp (generated)

004406926.b3lyp_6-31g(d).gjf (generated)

004406926.b3lyp_6-31g(d).firefly.inp (generated)

004406926.b3lyp_6-31g(d).smash.inp (generated)

004406926.b3lyp_6-31g(d).nwchem.inp (generated) 004406926.b3lyp_6-31g(d).log.xz 004406926.td-b3lyp_6-31g+(d).inp 004406926.td-b3lyp_6-31g+(d).log.xz

004406926.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406926.td-b3lyp_6-31+g(d).gjf (generated)

004406926.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406926.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406926.mol 004406926.PUBCHEM 004406926.mol (via Jmol)
004406979.b3lyp_6-31g(d).inp

004406979.b3lyp_6-31g(d).qchem.inp (generated)

004406979.b3lyp_6-31g(d).gjf (generated)

004406979.b3lyp_6-31g(d).firefly.inp (generated)

004406979.b3lyp_6-31g(d).smash.inp (generated)

004406979.b3lyp_6-31g(d).nwchem.inp (generated) 004406979.b3lyp_6-31g(d).log.xz 004406979.td-b3lyp_6-31g+(d).inp 004406979.td-b3lyp_6-31g+(d).log.xz

004406979.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406979.td-b3lyp_6-31+g(d).gjf (generated)

004406979.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406979.mol 004406979.PUBCHEM 004406979.mol (via Jmol)
004406998.b3lyp_6-31g(d).inp

004406998.b3lyp_6-31g(d).qchem.inp (generated)

004406998.b3lyp_6-31g(d).gjf (generated)

004406998.b3lyp_6-31g(d).firefly.inp (generated)

004406998.b3lyp_6-31g(d).smash.inp (generated)

004406998.b3lyp_6-31g(d).nwchem.inp (generated) 004406998.b3lyp_6-31g(d).log.xz 004406998.td-b3lyp_6-31g+(d).inp 004406998.td-b3lyp_6-31g+(d).log.xz

004406998.td-b3lyp_6-31+g(d).qchem.inp (generated)

004406998.td-b3lyp_6-31+g(d).gjf (generated)

004406998.td-b3lyp_6-31+g(d).firefly.inp (generated)

004406998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004406998.mol 004406998.PUBCHEM 004406998.mol (via Jmol)
004407015.b3lyp_6-31g(d).inp

004407015.b3lyp_6-31g(d).qchem.inp (generated)

004407015.b3lyp_6-31g(d).gjf (generated)

004407015.b3lyp_6-31g(d).firefly.inp (generated)

004407015.b3lyp_6-31g(d).smash.inp (generated)

004407015.b3lyp_6-31g(d).nwchem.inp (generated) 004407015.b3lyp_6-31g(d).log.xz 004407015.td-b3lyp_6-31g+(d).inp 004407015.td-b3lyp_6-31g+(d).log.xz

004407015.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407015.td-b3lyp_6-31+g(d).gjf (generated)

004407015.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407015.mol 004407015.PUBCHEM 004407015.mol (via Jmol)
004407075.b3lyp_6-31g(d).inp

004407075.b3lyp_6-31g(d).qchem.inp (generated)

004407075.b3lyp_6-31g(d).gjf (generated)

004407075.b3lyp_6-31g(d).firefly.inp (generated)

004407075.b3lyp_6-31g(d).smash.inp (generated)

004407075.b3lyp_6-31g(d).nwchem.inp (generated) 004407075.b3lyp_6-31g(d).log.xz 004407075.mol 004407075.PUBCHEM 004407075.mol (via Jmol)
004407093.b3lyp_6-31g(d).inp

004407093.b3lyp_6-31g(d).qchem.inp (generated)

004407093.b3lyp_6-31g(d).gjf (generated)

004407093.b3lyp_6-31g(d).firefly.inp (generated)

004407093.b3lyp_6-31g(d).smash.inp (generated)

004407093.b3lyp_6-31g(d).nwchem.inp (generated) 004407093.b3lyp_6-31g(d).log.xz 004407093.td-b3lyp_6-31g+(d).inp 004407093.td-b3lyp_6-31g+(d).log.xz

004407093.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407093.td-b3lyp_6-31+g(d).gjf (generated)

004407093.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407093.mol 004407093.PUBCHEM 004407093.mol (via Jmol)
004407135.b3lyp_6-31g(d).inp

004407135.b3lyp_6-31g(d).qchem.inp (generated)

004407135.b3lyp_6-31g(d).gjf (generated)

004407135.b3lyp_6-31g(d).firefly.inp (generated)

004407135.b3lyp_6-31g(d).smash.inp (generated)

004407135.b3lyp_6-31g(d).nwchem.inp (generated) 004407135.b3lyp_6-31g(d).log.xz 004407135.td-b3lyp_6-31g+(d).inp 004407135.td-b3lyp_6-31g+(d).log.xz

004407135.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407135.td-b3lyp_6-31+g(d).gjf (generated)

004407135.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407135.mol 004407135.PUBCHEM 004407135.mol (via Jmol)
004407258.b3lyp_6-31g(d).inp

004407258.b3lyp_6-31g(d).qchem.inp (generated)

004407258.b3lyp_6-31g(d).gjf (generated)

004407258.b3lyp_6-31g(d).firefly.inp (generated)

004407258.b3lyp_6-31g(d).smash.inp (generated)

004407258.b3lyp_6-31g(d).nwchem.inp (generated) 004407258.b3lyp_6-31g(d).log.xz 004407258.td-b3lyp_6-31g+(d).inp 004407258.td-b3lyp_6-31g+(d).log.xz

004407258.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407258.td-b3lyp_6-31+g(d).gjf (generated)

004407258.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407258.mol 004407258.PUBCHEM 004407258.mol (via Jmol)
004407264.b3lyp_6-31g(d).inp

004407264.b3lyp_6-31g(d).qchem.inp (generated)

004407264.b3lyp_6-31g(d).gjf (generated)

004407264.b3lyp_6-31g(d).firefly.inp (generated)

004407264.b3lyp_6-31g(d).smash.inp (generated)

004407264.b3lyp_6-31g(d).nwchem.inp (generated) 004407264.b3lyp_6-31g(d).log.xz 004407264.td-b3lyp_6-31g+(d).inp 004407264.td-b3lyp_6-31g+(d).log.xz

004407264.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407264.td-b3lyp_6-31+g(d).gjf (generated)

004407264.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407264.mol 004407264.PUBCHEM 004407264.mol (via Jmol)
004407270.b3lyp_6-31g(d).inp

004407270.b3lyp_6-31g(d).qchem.inp (generated)

004407270.b3lyp_6-31g(d).gjf (generated)

004407270.b3lyp_6-31g(d).firefly.inp (generated)

004407270.b3lyp_6-31g(d).smash.inp (generated)

004407270.b3lyp_6-31g(d).nwchem.inp (generated) 004407270.b3lyp_6-31g(d).log.xz 004407270.mol 004407270.PUBCHEM 004407270.mol (via Jmol)
004407271.b3lyp_6-31g(d).inp

004407271.b3lyp_6-31g(d).qchem.inp (generated)

004407271.b3lyp_6-31g(d).gjf (generated)

004407271.b3lyp_6-31g(d).firefly.inp (generated)

004407271.b3lyp_6-31g(d).smash.inp (generated)

004407271.b3lyp_6-31g(d).nwchem.inp (generated) 004407271.b3lyp_6-31g(d).log.xz 004407271.td-b3lyp_6-31g+(d).inp 004407271.td-b3lyp_6-31g+(d).log.xz

004407271.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407271.td-b3lyp_6-31+g(d).gjf (generated)

004407271.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407271.mol 004407271.PUBCHEM 004407271.mol (via Jmol)
004407323.b3lyp_6-31g(d).inp

004407323.b3lyp_6-31g(d).qchem.inp (generated)

004407323.b3lyp_6-31g(d).gjf (generated)

004407323.b3lyp_6-31g(d).firefly.inp (generated)

004407323.b3lyp_6-31g(d).smash.inp (generated)

004407323.b3lyp_6-31g(d).nwchem.inp (generated) 004407323.b3lyp_6-31g(d).log.xz 004407323.td-b3lyp_6-31g+(d).inp 004407323.td-b3lyp_6-31g+(d).log.xz

004407323.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407323.td-b3lyp_6-31+g(d).gjf (generated)

004407323.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407323.mol 004407323.PUBCHEM 004407323.mol (via Jmol)
004407333.b3lyp_6-31g(d).inp

004407333.b3lyp_6-31g(d).qchem.inp (generated)

004407333.b3lyp_6-31g(d).gjf (generated)

004407333.b3lyp_6-31g(d).firefly.inp (generated)

004407333.b3lyp_6-31g(d).smash.inp (generated)

004407333.b3lyp_6-31g(d).nwchem.inp (generated) 004407333.b3lyp_6-31g(d).log.xz 004407333.td-b3lyp_6-31g+(d).inp 004407333.td-b3lyp_6-31g+(d).log.xz

004407333.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407333.td-b3lyp_6-31+g(d).gjf (generated)

004407333.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407333.mol 004407333.PUBCHEM 004407333.mol (via Jmol)
004407334.b3lyp_6-31g(d).inp

004407334.b3lyp_6-31g(d).qchem.inp (generated)

004407334.b3lyp_6-31g(d).gjf (generated)

004407334.b3lyp_6-31g(d).firefly.inp (generated)

004407334.b3lyp_6-31g(d).smash.inp (generated)

004407334.b3lyp_6-31g(d).nwchem.inp (generated) 004407334.b3lyp_6-31g(d).log.xz 004407334.td-b3lyp_6-31g+(d).inp 004407334.td-b3lyp_6-31g+(d).log.xz

004407334.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407334.td-b3lyp_6-31+g(d).gjf (generated)

004407334.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407334.mol 004407334.PUBCHEM 004407334.mol (via Jmol)
004407335.b3lyp_6-31g(d).inp

004407335.b3lyp_6-31g(d).qchem.inp (generated)

004407335.b3lyp_6-31g(d).gjf (generated)

004407335.b3lyp_6-31g(d).firefly.inp (generated)

004407335.b3lyp_6-31g(d).smash.inp (generated)

004407335.b3lyp_6-31g(d).nwchem.inp (generated) 004407335.b3lyp_6-31g(d).log.xz 004407335.mol 004407335.PUBCHEM 004407335.mol (via Jmol)
004407365.b3lyp_6-31g(d).inp

004407365.b3lyp_6-31g(d).qchem.inp (generated)

004407365.b3lyp_6-31g(d).gjf (generated)

004407365.b3lyp_6-31g(d).firefly.inp (generated)

004407365.b3lyp_6-31g(d).smash.inp (generated)

004407365.b3lyp_6-31g(d).nwchem.inp (generated) 004407365.b3lyp_6-31g(d).log.xz 004407365.td-b3lyp_6-31g+(d).inp 004407365.td-b3lyp_6-31g+(d).log.xz

004407365.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407365.td-b3lyp_6-31+g(d).gjf (generated)

004407365.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407365.mol 004407365.PUBCHEM 004407365.mol (via Jmol)
004407383.b3lyp_6-31g(d).inp

004407383.b3lyp_6-31g(d).qchem.inp (generated)

004407383.b3lyp_6-31g(d).gjf (generated)

004407383.b3lyp_6-31g(d).firefly.inp (generated)

004407383.b3lyp_6-31g(d).smash.inp (generated)

004407383.b3lyp_6-31g(d).nwchem.inp (generated) 004407383.b3lyp_6-31g(d).log.xz 004407383.td-b3lyp_6-31g+(d).inp 004407383.td-b3lyp_6-31g+(d).log.xz

004407383.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407383.td-b3lyp_6-31+g(d).gjf (generated)

004407383.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407383.mol 004407383.PUBCHEM 004407383.mol (via Jmol)
004407420.b3lyp_6-31g(d).inp

004407420.b3lyp_6-31g(d).qchem.inp (generated)

004407420.b3lyp_6-31g(d).gjf (generated)

004407420.b3lyp_6-31g(d).firefly.inp (generated)

004407420.b3lyp_6-31g(d).smash.inp (generated)

004407420.b3lyp_6-31g(d).nwchem.inp (generated) 004407420.b3lyp_6-31g(d).log.xz 004407420.mol 004407420.PUBCHEM 004407420.mol (via Jmol)
004407434.b3lyp_6-31g(d).inp

004407434.b3lyp_6-31g(d).qchem.inp (generated)

004407434.b3lyp_6-31g(d).gjf (generated)

004407434.b3lyp_6-31g(d).firefly.inp (generated)

004407434.b3lyp_6-31g(d).smash.inp (generated)

004407434.b3lyp_6-31g(d).nwchem.inp (generated) 004407434.b3lyp_6-31g(d).log.xz 004407434.mol 004407434.PUBCHEM 004407434.mol (via Jmol)
004407464.b3lyp_6-31g(d).inp

004407464.b3lyp_6-31g(d).qchem.inp (generated)

004407464.b3lyp_6-31g(d).gjf (generated)

004407464.b3lyp_6-31g(d).firefly.inp (generated)

004407464.b3lyp_6-31g(d).smash.inp (generated)

004407464.b3lyp_6-31g(d).nwchem.inp (generated) 004407464.b3lyp_6-31g(d).log.xz 004407464.td-b3lyp_6-31g+(d).inp 004407464.td-b3lyp_6-31g+(d).log.xz

004407464.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407464.td-b3lyp_6-31+g(d).gjf (generated)

004407464.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407464.mol 004407464.PUBCHEM 004407464.mol (via Jmol)
004407465.b3lyp_6-31g(d).inp

004407465.b3lyp_6-31g(d).qchem.inp (generated)

004407465.b3lyp_6-31g(d).gjf (generated)

004407465.b3lyp_6-31g(d).firefly.inp (generated)

004407465.b3lyp_6-31g(d).smash.inp (generated)

004407465.b3lyp_6-31g(d).nwchem.inp (generated) 004407465.b3lyp_6-31g(d).log.xz 004407465.td-b3lyp_6-31g+(d).inp 004407465.td-b3lyp_6-31g+(d).log.xz

004407465.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407465.td-b3lyp_6-31+g(d).gjf (generated)

004407465.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407465.mol 004407465.PUBCHEM 004407465.mol (via Jmol)
004407476.b3lyp_6-31g(d).inp

004407476.b3lyp_6-31g(d).qchem.inp (generated)

004407476.b3lyp_6-31g(d).gjf (generated)

004407476.b3lyp_6-31g(d).firefly.inp (generated)

004407476.b3lyp_6-31g(d).smash.inp (generated)

004407476.b3lyp_6-31g(d).nwchem.inp (generated) 004407476.b3lyp_6-31g(d).log.xz 004407476.td-b3lyp_6-31g+(d).inp 004407476.td-b3lyp_6-31g+(d).log.xz

004407476.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407476.td-b3lyp_6-31+g(d).gjf (generated)

004407476.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407476.mol 004407476.PUBCHEM 004407476.mol (via Jmol)
004407544.b3lyp_6-31g(d).inp

004407544.b3lyp_6-31g(d).qchem.inp (generated)

004407544.b3lyp_6-31g(d).gjf (generated)

004407544.b3lyp_6-31g(d).firefly.inp (generated)

004407544.b3lyp_6-31g(d).smash.inp (generated)

004407544.b3lyp_6-31g(d).nwchem.inp (generated) 004407544.b3lyp_6-31g(d).log.xz 004407544.td-b3lyp_6-31g+(d).inp 004407544.td-b3lyp_6-31g+(d).log.xz

004407544.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407544.td-b3lyp_6-31+g(d).gjf (generated)

004407544.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407544.mol 004407544.PUBCHEM 004407544.mol (via Jmol)
004407545.b3lyp_6-31g(d).inp

004407545.b3lyp_6-31g(d).qchem.inp (generated)

004407545.b3lyp_6-31g(d).gjf (generated)

004407545.b3lyp_6-31g(d).firefly.inp (generated)

004407545.b3lyp_6-31g(d).smash.inp (generated)

004407545.b3lyp_6-31g(d).nwchem.inp (generated) 004407545.b3lyp_6-31g(d).log.xz 004407545.mol 004407545.PUBCHEM 004407545.mol (via Jmol)
004407573.b3lyp_6-31g(d).inp

004407573.b3lyp_6-31g(d).qchem.inp (generated)

004407573.b3lyp_6-31g(d).gjf (generated)

004407573.b3lyp_6-31g(d).firefly.inp (generated)

004407573.b3lyp_6-31g(d).smash.inp (generated)

004407573.b3lyp_6-31g(d).nwchem.inp (generated) 004407573.b3lyp_6-31g(d).log.xz 004407573.td-b3lyp_6-31g+(d).inp 004407573.td-b3lyp_6-31g+(d).log.xz

004407573.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407573.td-b3lyp_6-31+g(d).gjf (generated)

004407573.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407573.mol 004407573.PUBCHEM 004407573.mol (via Jmol)
004407581.b3lyp_6-31g(d).inp

004407581.b3lyp_6-31g(d).qchem.inp (generated)

004407581.b3lyp_6-31g(d).gjf (generated)

004407581.b3lyp_6-31g(d).firefly.inp (generated)

004407581.b3lyp_6-31g(d).smash.inp (generated)

004407581.b3lyp_6-31g(d).nwchem.inp (generated) 004407581.b3lyp_6-31g(d).log.xz 004407581.mol 004407581.PUBCHEM 004407581.mol (via Jmol)
004407661.b3lyp_6-31g(d).inp

004407661.b3lyp_6-31g(d).qchem.inp (generated)

004407661.b3lyp_6-31g(d).gjf (generated)

004407661.b3lyp_6-31g(d).firefly.inp (generated)

004407661.b3lyp_6-31g(d).smash.inp (generated)

004407661.b3lyp_6-31g(d).nwchem.inp (generated) 004407661.b3lyp_6-31g(d).log.xz 004407661.mol 004407661.PUBCHEM 004407661.mol (via Jmol)
004407677.b3lyp_6-31g(d).inp

004407677.b3lyp_6-31g(d).qchem.inp (generated)

004407677.b3lyp_6-31g(d).gjf (generated)

004407677.b3lyp_6-31g(d).firefly.inp (generated)

004407677.b3lyp_6-31g(d).smash.inp (generated)

004407677.b3lyp_6-31g(d).nwchem.inp (generated) 004407677.b3lyp_6-31g(d).log.xz 004407677.mol 004407677.PUBCHEM 004407677.mol (via Jmol)
004407684.b3lyp_6-31g(d).inp

004407684.b3lyp_6-31g(d).qchem.inp (generated)

004407684.b3lyp_6-31g(d).gjf (generated)

004407684.b3lyp_6-31g(d).firefly.inp (generated)

004407684.b3lyp_6-31g(d).smash.inp (generated)

004407684.b3lyp_6-31g(d).nwchem.inp (generated) 004407684.b3lyp_6-31g(d).log.xz 004407684.td-b3lyp_6-31g+(d).inp 004407684.td-b3lyp_6-31g+(d).log.xz

004407684.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407684.td-b3lyp_6-31+g(d).gjf (generated)

004407684.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407684.mol 004407684.PUBCHEM 004407684.mol (via Jmol)
004407701.b3lyp_6-31g(d).inp

004407701.b3lyp_6-31g(d).qchem.inp (generated)

004407701.b3lyp_6-31g(d).gjf (generated)

004407701.b3lyp_6-31g(d).firefly.inp (generated)

004407701.b3lyp_6-31g(d).smash.inp (generated)

004407701.b3lyp_6-31g(d).nwchem.inp (generated) 004407701.b3lyp_6-31g(d).log.xz 004407701.td-b3lyp_6-31g+(d).inp 004407701.td-b3lyp_6-31g+(d).log.xz

004407701.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407701.td-b3lyp_6-31+g(d).gjf (generated)

004407701.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407701.mol 004407701.PUBCHEM 004407701.mol (via Jmol)
004407702.b3lyp_6-31g(d).inp

004407702.b3lyp_6-31g(d).qchem.inp (generated)

004407702.b3lyp_6-31g(d).gjf (generated)

004407702.b3lyp_6-31g(d).firefly.inp (generated)

004407702.b3lyp_6-31g(d).smash.inp (generated)

004407702.b3lyp_6-31g(d).nwchem.inp (generated) 004407702.b3lyp_6-31g(d).log.xz 004407702.td-b3lyp_6-31g+(d).inp 004407702.td-b3lyp_6-31g+(d).log.xz

004407702.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407702.td-b3lyp_6-31+g(d).gjf (generated)

004407702.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407702.mol 004407702.PUBCHEM 004407702.mol (via Jmol)
004407731.b3lyp_6-31g(d).inp

004407731.b3lyp_6-31g(d).qchem.inp (generated)

004407731.b3lyp_6-31g(d).gjf (generated)

004407731.b3lyp_6-31g(d).firefly.inp (generated)

004407731.b3lyp_6-31g(d).smash.inp (generated)

004407731.b3lyp_6-31g(d).nwchem.inp (generated) 004407731.b3lyp_6-31g(d).log.xz 004407731.td-b3lyp_6-31g+(d).inp 004407731.td-b3lyp_6-31g+(d).log.xz

004407731.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407731.td-b3lyp_6-31+g(d).gjf (generated)

004407731.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407731.mol 004407731.PUBCHEM 004407731.mol (via Jmol)
004407756.b3lyp_6-31g(d).inp

004407756.b3lyp_6-31g(d).qchem.inp (generated)

004407756.b3lyp_6-31g(d).gjf (generated)

004407756.b3lyp_6-31g(d).firefly.inp (generated)

004407756.b3lyp_6-31g(d).smash.inp (generated)

004407756.b3lyp_6-31g(d).nwchem.inp (generated) 004407756.b3lyp_6-31g(d).log.xz 004407756.td-b3lyp_6-31g+(d).inp 004407756.td-b3lyp_6-31g+(d).log.xz

004407756.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407756.td-b3lyp_6-31+g(d).gjf (generated)

004407756.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407756.mol 004407756.PUBCHEM 004407756.mol (via Jmol)
004407791.b3lyp_6-31g(d).inp

004407791.b3lyp_6-31g(d).qchem.inp (generated)

004407791.b3lyp_6-31g(d).gjf (generated)

004407791.b3lyp_6-31g(d).firefly.inp (generated)

004407791.b3lyp_6-31g(d).smash.inp (generated)

004407791.b3lyp_6-31g(d).nwchem.inp (generated) 004407791.b3lyp_6-31g(d).log.xz 004407791.mol 004407791.PUBCHEM 004407791.mol (via Jmol)
004407805.b3lyp_6-31g(d).inp

004407805.b3lyp_6-31g(d).qchem.inp (generated)

004407805.b3lyp_6-31g(d).gjf (generated)

004407805.b3lyp_6-31g(d).firefly.inp (generated)

004407805.b3lyp_6-31g(d).smash.inp (generated)

004407805.b3lyp_6-31g(d).nwchem.inp (generated) 004407805.b3lyp_6-31g(d).log.xz 004407805.td-b3lyp_6-31g+(d).inp 004407805.td-b3lyp_6-31g+(d).log.xz

004407805.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407805.td-b3lyp_6-31+g(d).gjf (generated)

004407805.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407805.mol 004407805.PUBCHEM 004407805.mol (via Jmol)
004407824.b3lyp_6-31g(d).inp

004407824.b3lyp_6-31g(d).qchem.inp (generated)

004407824.b3lyp_6-31g(d).gjf (generated)

004407824.b3lyp_6-31g(d).firefly.inp (generated)

004407824.b3lyp_6-31g(d).smash.inp (generated)

004407824.b3lyp_6-31g(d).nwchem.inp (generated) 004407824.b3lyp_6-31g(d).log.xz 004407824.td-b3lyp_6-31g+(d).inp 004407824.td-b3lyp_6-31g+(d).log.xz

004407824.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407824.td-b3lyp_6-31+g(d).gjf (generated)

004407824.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407824.mol 004407824.PUBCHEM 004407824.mol (via Jmol)
004407867.b3lyp_6-31g(d).inp

004407867.b3lyp_6-31g(d).qchem.inp (generated)

004407867.b3lyp_6-31g(d).gjf (generated)

004407867.b3lyp_6-31g(d).firefly.inp (generated)

004407867.b3lyp_6-31g(d).smash.inp (generated)

004407867.b3lyp_6-31g(d).nwchem.inp (generated) 004407867.b3lyp_6-31g(d).log.xz 004407867.td-b3lyp_6-31g+(d).inp 004407867.td-b3lyp_6-31g+(d).log.xz

004407867.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407867.td-b3lyp_6-31+g(d).gjf (generated)

004407867.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407867.mol 004407867.PUBCHEM 004407867.mol (via Jmol)
004407908.b3lyp_6-31g(d).inp

004407908.b3lyp_6-31g(d).qchem.inp (generated)

004407908.b3lyp_6-31g(d).gjf (generated)

004407908.b3lyp_6-31g(d).firefly.inp (generated)

004407908.b3lyp_6-31g(d).smash.inp (generated)

004407908.b3lyp_6-31g(d).nwchem.inp (generated) 004407908.b3lyp_6-31g(d).log.xz 004407908.td-b3lyp_6-31g+(d).inp 004407908.td-b3lyp_6-31g+(d).log.xz

004407908.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407908.td-b3lyp_6-31+g(d).gjf (generated)

004407908.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407908.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407908.mol 004407908.PUBCHEM 004407908.mol (via Jmol)
004407968.b3lyp_6-31g(d).inp

004407968.b3lyp_6-31g(d).qchem.inp (generated)

004407968.b3lyp_6-31g(d).gjf (generated)

004407968.b3lyp_6-31g(d).firefly.inp (generated)

004407968.b3lyp_6-31g(d).smash.inp (generated)

004407968.b3lyp_6-31g(d).nwchem.inp (generated) 004407968.b3lyp_6-31g(d).log.xz 004407968.td-b3lyp_6-31g+(d).inp 004407968.td-b3lyp_6-31g+(d).log.xz

004407968.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407968.td-b3lyp_6-31+g(d).gjf (generated)

004407968.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407968.mol 004407968.PUBCHEM 004407968.mol (via Jmol)
004407982.b3lyp_6-31g(d).inp

004407982.b3lyp_6-31g(d).qchem.inp (generated)

004407982.b3lyp_6-31g(d).gjf (generated)

004407982.b3lyp_6-31g(d).firefly.inp (generated)

004407982.b3lyp_6-31g(d).smash.inp (generated)

004407982.b3lyp_6-31g(d).nwchem.inp (generated) 004407982.b3lyp_6-31g(d).log.xz 004407982.td-b3lyp_6-31g+(d).inp 004407982.td-b3lyp_6-31g+(d).log.xz

004407982.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407982.td-b3lyp_6-31+g(d).gjf (generated)

004407982.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407982.mol 004407982.PUBCHEM 004407982.mol (via Jmol)
004407995.b3lyp_6-31g(d).inp

004407995.b3lyp_6-31g(d).qchem.inp (generated)

004407995.b3lyp_6-31g(d).gjf (generated)

004407995.b3lyp_6-31g(d).firefly.inp (generated)

004407995.b3lyp_6-31g(d).smash.inp (generated)

004407995.b3lyp_6-31g(d).nwchem.inp (generated) 004407995.b3lyp_6-31g(d).log.xz 004407995.td-b3lyp_6-31g+(d).inp 004407995.td-b3lyp_6-31g+(d).log.xz

004407995.td-b3lyp_6-31+g(d).qchem.inp (generated)

004407995.td-b3lyp_6-31+g(d).gjf (generated)

004407995.td-b3lyp_6-31+g(d).firefly.inp (generated)

004407995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004407995.mol 004407995.PUBCHEM 004407995.mol (via Jmol)
004408062.b3lyp_6-31g(d).inp

004408062.b3lyp_6-31g(d).qchem.inp (generated)

004408062.b3lyp_6-31g(d).gjf (generated)

004408062.b3lyp_6-31g(d).firefly.inp (generated)

004408062.b3lyp_6-31g(d).smash.inp (generated)

004408062.b3lyp_6-31g(d).nwchem.inp (generated) 004408062.b3lyp_6-31g(d).log.xz 004408062.td-b3lyp_6-31g+(d).inp 004408062.td-b3lyp_6-31g+(d).log.xz

004408062.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408062.td-b3lyp_6-31+g(d).gjf (generated)

004408062.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408062.mol 004408062.PUBCHEM 004408062.mol (via Jmol)
004408140.b3lyp_6-31g(d).inp

004408140.b3lyp_6-31g(d).qchem.inp (generated)

004408140.b3lyp_6-31g(d).gjf (generated)

004408140.b3lyp_6-31g(d).firefly.inp (generated)

004408140.b3lyp_6-31g(d).smash.inp (generated)

004408140.b3lyp_6-31g(d).nwchem.inp (generated) 004408140.b3lyp_6-31g(d).log.xz 004408140.td-b3lyp_6-31g+(d).inp 004408140.td-b3lyp_6-31g+(d).log.xz

004408140.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408140.td-b3lyp_6-31+g(d).gjf (generated)

004408140.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408140.mol 004408140.PUBCHEM 004408140.mol (via Jmol)
004408170.b3lyp_6-31g(d).inp

004408170.b3lyp_6-31g(d).qchem.inp (generated)

004408170.b3lyp_6-31g(d).gjf (generated)

004408170.b3lyp_6-31g(d).firefly.inp (generated)

004408170.b3lyp_6-31g(d).smash.inp (generated)

004408170.b3lyp_6-31g(d).nwchem.inp (generated) 004408170.b3lyp_6-31g(d).log.xz 004408170.td-b3lyp_6-31g+(d).inp 004408170.td-b3lyp_6-31g+(d).log.xz

004408170.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408170.td-b3lyp_6-31+g(d).gjf (generated)

004408170.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408170.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408170.mol 004408170.PUBCHEM 004408170.mol (via Jmol)
004408229.b3lyp_6-31g(d).inp

004408229.b3lyp_6-31g(d).qchem.inp (generated)

004408229.b3lyp_6-31g(d).gjf (generated)

004408229.b3lyp_6-31g(d).firefly.inp (generated)

004408229.b3lyp_6-31g(d).smash.inp (generated)

004408229.b3lyp_6-31g(d).nwchem.inp (generated) 004408229.b3lyp_6-31g(d).log.xz 004408229.td-b3lyp_6-31g+(d).inp 004408229.td-b3lyp_6-31g+(d).log.xz

004408229.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408229.td-b3lyp_6-31+g(d).gjf (generated)

004408229.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408229.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408229.mol 004408229.PUBCHEM 004408229.mol (via Jmol)
004408257.b3lyp_6-31g(d).inp

004408257.b3lyp_6-31g(d).qchem.inp (generated)

004408257.b3lyp_6-31g(d).gjf (generated)

004408257.b3lyp_6-31g(d).firefly.inp (generated)

004408257.b3lyp_6-31g(d).smash.inp (generated)

004408257.b3lyp_6-31g(d).nwchem.inp (generated) 004408257.b3lyp_6-31g(d).log.xz 004408257.td-b3lyp_6-31g+(d).inp 004408257.td-b3lyp_6-31g+(d).log.xz

004408257.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408257.td-b3lyp_6-31+g(d).gjf (generated)

004408257.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408257.mol 004408257.PUBCHEM 004408257.mol (via Jmol)
004408426.b3lyp_6-31g(d).inp

004408426.b3lyp_6-31g(d).qchem.inp (generated)

004408426.b3lyp_6-31g(d).gjf (generated)

004408426.b3lyp_6-31g(d).firefly.inp (generated)

004408426.b3lyp_6-31g(d).smash.inp (generated)

004408426.b3lyp_6-31g(d).nwchem.inp (generated) 004408426.b3lyp_6-31g(d).log.xz 004408426.td-b3lyp_6-31g+(d).inp 004408426.td-b3lyp_6-31g+(d).log.xz

004408426.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408426.td-b3lyp_6-31+g(d).gjf (generated)

004408426.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408426.mol 004408426.PUBCHEM 004408426.mol (via Jmol)
004408457.b3lyp_6-31g(d).inp

004408457.b3lyp_6-31g(d).qchem.inp (generated)

004408457.b3lyp_6-31g(d).gjf (generated)

004408457.b3lyp_6-31g(d).firefly.inp (generated)

004408457.b3lyp_6-31g(d).smash.inp (generated)

004408457.b3lyp_6-31g(d).nwchem.inp (generated) 004408457.b3lyp_6-31g(d).log.xz 004408457.td-b3lyp_6-31g+(d).inp 004408457.td-b3lyp_6-31g+(d).log.xz

004408457.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408457.td-b3lyp_6-31+g(d).gjf (generated)

004408457.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408457.mol 004408457.PUBCHEM 004408457.mol (via Jmol)
004408459.b3lyp_6-31g(d).inp

004408459.b3lyp_6-31g(d).qchem.inp (generated)

004408459.b3lyp_6-31g(d).gjf (generated)

004408459.b3lyp_6-31g(d).firefly.inp (generated)

004408459.b3lyp_6-31g(d).smash.inp (generated)

004408459.b3lyp_6-31g(d).nwchem.inp (generated) 004408459.b3lyp_6-31g(d).log.xz 004408459.td-b3lyp_6-31g+(d).inp 004408459.td-b3lyp_6-31g+(d).log.xz

004408459.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408459.td-b3lyp_6-31+g(d).gjf (generated)

004408459.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408459.mol 004408459.PUBCHEM 004408459.mol (via Jmol)
004408460.b3lyp_6-31g(d).inp

004408460.b3lyp_6-31g(d).qchem.inp (generated)

004408460.b3lyp_6-31g(d).gjf (generated)

004408460.b3lyp_6-31g(d).firefly.inp (generated)

004408460.b3lyp_6-31g(d).smash.inp (generated)

004408460.b3lyp_6-31g(d).nwchem.inp (generated) 004408460.b3lyp_6-31g(d).log.xz 004408460.mol 004408460.PUBCHEM 004408460.mol (via Jmol)
004408515.b3lyp_6-31g(d).inp

004408515.b3lyp_6-31g(d).qchem.inp (generated)

004408515.b3lyp_6-31g(d).gjf (generated)

004408515.b3lyp_6-31g(d).firefly.inp (generated)

004408515.b3lyp_6-31g(d).smash.inp (generated)

004408515.b3lyp_6-31g(d).nwchem.inp (generated) 004408515.b3lyp_6-31g(d).log.xz 004408515.td-b3lyp_6-31g+(d).inp 004408515.td-b3lyp_6-31g+(d).log.xz

004408515.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408515.td-b3lyp_6-31+g(d).gjf (generated)

004408515.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408515.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408515.mol 004408515.PUBCHEM 004408515.mol (via Jmol)
004408548.b3lyp_6-31g(d).inp

004408548.b3lyp_6-31g(d).qchem.inp (generated)

004408548.b3lyp_6-31g(d).gjf (generated)

004408548.b3lyp_6-31g(d).firefly.inp (generated)

004408548.b3lyp_6-31g(d).smash.inp (generated)

004408548.b3lyp_6-31g(d).nwchem.inp (generated) 004408548.b3lyp_6-31g(d).log.xz 004408548.td-b3lyp_6-31g+(d).inp 004408548.td-b3lyp_6-31g+(d).log.xz

004408548.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408548.td-b3lyp_6-31+g(d).gjf (generated)

004408548.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408548.mol 004408548.PUBCHEM 004408548.mol (via Jmol)
004408624.b3lyp_6-31g(d).inp

004408624.b3lyp_6-31g(d).qchem.inp (generated)

004408624.b3lyp_6-31g(d).gjf (generated)

004408624.b3lyp_6-31g(d).firefly.inp (generated)

004408624.b3lyp_6-31g(d).smash.inp (generated)

004408624.b3lyp_6-31g(d).nwchem.inp (generated) 004408624.b3lyp_6-31g(d).log.xz 004408624.mol 004408624.PUBCHEM 004408624.mol (via Jmol)
004408686.b3lyp_6-31g(d).inp

004408686.b3lyp_6-31g(d).qchem.inp (generated)

004408686.b3lyp_6-31g(d).gjf (generated)

004408686.b3lyp_6-31g(d).firefly.inp (generated)

004408686.b3lyp_6-31g(d).smash.inp (generated)

004408686.b3lyp_6-31g(d).nwchem.inp (generated) 004408686.b3lyp_6-31g(d).log.xz 004408686.td-b3lyp_6-31g+(d).inp 004408686.td-b3lyp_6-31g+(d).log.xz

004408686.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408686.td-b3lyp_6-31+g(d).gjf (generated)

004408686.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408686.mol 004408686.PUBCHEM 004408686.mol (via Jmol)
004408913.b3lyp_6-31g(d).inp

004408913.b3lyp_6-31g(d).qchem.inp (generated)

004408913.b3lyp_6-31g(d).gjf (generated)

004408913.b3lyp_6-31g(d).firefly.inp (generated)

004408913.b3lyp_6-31g(d).smash.inp (generated)

004408913.b3lyp_6-31g(d).nwchem.inp (generated) 004408913.b3lyp_6-31g(d).log.xz 004408913.td-b3lyp_6-31g+(d).inp 004408913.td-b3lyp_6-31g+(d).log.xz

004408913.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408913.td-b3lyp_6-31+g(d).gjf (generated)

004408913.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408913.mol 004408913.PUBCHEM 004408913.mol (via Jmol)
004408952.b3lyp_6-31g(d).inp

004408952.b3lyp_6-31g(d).qchem.inp (generated)

004408952.b3lyp_6-31g(d).gjf (generated)

004408952.b3lyp_6-31g(d).firefly.inp (generated)

004408952.b3lyp_6-31g(d).smash.inp (generated)

004408952.b3lyp_6-31g(d).nwchem.inp (generated) 004408952.b3lyp_6-31g(d).log.xz 004408952.td-b3lyp_6-31g+(d).inp 004408952.td-b3lyp_6-31g+(d).log.xz

004408952.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408952.td-b3lyp_6-31+g(d).gjf (generated)

004408952.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408952.mol 004408952.PUBCHEM 004408952.mol (via Jmol)
004408969.b3lyp_6-31g(d).inp

004408969.b3lyp_6-31g(d).qchem.inp (generated)

004408969.b3lyp_6-31g(d).gjf (generated)

004408969.b3lyp_6-31g(d).firefly.inp (generated)

004408969.b3lyp_6-31g(d).smash.inp (generated)

004408969.b3lyp_6-31g(d).nwchem.inp (generated) 004408969.b3lyp_6-31g(d).log.xz 004408969.td-b3lyp_6-31g+(d).inp 004408969.td-b3lyp_6-31g+(d).log.xz

004408969.td-b3lyp_6-31+g(d).qchem.inp (generated)

004408969.td-b3lyp_6-31+g(d).gjf (generated)

004408969.td-b3lyp_6-31+g(d).firefly.inp (generated)

004408969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004408969.mol 004408969.PUBCHEM 004408969.mol (via Jmol)
004409048.b3lyp_6-31g(d).inp

004409048.b3lyp_6-31g(d).qchem.inp (generated)

004409048.b3lyp_6-31g(d).gjf (generated)

004409048.b3lyp_6-31g(d).firefly.inp (generated)

004409048.b3lyp_6-31g(d).smash.inp (generated)

004409048.b3lyp_6-31g(d).nwchem.inp (generated) 004409048.b3lyp_6-31g(d).log.xz 004409048.td-b3lyp_6-31g+(d).inp 004409048.td-b3lyp_6-31g+(d).log.xz

004409048.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409048.td-b3lyp_6-31+g(d).gjf (generated)

004409048.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409048.mol 004409048.PUBCHEM 004409048.mol (via Jmol)
004409071.b3lyp_6-31g(d).inp

004409071.b3lyp_6-31g(d).qchem.inp (generated)

004409071.b3lyp_6-31g(d).gjf (generated)

004409071.b3lyp_6-31g(d).firefly.inp (generated)

004409071.b3lyp_6-31g(d).smash.inp (generated)

004409071.b3lyp_6-31g(d).nwchem.inp (generated) 004409071.b3lyp_6-31g(d).log.xz 004409071.td-b3lyp_6-31g+(d).inp 004409071.td-b3lyp_6-31g+(d).log.xz

004409071.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409071.td-b3lyp_6-31+g(d).gjf (generated)

004409071.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409071.mol 004409071.PUBCHEM 004409071.mol (via Jmol)
004409074.b3lyp_6-31g(d).inp

004409074.b3lyp_6-31g(d).qchem.inp (generated)

004409074.b3lyp_6-31g(d).gjf (generated)

004409074.b3lyp_6-31g(d).firefly.inp (generated)

004409074.b3lyp_6-31g(d).smash.inp (generated)

004409074.b3lyp_6-31g(d).nwchem.inp (generated) 004409074.b3lyp_6-31g(d).log.xz 004409074.mol 004409074.PUBCHEM 004409074.mol (via Jmol)
004409173.b3lyp_6-31g(d).inp

004409173.b3lyp_6-31g(d).qchem.inp (generated)

004409173.b3lyp_6-31g(d).gjf (generated)

004409173.b3lyp_6-31g(d).firefly.inp (generated)

004409173.b3lyp_6-31g(d).smash.inp (generated)

004409173.b3lyp_6-31g(d).nwchem.inp (generated) 004409173.b3lyp_6-31g(d).log.xz 004409173.td-b3lyp_6-31g+(d).inp 004409173.td-b3lyp_6-31g+(d).log.xz

004409173.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409173.td-b3lyp_6-31+g(d).gjf (generated)

004409173.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409173.mol 004409173.PUBCHEM 004409173.mol (via Jmol)
004409226.b3lyp_6-31g(d).inp

004409226.b3lyp_6-31g(d).qchem.inp (generated)

004409226.b3lyp_6-31g(d).gjf (generated)

004409226.b3lyp_6-31g(d).firefly.inp (generated)

004409226.b3lyp_6-31g(d).smash.inp (generated)

004409226.b3lyp_6-31g(d).nwchem.inp (generated) 004409226.b3lyp_6-31g(d).log.xz 004409226.td-b3lyp_6-31g+(d).inp 004409226.td-b3lyp_6-31g+(d).log.xz

004409226.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409226.td-b3lyp_6-31+g(d).gjf (generated)

004409226.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409226.mol 004409226.PUBCHEM 004409226.mol (via Jmol)
004409231.b3lyp_6-31g(d).inp

004409231.b3lyp_6-31g(d).qchem.inp (generated)

004409231.b3lyp_6-31g(d).gjf (generated)

004409231.b3lyp_6-31g(d).firefly.inp (generated)

004409231.b3lyp_6-31g(d).smash.inp (generated)

004409231.b3lyp_6-31g(d).nwchem.inp (generated) 004409231.b3lyp_6-31g(d).log.xz 004409231.td-b3lyp_6-31g+(d).inp 004409231.td-b3lyp_6-31g+(d).log.xz

004409231.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409231.td-b3lyp_6-31+g(d).gjf (generated)

004409231.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409231.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409231.mol 004409231.PUBCHEM 004409231.mol (via Jmol)
004409233.b3lyp_6-31g(d).inp

004409233.b3lyp_6-31g(d).qchem.inp (generated)

004409233.b3lyp_6-31g(d).gjf (generated)

004409233.b3lyp_6-31g(d).firefly.inp (generated)

004409233.b3lyp_6-31g(d).smash.inp (generated)

004409233.b3lyp_6-31g(d).nwchem.inp (generated) 004409233.b3lyp_6-31g(d).log.xz 004409233.td-b3lyp_6-31g+(d).inp 004409233.td-b3lyp_6-31g+(d).log.xz

004409233.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409233.td-b3lyp_6-31+g(d).gjf (generated)

004409233.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409233.mol 004409233.PUBCHEM 004409233.mol (via Jmol)
004409384.b3lyp_6-31g(d).inp

004409384.b3lyp_6-31g(d).qchem.inp (generated)

004409384.b3lyp_6-31g(d).gjf (generated)

004409384.b3lyp_6-31g(d).firefly.inp (generated)

004409384.b3lyp_6-31g(d).smash.inp (generated)

004409384.b3lyp_6-31g(d).nwchem.inp (generated) 004409384.b3lyp_6-31g(d).log.xz 004409384.td-b3lyp_6-31g+(d).inp 004409384.td-b3lyp_6-31g+(d).log.xz

004409384.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409384.td-b3lyp_6-31+g(d).gjf (generated)

004409384.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409384.mol 004409384.PUBCHEM 004409384.mol (via Jmol)
004409450.b3lyp_6-31g(d).inp

004409450.b3lyp_6-31g(d).qchem.inp (generated)

004409450.b3lyp_6-31g(d).gjf (generated)

004409450.b3lyp_6-31g(d).firefly.inp (generated)

004409450.b3lyp_6-31g(d).smash.inp (generated)

004409450.b3lyp_6-31g(d).nwchem.inp (generated) 004409450.b3lyp_6-31g(d).log.xz 004409450.mol 004409450.PUBCHEM 004409450.mol (via Jmol)
004409465.b3lyp_6-31g(d).inp

004409465.b3lyp_6-31g(d).qchem.inp (generated)

004409465.b3lyp_6-31g(d).gjf (generated)

004409465.b3lyp_6-31g(d).firefly.inp (generated)

004409465.b3lyp_6-31g(d).smash.inp (generated)

004409465.b3lyp_6-31g(d).nwchem.inp (generated) 004409465.b3lyp_6-31g(d).log.xz 004409465.td-b3lyp_6-31g+(d).inp 004409465.td-b3lyp_6-31g+(d).log.xz

004409465.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409465.td-b3lyp_6-31+g(d).gjf (generated)

004409465.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409465.mol 004409465.PUBCHEM 004409465.mol (via Jmol)
004409470.b3lyp_6-31g(d).inp

004409470.b3lyp_6-31g(d).qchem.inp (generated)

004409470.b3lyp_6-31g(d).gjf (generated)

004409470.b3lyp_6-31g(d).firefly.inp (generated)

004409470.b3lyp_6-31g(d).smash.inp (generated)

004409470.b3lyp_6-31g(d).nwchem.inp (generated) 004409470.b3lyp_6-31g(d).log.xz 004409470.td-b3lyp_6-31g+(d).inp 004409470.td-b3lyp_6-31g+(d).log.xz

004409470.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409470.td-b3lyp_6-31+g(d).gjf (generated)

004409470.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409470.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409470.mol 004409470.PUBCHEM 004409470.mol (via Jmol)
004409477.b3lyp_6-31g(d).inp

004409477.b3lyp_6-31g(d).qchem.inp (generated)

004409477.b3lyp_6-31g(d).gjf (generated)

004409477.b3lyp_6-31g(d).firefly.inp (generated)

004409477.b3lyp_6-31g(d).smash.inp (generated)

004409477.b3lyp_6-31g(d).nwchem.inp (generated) 004409477.b3lyp_6-31g(d).log.xz 004409477.td-b3lyp_6-31g+(d).inp 004409477.td-b3lyp_6-31g+(d).log.xz

004409477.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409477.td-b3lyp_6-31+g(d).gjf (generated)

004409477.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409477.mol 004409477.PUBCHEM 004409477.mol (via Jmol)
004409487.b3lyp_6-31g(d).inp

004409487.b3lyp_6-31g(d).qchem.inp (generated)

004409487.b3lyp_6-31g(d).gjf (generated)

004409487.b3lyp_6-31g(d).firefly.inp (generated)

004409487.b3lyp_6-31g(d).smash.inp (generated)

004409487.b3lyp_6-31g(d).nwchem.inp (generated) 004409487.b3lyp_6-31g(d).log.xz 004409487.mol 004409487.PUBCHEM 004409487.mol (via Jmol)
004409503.b3lyp_6-31g(d).inp

004409503.b3lyp_6-31g(d).qchem.inp (generated)

004409503.b3lyp_6-31g(d).gjf (generated)

004409503.b3lyp_6-31g(d).firefly.inp (generated)

004409503.b3lyp_6-31g(d).smash.inp (generated)

004409503.b3lyp_6-31g(d).nwchem.inp (generated) 004409503.b3lyp_6-31g(d).log.xz 004409503.td-b3lyp_6-31g+(d).inp 004409503.td-b3lyp_6-31g+(d).log.xz

004409503.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409503.td-b3lyp_6-31+g(d).gjf (generated)

004409503.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409503.mol 004409503.PUBCHEM 004409503.mol (via Jmol)
004409677.b3lyp_6-31g(d).inp

004409677.b3lyp_6-31g(d).qchem.inp (generated)

004409677.b3lyp_6-31g(d).gjf (generated)

004409677.b3lyp_6-31g(d).firefly.inp (generated)

004409677.b3lyp_6-31g(d).smash.inp (generated)

004409677.b3lyp_6-31g(d).nwchem.inp (generated) 004409677.b3lyp_6-31g(d).log.xz 004409677.td-b3lyp_6-31g+(d).inp 004409677.td-b3lyp_6-31g+(d).log.xz

004409677.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409677.td-b3lyp_6-31+g(d).gjf (generated)

004409677.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409677.mol 004409677.PUBCHEM 004409677.mol (via Jmol)
004409704.b3lyp_6-31g(d).inp

004409704.b3lyp_6-31g(d).qchem.inp (generated)

004409704.b3lyp_6-31g(d).gjf (generated)

004409704.b3lyp_6-31g(d).firefly.inp (generated)

004409704.b3lyp_6-31g(d).smash.inp (generated)

004409704.b3lyp_6-31g(d).nwchem.inp (generated) 004409704.b3lyp_6-31g(d).log.xz 004409704.td-b3lyp_6-31g+(d).inp 004409704.td-b3lyp_6-31g+(d).log.xz

004409704.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409704.td-b3lyp_6-31+g(d).gjf (generated)

004409704.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409704.mol 004409704.PUBCHEM 004409704.mol (via Jmol)
004409709.b3lyp_6-31g(d).inp

004409709.b3lyp_6-31g(d).qchem.inp (generated)

004409709.b3lyp_6-31g(d).gjf (generated)

004409709.b3lyp_6-31g(d).firefly.inp (generated)

004409709.b3lyp_6-31g(d).smash.inp (generated)

004409709.b3lyp_6-31g(d).nwchem.inp (generated) 004409709.b3lyp_6-31g(d).log.xz 004409709.td-b3lyp_6-31g+(d).inp 004409709.td-b3lyp_6-31g+(d).log.xz

004409709.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409709.td-b3lyp_6-31+g(d).gjf (generated)

004409709.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409709.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409709.mol 004409709.PUBCHEM 004409709.mol (via Jmol)
004409723.b3lyp_6-31g(d).inp

004409723.b3lyp_6-31g(d).qchem.inp (generated)

004409723.b3lyp_6-31g(d).gjf (generated)

004409723.b3lyp_6-31g(d).firefly.inp (generated)

004409723.b3lyp_6-31g(d).smash.inp (generated)

004409723.b3lyp_6-31g(d).nwchem.inp (generated) 004409723.b3lyp_6-31g(d).log.xz 004409723.td-b3lyp_6-31g+(d).inp 004409723.td-b3lyp_6-31g+(d).log.xz

004409723.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409723.td-b3lyp_6-31+g(d).gjf (generated)

004409723.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409723.mol 004409723.PUBCHEM 004409723.mol (via Jmol)
004409748.b3lyp_6-31g(d).inp

004409748.b3lyp_6-31g(d).qchem.inp (generated)

004409748.b3lyp_6-31g(d).gjf (generated)

004409748.b3lyp_6-31g(d).firefly.inp (generated)

004409748.b3lyp_6-31g(d).smash.inp (generated)

004409748.b3lyp_6-31g(d).nwchem.inp (generated) 004409748.b3lyp_6-31g(d).log.xz 004409748.td-b3lyp_6-31g+(d).inp 004409748.td-b3lyp_6-31g+(d).log.xz

004409748.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409748.td-b3lyp_6-31+g(d).gjf (generated)

004409748.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409748.mol 004409748.PUBCHEM 004409748.mol (via Jmol)
004409751.b3lyp_6-31g(d).inp

004409751.b3lyp_6-31g(d).qchem.inp (generated)

004409751.b3lyp_6-31g(d).gjf (generated)

004409751.b3lyp_6-31g(d).firefly.inp (generated)

004409751.b3lyp_6-31g(d).smash.inp (generated)

004409751.b3lyp_6-31g(d).nwchem.inp (generated) 004409751.b3lyp_6-31g(d).log.xz 004409751.td-b3lyp_6-31g+(d).inp 004409751.td-b3lyp_6-31g+(d).log.xz

004409751.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409751.td-b3lyp_6-31+g(d).gjf (generated)

004409751.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409751.mol 004409751.PUBCHEM 004409751.mol (via Jmol)
004409778.b3lyp_6-31g(d).inp

004409778.b3lyp_6-31g(d).qchem.inp (generated)

004409778.b3lyp_6-31g(d).gjf (generated)

004409778.b3lyp_6-31g(d).firefly.inp (generated)

004409778.b3lyp_6-31g(d).smash.inp (generated)

004409778.b3lyp_6-31g(d).nwchem.inp (generated) 004409778.b3lyp_6-31g(d).log.xz 004409778.td-b3lyp_6-31g+(d).inp 004409778.td-b3lyp_6-31g+(d).log.xz

004409778.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409778.td-b3lyp_6-31+g(d).gjf (generated)

004409778.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409778.mol 004409778.PUBCHEM 004409778.mol (via Jmol)
004409781.b3lyp_6-31g(d).inp

004409781.b3lyp_6-31g(d).qchem.inp (generated)

004409781.b3lyp_6-31g(d).gjf (generated)

004409781.b3lyp_6-31g(d).firefly.inp (generated)

004409781.b3lyp_6-31g(d).smash.inp (generated)

004409781.b3lyp_6-31g(d).nwchem.inp (generated) 004409781.b3lyp_6-31g(d).log.xz 004409781.td-b3lyp_6-31g+(d).inp 004409781.td-b3lyp_6-31g+(d).log.xz

004409781.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409781.td-b3lyp_6-31+g(d).gjf (generated)

004409781.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409781.mol 004409781.PUBCHEM 004409781.mol (via Jmol)
004409787.b3lyp_6-31g(d).inp

004409787.b3lyp_6-31g(d).qchem.inp (generated)

004409787.b3lyp_6-31g(d).gjf (generated)

004409787.b3lyp_6-31g(d).firefly.inp (generated)

004409787.b3lyp_6-31g(d).smash.inp (generated)

004409787.b3lyp_6-31g(d).nwchem.inp (generated) 004409787.b3lyp_6-31g(d).log.xz 004409787.td-b3lyp_6-31g+(d).inp 004409787.td-b3lyp_6-31g+(d).log.xz

004409787.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409787.td-b3lyp_6-31+g(d).gjf (generated)

004409787.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409787.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409787.mol 004409787.PUBCHEM 004409787.mol (via Jmol)
004409820.b3lyp_6-31g(d).inp

004409820.b3lyp_6-31g(d).qchem.inp (generated)

004409820.b3lyp_6-31g(d).gjf (generated)

004409820.b3lyp_6-31g(d).firefly.inp (generated)

004409820.b3lyp_6-31g(d).smash.inp (generated)

004409820.b3lyp_6-31g(d).nwchem.inp (generated) 004409820.b3lyp_6-31g(d).log.xz 004409820.td-b3lyp_6-31g+(d).inp 004409820.td-b3lyp_6-31g+(d).log.xz

004409820.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409820.td-b3lyp_6-31+g(d).gjf (generated)

004409820.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409820.mol 004409820.PUBCHEM 004409820.mol (via Jmol)
004409825.b3lyp_6-31g(d).inp

004409825.b3lyp_6-31g(d).qchem.inp (generated)

004409825.b3lyp_6-31g(d).gjf (generated)

004409825.b3lyp_6-31g(d).firefly.inp (generated)

004409825.b3lyp_6-31g(d).smash.inp (generated)

004409825.b3lyp_6-31g(d).nwchem.inp (generated) 004409825.b3lyp_6-31g(d).log.xz 004409825.td-b3lyp_6-31g+(d).inp 004409825.td-b3lyp_6-31g+(d).log.xz

004409825.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409825.td-b3lyp_6-31+g(d).gjf (generated)

004409825.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409825.mol 004409825.PUBCHEM 004409825.mol (via Jmol)
004409827.b3lyp_6-31g(d).inp

004409827.b3lyp_6-31g(d).qchem.inp (generated)

004409827.b3lyp_6-31g(d).gjf (generated)

004409827.b3lyp_6-31g(d).firefly.inp (generated)

004409827.b3lyp_6-31g(d).smash.inp (generated)

004409827.b3lyp_6-31g(d).nwchem.inp (generated) 004409827.b3lyp_6-31g(d).log.xz 004409827.td-b3lyp_6-31g+(d).inp 004409827.td-b3lyp_6-31g+(d).log.xz

004409827.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409827.td-b3lyp_6-31+g(d).gjf (generated)

004409827.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409827.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409827.mol 004409827.PUBCHEM 004409827.mol (via Jmol)
004409936.b3lyp_6-31g(d).inp

004409936.b3lyp_6-31g(d).qchem.inp (generated)

004409936.b3lyp_6-31g(d).gjf (generated)

004409936.b3lyp_6-31g(d).firefly.inp (generated)

004409936.b3lyp_6-31g(d).smash.inp (generated)

004409936.b3lyp_6-31g(d).nwchem.inp (generated) 004409936.b3lyp_6-31g(d).log.xz 004409936.td-b3lyp_6-31g+(d).inp 004409936.td-b3lyp_6-31g+(d).log.xz

004409936.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409936.td-b3lyp_6-31+g(d).gjf (generated)

004409936.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409936.mol 004409936.PUBCHEM 004409936.mol (via Jmol)
004409943.b3lyp_6-31g(d).inp

004409943.b3lyp_6-31g(d).qchem.inp (generated)

004409943.b3lyp_6-31g(d).gjf (generated)

004409943.b3lyp_6-31g(d).firefly.inp (generated)

004409943.b3lyp_6-31g(d).smash.inp (generated)

004409943.b3lyp_6-31g(d).nwchem.inp (generated) 004409943.b3lyp_6-31g(d).log.xz 004409943.td-b3lyp_6-31g+(d).inp 004409943.td-b3lyp_6-31g+(d).log.xz

004409943.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409943.td-b3lyp_6-31+g(d).gjf (generated)

004409943.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409943.mol 004409943.PUBCHEM 004409943.mol (via Jmol)
004409966.b3lyp_6-31g(d).inp

004409966.b3lyp_6-31g(d).qchem.inp (generated)

004409966.b3lyp_6-31g(d).gjf (generated)

004409966.b3lyp_6-31g(d).firefly.inp (generated)

004409966.b3lyp_6-31g(d).smash.inp (generated)

004409966.b3lyp_6-31g(d).nwchem.inp (generated) 004409966.b3lyp_6-31g(d).log.xz 004409966.mol 004409966.PUBCHEM 004409966.mol (via Jmol)
004409971.b3lyp_6-31g(d).inp

004409971.b3lyp_6-31g(d).qchem.inp (generated)

004409971.b3lyp_6-31g(d).gjf (generated)

004409971.b3lyp_6-31g(d).firefly.inp (generated)

004409971.b3lyp_6-31g(d).smash.inp (generated)

004409971.b3lyp_6-31g(d).nwchem.inp (generated) 004409971.b3lyp_6-31g(d).log.xz 004409971.td-b3lyp_6-31g+(d).inp 004409971.td-b3lyp_6-31g+(d).log.xz

004409971.td-b3lyp_6-31+g(d).qchem.inp (generated)

004409971.td-b3lyp_6-31+g(d).gjf (generated)

004409971.td-b3lyp_6-31+g(d).firefly.inp (generated)

004409971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004409971.mol 004409971.PUBCHEM 004409971.mol (via Jmol)
004410025.b3lyp_6-31g(d).inp

004410025.b3lyp_6-31g(d).qchem.inp (generated)

004410025.b3lyp_6-31g(d).gjf (generated)

004410025.b3lyp_6-31g(d).firefly.inp (generated)

004410025.b3lyp_6-31g(d).smash.inp (generated)

004410025.b3lyp_6-31g(d).nwchem.inp (generated) 004410025.b3lyp_6-31g(d).log.xz 004410025.td-b3lyp_6-31g+(d).inp 004410025.td-b3lyp_6-31g+(d).log.xz

004410025.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410025.td-b3lyp_6-31+g(d).gjf (generated)

004410025.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410025.mol 004410025.PUBCHEM 004410025.mol (via Jmol)
004410040.b3lyp_6-31g(d).inp

004410040.b3lyp_6-31g(d).qchem.inp (generated)

004410040.b3lyp_6-31g(d).gjf (generated)

004410040.b3lyp_6-31g(d).firefly.inp (generated)

004410040.b3lyp_6-31g(d).smash.inp (generated)

004410040.b3lyp_6-31g(d).nwchem.inp (generated) 004410040.b3lyp_6-31g(d).log.xz 004410040.td-b3lyp_6-31g+(d).inp 004410040.td-b3lyp_6-31g+(d).log.xz

004410040.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410040.td-b3lyp_6-31+g(d).gjf (generated)

004410040.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410040.mol 004410040.PUBCHEM 004410040.mol (via Jmol)
004410041.b3lyp_6-31g(d).inp

004410041.b3lyp_6-31g(d).qchem.inp (generated)

004410041.b3lyp_6-31g(d).gjf (generated)

004410041.b3lyp_6-31g(d).firefly.inp (generated)

004410041.b3lyp_6-31g(d).smash.inp (generated)

004410041.b3lyp_6-31g(d).nwchem.inp (generated) 004410041.b3lyp_6-31g(d).log.xz 004410041.td-b3lyp_6-31g+(d).inp 004410041.td-b3lyp_6-31g+(d).log.xz

004410041.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410041.td-b3lyp_6-31+g(d).gjf (generated)

004410041.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410041.mol 004410041.PUBCHEM 004410041.mol (via Jmol)
004410045.b3lyp_6-31g(d).inp

004410045.b3lyp_6-31g(d).qchem.inp (generated)

004410045.b3lyp_6-31g(d).gjf (generated)

004410045.b3lyp_6-31g(d).firefly.inp (generated)

004410045.b3lyp_6-31g(d).smash.inp (generated)

004410045.b3lyp_6-31g(d).nwchem.inp (generated) 004410045.b3lyp_6-31g(d).log.xz 004410045.td-b3lyp_6-31g+(d).inp 004410045.td-b3lyp_6-31g+(d).log.xz

004410045.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410045.td-b3lyp_6-31+g(d).gjf (generated)

004410045.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410045.mol 004410045.PUBCHEM 004410045.mol (via Jmol)
004410071.b3lyp_6-31g(d).inp

004410071.b3lyp_6-31g(d).qchem.inp (generated)

004410071.b3lyp_6-31g(d).gjf (generated)

004410071.b3lyp_6-31g(d).firefly.inp (generated)

004410071.b3lyp_6-31g(d).smash.inp (generated)

004410071.b3lyp_6-31g(d).nwchem.inp (generated) 004410071.b3lyp_6-31g(d).log.xz 004410071.td-b3lyp_6-31g+(d).inp 004410071.td-b3lyp_6-31g+(d).log.xz

004410071.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410071.td-b3lyp_6-31+g(d).gjf (generated)

004410071.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410071.mol 004410071.PUBCHEM 004410071.mol (via Jmol)
004410093.b3lyp_6-31g(d).inp

004410093.b3lyp_6-31g(d).qchem.inp (generated)

004410093.b3lyp_6-31g(d).gjf (generated)

004410093.b3lyp_6-31g(d).firefly.inp (generated)

004410093.b3lyp_6-31g(d).smash.inp (generated)

004410093.b3lyp_6-31g(d).nwchem.inp (generated) 004410093.b3lyp_6-31g(d).log.xz 004410093.td-b3lyp_6-31g+(d).inp 004410093.td-b3lyp_6-31g+(d).log.xz

004410093.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410093.td-b3lyp_6-31+g(d).gjf (generated)

004410093.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410093.mol 004410093.PUBCHEM 004410093.mol (via Jmol)
004410182.b3lyp_6-31g(d).inp

004410182.b3lyp_6-31g(d).qchem.inp (generated)

004410182.b3lyp_6-31g(d).gjf (generated)

004410182.b3lyp_6-31g(d).firefly.inp (generated)

004410182.b3lyp_6-31g(d).smash.inp (generated)

004410182.b3lyp_6-31g(d).nwchem.inp (generated) 004410182.b3lyp_6-31g(d).log.xz 004410182.td-b3lyp_6-31g+(d).inp 004410182.td-b3lyp_6-31g+(d).log.xz

004410182.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410182.td-b3lyp_6-31+g(d).gjf (generated)

004410182.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410182.mol 004410182.PUBCHEM 004410182.mol (via Jmol)
004410190.b3lyp_6-31g(d).inp

004410190.b3lyp_6-31g(d).qchem.inp (generated)

004410190.b3lyp_6-31g(d).gjf (generated)

004410190.b3lyp_6-31g(d).firefly.inp (generated)

004410190.b3lyp_6-31g(d).smash.inp (generated)

004410190.b3lyp_6-31g(d).nwchem.inp (generated) 004410190.b3lyp_6-31g(d).log.xz 004410190.td-b3lyp_6-31g+(d).inp 004410190.td-b3lyp_6-31g+(d).log.xz

004410190.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410190.td-b3lyp_6-31+g(d).gjf (generated)

004410190.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410190.mol 004410190.PUBCHEM 004410190.mol (via Jmol)
004410233.b3lyp_6-31g(d).inp

004410233.b3lyp_6-31g(d).qchem.inp (generated)

004410233.b3lyp_6-31g(d).gjf (generated)

004410233.b3lyp_6-31g(d).firefly.inp (generated)

004410233.b3lyp_6-31g(d).smash.inp (generated)

004410233.b3lyp_6-31g(d).nwchem.inp (generated) 004410233.b3lyp_6-31g(d).log.xz 004410233.mol 004410233.PUBCHEM 004410233.mol (via Jmol)
004410234.b3lyp_6-31g(d).inp

004410234.b3lyp_6-31g(d).qchem.inp (generated)

004410234.b3lyp_6-31g(d).gjf (generated)

004410234.b3lyp_6-31g(d).firefly.inp (generated)

004410234.b3lyp_6-31g(d).smash.inp (generated)

004410234.b3lyp_6-31g(d).nwchem.inp (generated) 004410234.b3lyp_6-31g(d).log.xz 004410234.td-b3lyp_6-31g+(d).inp 004410234.td-b3lyp_6-31g+(d).log.xz

004410234.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410234.td-b3lyp_6-31+g(d).gjf (generated)

004410234.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410234.mol 004410234.PUBCHEM 004410234.mol (via Jmol)
004410304.b3lyp_6-31g(d).inp

004410304.b3lyp_6-31g(d).qchem.inp (generated)

004410304.b3lyp_6-31g(d).gjf (generated)

004410304.b3lyp_6-31g(d).firefly.inp (generated)

004410304.b3lyp_6-31g(d).smash.inp (generated)

004410304.b3lyp_6-31g(d).nwchem.inp (generated) 004410304.b3lyp_6-31g(d).log.xz 004410304.td-b3lyp_6-31g+(d).inp 004410304.td-b3lyp_6-31g+(d).log.xz

004410304.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410304.td-b3lyp_6-31+g(d).gjf (generated)

004410304.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410304.mol 004410304.PUBCHEM 004410304.mol (via Jmol)
004410306.b3lyp_6-31g(d).inp

004410306.b3lyp_6-31g(d).qchem.inp (generated)

004410306.b3lyp_6-31g(d).gjf (generated)

004410306.b3lyp_6-31g(d).firefly.inp (generated)

004410306.b3lyp_6-31g(d).smash.inp (generated)

004410306.b3lyp_6-31g(d).nwchem.inp (generated) 004410306.b3lyp_6-31g(d).log.xz 004410306.td-b3lyp_6-31g+(d).inp 004410306.td-b3lyp_6-31g+(d).log.xz

004410306.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410306.td-b3lyp_6-31+g(d).gjf (generated)

004410306.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410306.mol 004410306.PUBCHEM 004410306.mol (via Jmol)
004410310.b3lyp_6-31g(d).inp

004410310.b3lyp_6-31g(d).qchem.inp (generated)

004410310.b3lyp_6-31g(d).gjf (generated)

004410310.b3lyp_6-31g(d).firefly.inp (generated)

004410310.b3lyp_6-31g(d).smash.inp (generated)

004410310.b3lyp_6-31g(d).nwchem.inp (generated) 004410310.b3lyp_6-31g(d).log.xz 004410310.td-b3lyp_6-31g+(d).inp 004410310.td-b3lyp_6-31g+(d).log.xz

004410310.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410310.td-b3lyp_6-31+g(d).gjf (generated)

004410310.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410310.mol 004410310.PUBCHEM 004410310.mol (via Jmol)
004410312.b3lyp_6-31g(d).inp

004410312.b3lyp_6-31g(d).qchem.inp (generated)

004410312.b3lyp_6-31g(d).gjf (generated)

004410312.b3lyp_6-31g(d).firefly.inp (generated)

004410312.b3lyp_6-31g(d).smash.inp (generated)

004410312.b3lyp_6-31g(d).nwchem.inp (generated) 004410312.b3lyp_6-31g(d).log.xz 004410312.td-b3lyp_6-31g+(d).inp 004410312.td-b3lyp_6-31g+(d).log.xz

004410312.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410312.td-b3lyp_6-31+g(d).gjf (generated)

004410312.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410312.mol 004410312.PUBCHEM 004410312.mol (via Jmol)
004410377.b3lyp_6-31g(d).inp

004410377.b3lyp_6-31g(d).qchem.inp (generated)

004410377.b3lyp_6-31g(d).gjf (generated)

004410377.b3lyp_6-31g(d).firefly.inp (generated)

004410377.b3lyp_6-31g(d).smash.inp (generated)

004410377.b3lyp_6-31g(d).nwchem.inp (generated) 004410377.b3lyp_6-31g(d).log.xz 004410377.td-b3lyp_6-31g+(d).inp 004410377.td-b3lyp_6-31g+(d).log.xz

004410377.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410377.td-b3lyp_6-31+g(d).gjf (generated)

004410377.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410377.mol 004410377.PUBCHEM 004410377.mol (via Jmol)
004410393.b3lyp_6-31g(d).inp

004410393.b3lyp_6-31g(d).qchem.inp (generated)

004410393.b3lyp_6-31g(d).gjf (generated)

004410393.b3lyp_6-31g(d).firefly.inp (generated)

004410393.b3lyp_6-31g(d).smash.inp (generated)

004410393.b3lyp_6-31g(d).nwchem.inp (generated) 004410393.b3lyp_6-31g(d).log.xz 004410393.td-b3lyp_6-31g+(d).inp 004410393.td-b3lyp_6-31g+(d).log.xz

004410393.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410393.td-b3lyp_6-31+g(d).gjf (generated)

004410393.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410393.mol 004410393.PUBCHEM 004410393.mol (via Jmol)
004410552.b3lyp_6-31g(d).inp

004410552.b3lyp_6-31g(d).qchem.inp (generated)

004410552.b3lyp_6-31g(d).gjf (generated)

004410552.b3lyp_6-31g(d).firefly.inp (generated)

004410552.b3lyp_6-31g(d).smash.inp (generated)

004410552.b3lyp_6-31g(d).nwchem.inp (generated) 004410552.b3lyp_6-31g(d).log.xz 004410552.td-b3lyp_6-31g+(d).inp 004410552.td-b3lyp_6-31g+(d).log.xz

004410552.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410552.td-b3lyp_6-31+g(d).gjf (generated)

004410552.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410552.mol 004410552.PUBCHEM 004410552.mol (via Jmol)
004410578.b3lyp_6-31g(d).inp

004410578.b3lyp_6-31g(d).qchem.inp (generated)

004410578.b3lyp_6-31g(d).gjf (generated)

004410578.b3lyp_6-31g(d).firefly.inp (generated)

004410578.b3lyp_6-31g(d).smash.inp (generated)

004410578.b3lyp_6-31g(d).nwchem.inp (generated) 004410578.b3lyp_6-31g(d).log.xz 004410578.td-b3lyp_6-31g+(d).inp 004410578.td-b3lyp_6-31g+(d).log.xz

004410578.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410578.td-b3lyp_6-31+g(d).gjf (generated)

004410578.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410578.mol 004410578.PUBCHEM 004410578.mol (via Jmol)
004410651.b3lyp_6-31g(d).inp

004410651.b3lyp_6-31g(d).qchem.inp (generated)

004410651.b3lyp_6-31g(d).gjf (generated)

004410651.b3lyp_6-31g(d).firefly.inp (generated)

004410651.b3lyp_6-31g(d).smash.inp (generated)

004410651.b3lyp_6-31g(d).nwchem.inp (generated) 004410651.b3lyp_6-31g(d).log.xz 004410651.mol 004410651.PUBCHEM 004410651.mol (via Jmol)
004410676.b3lyp_6-31g(d).inp

004410676.b3lyp_6-31g(d).qchem.inp (generated)

004410676.b3lyp_6-31g(d).gjf (generated)

004410676.b3lyp_6-31g(d).firefly.inp (generated)

004410676.b3lyp_6-31g(d).smash.inp (generated)

004410676.b3lyp_6-31g(d).nwchem.inp (generated) 004410676.b3lyp_6-31g(d).log.xz 004410676.td-b3lyp_6-31g+(d).inp 004410676.td-b3lyp_6-31g+(d).log.xz

004410676.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410676.td-b3lyp_6-31+g(d).gjf (generated)

004410676.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410676.mol 004410676.PUBCHEM 004410676.mol (via Jmol)
004410870.b3lyp_6-31g(d).inp

004410870.b3lyp_6-31g(d).qchem.inp (generated)

004410870.b3lyp_6-31g(d).gjf (generated)

004410870.b3lyp_6-31g(d).firefly.inp (generated)

004410870.b3lyp_6-31g(d).smash.inp (generated)

004410870.b3lyp_6-31g(d).nwchem.inp (generated) 004410870.b3lyp_6-31g(d).log.xz 004410870.td-b3lyp_6-31g+(d).inp 004410870.td-b3lyp_6-31g+(d).log.xz

004410870.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410870.td-b3lyp_6-31+g(d).gjf (generated)

004410870.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410870.mol 004410870.PUBCHEM 004410870.mol (via Jmol)
004410878.b3lyp_6-31g(d).inp

004410878.b3lyp_6-31g(d).qchem.inp (generated)

004410878.b3lyp_6-31g(d).gjf (generated)

004410878.b3lyp_6-31g(d).firefly.inp (generated)

004410878.b3lyp_6-31g(d).smash.inp (generated)

004410878.b3lyp_6-31g(d).nwchem.inp (generated) 004410878.b3lyp_6-31g(d).log.xz 004410878.td-b3lyp_6-31g+(d).inp 004410878.td-b3lyp_6-31g+(d).log.xz

004410878.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410878.td-b3lyp_6-31+g(d).gjf (generated)

004410878.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410878.mol 004410878.PUBCHEM 004410878.mol (via Jmol)
004410882.b3lyp_6-31g(d).inp

004410882.b3lyp_6-31g(d).qchem.inp (generated)

004410882.b3lyp_6-31g(d).gjf (generated)

004410882.b3lyp_6-31g(d).firefly.inp (generated)

004410882.b3lyp_6-31g(d).smash.inp (generated)

004410882.b3lyp_6-31g(d).nwchem.inp (generated) 004410882.b3lyp_6-31g(d).log.xz 004410882.mol 004410882.PUBCHEM 004410882.mol (via Jmol)
004410891.b3lyp_6-31g(d).inp

004410891.b3lyp_6-31g(d).qchem.inp (generated)

004410891.b3lyp_6-31g(d).gjf (generated)

004410891.b3lyp_6-31g(d).firefly.inp (generated)

004410891.b3lyp_6-31g(d).smash.inp (generated)

004410891.b3lyp_6-31g(d).nwchem.inp (generated) 004410891.b3lyp_6-31g(d).log.xz 004410891.td-b3lyp_6-31g+(d).inp 004410891.td-b3lyp_6-31g+(d).log.xz

004410891.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410891.td-b3lyp_6-31+g(d).gjf (generated)

004410891.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410891.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410891.mol 004410891.PUBCHEM 004410891.mol (via Jmol)
004410899.b3lyp_6-31g(d).inp

004410899.b3lyp_6-31g(d).qchem.inp (generated)

004410899.b3lyp_6-31g(d).gjf (generated)

004410899.b3lyp_6-31g(d).firefly.inp (generated)

004410899.b3lyp_6-31g(d).smash.inp (generated)

004410899.b3lyp_6-31g(d).nwchem.inp (generated) 004410899.b3lyp_6-31g(d).log.xz 004410899.mol 004410899.PUBCHEM 004410899.mol (via Jmol)
004410958.b3lyp_6-31g(d).inp

004410958.b3lyp_6-31g(d).qchem.inp (generated)

004410958.b3lyp_6-31g(d).gjf (generated)

004410958.b3lyp_6-31g(d).firefly.inp (generated)

004410958.b3lyp_6-31g(d).smash.inp (generated)

004410958.b3lyp_6-31g(d).nwchem.inp (generated) 004410958.b3lyp_6-31g(d).log.xz 004410958.td-b3lyp_6-31g+(d).inp 004410958.td-b3lyp_6-31g+(d).log.xz

004410958.td-b3lyp_6-31+g(d).qchem.inp (generated)

004410958.td-b3lyp_6-31+g(d).gjf (generated)

004410958.td-b3lyp_6-31+g(d).firefly.inp (generated)

004410958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004410958.mol 004410958.PUBCHEM 004410958.mol (via Jmol)
004411027.b3lyp_6-31g(d).inp

004411027.b3lyp_6-31g(d).qchem.inp (generated)

004411027.b3lyp_6-31g(d).gjf (generated)

004411027.b3lyp_6-31g(d).firefly.inp (generated)

004411027.b3lyp_6-31g(d).smash.inp (generated)

004411027.b3lyp_6-31g(d).nwchem.inp (generated) 004411027.b3lyp_6-31g(d).log.xz 004411027.td-b3lyp_6-31g+(d).inp 004411027.td-b3lyp_6-31g+(d).log.xz

004411027.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411027.td-b3lyp_6-31+g(d).gjf (generated)

004411027.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411027.mol 004411027.PUBCHEM 004411027.mol (via Jmol)
004411079.b3lyp_6-31g(d).inp

004411079.b3lyp_6-31g(d).qchem.inp (generated)

004411079.b3lyp_6-31g(d).gjf (generated)

004411079.b3lyp_6-31g(d).firefly.inp (generated)

004411079.b3lyp_6-31g(d).smash.inp (generated)

004411079.b3lyp_6-31g(d).nwchem.inp (generated) 004411079.b3lyp_6-31g(d).log.xz 004411079.td-b3lyp_6-31g+(d).inp 004411079.td-b3lyp_6-31g+(d).log.xz

004411079.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411079.td-b3lyp_6-31+g(d).gjf (generated)

004411079.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411079.mol 004411079.PUBCHEM 004411079.mol (via Jmol)
004411183.b3lyp_6-31g(d).inp

004411183.b3lyp_6-31g(d).qchem.inp (generated)

004411183.b3lyp_6-31g(d).gjf (generated)

004411183.b3lyp_6-31g(d).firefly.inp (generated)

004411183.b3lyp_6-31g(d).smash.inp (generated)

004411183.b3lyp_6-31g(d).nwchem.inp (generated) 004411183.b3lyp_6-31g(d).log.xz 004411183.td-b3lyp_6-31g+(d).inp 004411183.td-b3lyp_6-31g+(d).log.xz

004411183.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411183.td-b3lyp_6-31+g(d).gjf (generated)

004411183.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411183.mol 004411183.PUBCHEM 004411183.mol (via Jmol)
004411239.b3lyp_6-31g(d).inp

004411239.b3lyp_6-31g(d).qchem.inp (generated)

004411239.b3lyp_6-31g(d).gjf (generated)

004411239.b3lyp_6-31g(d).firefly.inp (generated)

004411239.b3lyp_6-31g(d).smash.inp (generated)

004411239.b3lyp_6-31g(d).nwchem.inp (generated) 004411239.b3lyp_6-31g(d).log.xz 004411239.td-b3lyp_6-31g+(d).inp 004411239.td-b3lyp_6-31g+(d).log.xz

004411239.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411239.td-b3lyp_6-31+g(d).gjf (generated)

004411239.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411239.mol 004411239.PUBCHEM 004411239.mol (via Jmol)
004411314.b3lyp_6-31g(d).inp

004411314.b3lyp_6-31g(d).qchem.inp (generated)

004411314.b3lyp_6-31g(d).gjf (generated)

004411314.b3lyp_6-31g(d).firefly.inp (generated)

004411314.b3lyp_6-31g(d).smash.inp (generated)

004411314.b3lyp_6-31g(d).nwchem.inp (generated) 004411314.b3lyp_6-31g(d).log.xz 004411314.td-b3lyp_6-31g+(d).inp 004411314.td-b3lyp_6-31g+(d).log.xz

004411314.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411314.td-b3lyp_6-31+g(d).gjf (generated)

004411314.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411314.mol 004411314.PUBCHEM 004411314.mol (via Jmol)
004411497.b3lyp_6-31g(d).inp

004411497.b3lyp_6-31g(d).qchem.inp (generated)

004411497.b3lyp_6-31g(d).gjf (generated)

004411497.b3lyp_6-31g(d).firefly.inp (generated)

004411497.b3lyp_6-31g(d).smash.inp (generated)

004411497.b3lyp_6-31g(d).nwchem.inp (generated) 004411497.b3lyp_6-31g(d).log.xz 004411497.td-b3lyp_6-31g+(d).inp 004411497.td-b3lyp_6-31g+(d).log.xz

004411497.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411497.td-b3lyp_6-31+g(d).gjf (generated)

004411497.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411497.mol 004411497.PUBCHEM 004411497.mol (via Jmol)
004411533.b3lyp_6-31g(d).inp

004411533.b3lyp_6-31g(d).qchem.inp (generated)

004411533.b3lyp_6-31g(d).gjf (generated)

004411533.b3lyp_6-31g(d).firefly.inp (generated)

004411533.b3lyp_6-31g(d).smash.inp (generated)

004411533.b3lyp_6-31g(d).nwchem.inp (generated) 004411533.b3lyp_6-31g(d).log.xz 004411533.td-b3lyp_6-31g+(d).inp 004411533.td-b3lyp_6-31g+(d).log.xz

004411533.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411533.td-b3lyp_6-31+g(d).gjf (generated)

004411533.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411533.mol 004411533.PUBCHEM 004411533.mol (via Jmol)
004411600.b3lyp_6-31g(d).inp

004411600.b3lyp_6-31g(d).qchem.inp (generated)

004411600.b3lyp_6-31g(d).gjf (generated)

004411600.b3lyp_6-31g(d).firefly.inp (generated)

004411600.b3lyp_6-31g(d).smash.inp (generated)

004411600.b3lyp_6-31g(d).nwchem.inp (generated) 004411600.b3lyp_6-31g(d).log.xz 004411600.td-b3lyp_6-31g+(d).inp 004411600.td-b3lyp_6-31g+(d).log.xz

004411600.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411600.td-b3lyp_6-31+g(d).gjf (generated)

004411600.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411600.mol 004411600.PUBCHEM 004411600.mol (via Jmol)
004411611.b3lyp_6-31g(d).inp

004411611.b3lyp_6-31g(d).qchem.inp (generated)

004411611.b3lyp_6-31g(d).gjf (generated)

004411611.b3lyp_6-31g(d).firefly.inp (generated)

004411611.b3lyp_6-31g(d).smash.inp (generated)

004411611.b3lyp_6-31g(d).nwchem.inp (generated) 004411611.b3lyp_6-31g(d).log.xz 004411611.mol 004411611.PUBCHEM 004411611.mol (via Jmol)
004411661.b3lyp_6-31g(d).inp

004411661.b3lyp_6-31g(d).qchem.inp (generated)

004411661.b3lyp_6-31g(d).gjf (generated)

004411661.b3lyp_6-31g(d).firefly.inp (generated)

004411661.b3lyp_6-31g(d).smash.inp (generated)

004411661.b3lyp_6-31g(d).nwchem.inp (generated) 004411661.b3lyp_6-31g(d).log.xz 004411661.td-b3lyp_6-31g+(d).inp 004411661.td-b3lyp_6-31g+(d).log.xz

004411661.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411661.td-b3lyp_6-31+g(d).gjf (generated)

004411661.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411661.mol 004411661.PUBCHEM 004411661.mol (via Jmol)
004411662.b3lyp_6-31g(d).inp

004411662.b3lyp_6-31g(d).qchem.inp (generated)

004411662.b3lyp_6-31g(d).gjf (generated)

004411662.b3lyp_6-31g(d).firefly.inp (generated)

004411662.b3lyp_6-31g(d).smash.inp (generated)

004411662.b3lyp_6-31g(d).nwchem.inp (generated) 004411662.b3lyp_6-31g(d).log.xz 004411662.td-b3lyp_6-31g+(d).inp 004411662.td-b3lyp_6-31g+(d).log.xz

004411662.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411662.td-b3lyp_6-31+g(d).gjf (generated)

004411662.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411662.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411662.mol 004411662.PUBCHEM 004411662.mol (via Jmol)
004411702.b3lyp_6-31g(d).inp

004411702.b3lyp_6-31g(d).qchem.inp (generated)

004411702.b3lyp_6-31g(d).gjf (generated)

004411702.b3lyp_6-31g(d).firefly.inp (generated)

004411702.b3lyp_6-31g(d).smash.inp (generated)

004411702.b3lyp_6-31g(d).nwchem.inp (generated) 004411702.b3lyp_6-31g(d).log.xz 004411702.td-b3lyp_6-31g+(d).inp 004411702.td-b3lyp_6-31g+(d).log.xz

004411702.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411702.td-b3lyp_6-31+g(d).gjf (generated)

004411702.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411702.mol 004411702.PUBCHEM 004411702.mol (via Jmol)
004411739.b3lyp_6-31g(d).inp

004411739.b3lyp_6-31g(d).qchem.inp (generated)

004411739.b3lyp_6-31g(d).gjf (generated)

004411739.b3lyp_6-31g(d).firefly.inp (generated)

004411739.b3lyp_6-31g(d).smash.inp (generated)

004411739.b3lyp_6-31g(d).nwchem.inp (generated) 004411739.b3lyp_6-31g(d).log.xz 004411739.td-b3lyp_6-31g+(d).inp 004411739.td-b3lyp_6-31g+(d).log.xz

004411739.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411739.td-b3lyp_6-31+g(d).gjf (generated)

004411739.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411739.mol 004411739.PUBCHEM 004411739.mol (via Jmol)
004411882.b3lyp_6-31g(d).inp

004411882.b3lyp_6-31g(d).qchem.inp (generated)

004411882.b3lyp_6-31g(d).gjf (generated)

004411882.b3lyp_6-31g(d).firefly.inp (generated)

004411882.b3lyp_6-31g(d).smash.inp (generated)

004411882.b3lyp_6-31g(d).nwchem.inp (generated) 004411882.b3lyp_6-31g(d).log.xz 004411882.td-b3lyp_6-31g+(d).inp 004411882.td-b3lyp_6-31g+(d).log.xz

004411882.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411882.td-b3lyp_6-31+g(d).gjf (generated)

004411882.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411882.mol 004411882.PUBCHEM 004411882.mol (via Jmol)
004411897.b3lyp_6-31g(d).inp

004411897.b3lyp_6-31g(d).qchem.inp (generated)

004411897.b3lyp_6-31g(d).gjf (generated)

004411897.b3lyp_6-31g(d).firefly.inp (generated)

004411897.b3lyp_6-31g(d).smash.inp (generated)

004411897.b3lyp_6-31g(d).nwchem.inp (generated) 004411897.b3lyp_6-31g(d).log.xz 004411897.td-b3lyp_6-31g+(d).inp 004411897.td-b3lyp_6-31g+(d).log.xz

004411897.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411897.td-b3lyp_6-31+g(d).gjf (generated)

004411897.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411897.mol 004411897.PUBCHEM 004411897.mol (via Jmol)
004411898.b3lyp_6-31g(d).inp

004411898.b3lyp_6-31g(d).qchem.inp (generated)

004411898.b3lyp_6-31g(d).gjf (generated)

004411898.b3lyp_6-31g(d).firefly.inp (generated)

004411898.b3lyp_6-31g(d).smash.inp (generated)

004411898.b3lyp_6-31g(d).nwchem.inp (generated) 004411898.b3lyp_6-31g(d).log.xz 004411898.td-b3lyp_6-31g+(d).inp 004411898.td-b3lyp_6-31g+(d).log.xz

004411898.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411898.td-b3lyp_6-31+g(d).gjf (generated)

004411898.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411898.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411898.mol 004411898.PUBCHEM 004411898.mol (via Jmol)
004411949.b3lyp_6-31g(d).inp

004411949.b3lyp_6-31g(d).qchem.inp (generated)

004411949.b3lyp_6-31g(d).gjf (generated)

004411949.b3lyp_6-31g(d).firefly.inp (generated)

004411949.b3lyp_6-31g(d).smash.inp (generated)

004411949.b3lyp_6-31g(d).nwchem.inp (generated) 004411949.b3lyp_6-31g(d).log.xz 004411949.td-b3lyp_6-31g+(d).inp 004411949.td-b3lyp_6-31g+(d).log.xz

004411949.td-b3lyp_6-31+g(d).qchem.inp (generated)

004411949.td-b3lyp_6-31+g(d).gjf (generated)

004411949.td-b3lyp_6-31+g(d).firefly.inp (generated)

004411949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004411949.mol 004411949.PUBCHEM 004411949.mol (via Jmol)
004412085.b3lyp_6-31g(d).inp

004412085.b3lyp_6-31g(d).qchem.inp (generated)

004412085.b3lyp_6-31g(d).gjf (generated)

004412085.b3lyp_6-31g(d).firefly.inp (generated)

004412085.b3lyp_6-31g(d).smash.inp (generated)

004412085.b3lyp_6-31g(d).nwchem.inp (generated) 004412085.b3lyp_6-31g(d).log.xz 004412085.mol 004412085.PUBCHEM 004412085.mol (via Jmol)
004412131.b3lyp_6-31g(d).inp

004412131.b3lyp_6-31g(d).qchem.inp (generated)

004412131.b3lyp_6-31g(d).gjf (generated)

004412131.b3lyp_6-31g(d).firefly.inp (generated)

004412131.b3lyp_6-31g(d).smash.inp (generated)

004412131.b3lyp_6-31g(d).nwchem.inp (generated) 004412131.b3lyp_6-31g(d).log.xz 004412131.td-b3lyp_6-31g+(d).inp 004412131.td-b3lyp_6-31g+(d).log.xz

004412131.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412131.td-b3lyp_6-31+g(d).gjf (generated)

004412131.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412131.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412131.mol 004412131.PUBCHEM 004412131.mol (via Jmol)
004412169.b3lyp_6-31g(d).inp

004412169.b3lyp_6-31g(d).qchem.inp (generated)

004412169.b3lyp_6-31g(d).gjf (generated)

004412169.b3lyp_6-31g(d).firefly.inp (generated)

004412169.b3lyp_6-31g(d).smash.inp (generated)

004412169.b3lyp_6-31g(d).nwchem.inp (generated) 004412169.b3lyp_6-31g(d).log.xz 004412169.mol 004412169.PUBCHEM 004412169.mol (via Jmol)
004412208.b3lyp_6-31g(d).inp

004412208.b3lyp_6-31g(d).qchem.inp (generated)

004412208.b3lyp_6-31g(d).gjf (generated)

004412208.b3lyp_6-31g(d).firefly.inp (generated)

004412208.b3lyp_6-31g(d).smash.inp (generated)

004412208.b3lyp_6-31g(d).nwchem.inp (generated) 004412208.b3lyp_6-31g(d).log.xz 004412208.td-b3lyp_6-31g+(d).inp 004412208.td-b3lyp_6-31g+(d).log.xz

004412208.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412208.td-b3lyp_6-31+g(d).gjf (generated)

004412208.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412208.mol 004412208.PUBCHEM 004412208.mol (via Jmol)
004412268.b3lyp_6-31g(d).inp

004412268.b3lyp_6-31g(d).qchem.inp (generated)

004412268.b3lyp_6-31g(d).gjf (generated)

004412268.b3lyp_6-31g(d).firefly.inp (generated)

004412268.b3lyp_6-31g(d).smash.inp (generated)

004412268.b3lyp_6-31g(d).nwchem.inp (generated) 004412268.b3lyp_6-31g(d).log.xz 004412268.mol 004412268.PUBCHEM 004412268.mol (via Jmol)
004412290.b3lyp_6-31g(d).inp

004412290.b3lyp_6-31g(d).qchem.inp (generated)

004412290.b3lyp_6-31g(d).gjf (generated)

004412290.b3lyp_6-31g(d).firefly.inp (generated)

004412290.b3lyp_6-31g(d).smash.inp (generated)

004412290.b3lyp_6-31g(d).nwchem.inp (generated) 004412290.b3lyp_6-31g(d).log.xz 004412290.td-b3lyp_6-31g+(d).inp 004412290.td-b3lyp_6-31g+(d).log.xz

004412290.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412290.td-b3lyp_6-31+g(d).gjf (generated)

004412290.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412290.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412290.mol 004412290.PUBCHEM 004412290.mol (via Jmol)
004412294.b3lyp_6-31g(d).inp

004412294.b3lyp_6-31g(d).qchem.inp (generated)

004412294.b3lyp_6-31g(d).gjf (generated)

004412294.b3lyp_6-31g(d).firefly.inp (generated)

004412294.b3lyp_6-31g(d).smash.inp (generated)

004412294.b3lyp_6-31g(d).nwchem.inp (generated) 004412294.b3lyp_6-31g(d).log.xz 004412294.mol 004412294.PUBCHEM 004412294.mol (via Jmol)
004412321.b3lyp_6-31g(d).inp

004412321.b3lyp_6-31g(d).qchem.inp (generated)

004412321.b3lyp_6-31g(d).gjf (generated)

004412321.b3lyp_6-31g(d).firefly.inp (generated)

004412321.b3lyp_6-31g(d).smash.inp (generated)

004412321.b3lyp_6-31g(d).nwchem.inp (generated) 004412321.b3lyp_6-31g(d).log.xz 004412321.td-b3lyp_6-31g+(d).inp 004412321.td-b3lyp_6-31g+(d).log.xz

004412321.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412321.td-b3lyp_6-31+g(d).gjf (generated)

004412321.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412321.mol 004412321.PUBCHEM 004412321.mol (via Jmol)
004412368.b3lyp_6-31g(d).inp

004412368.b3lyp_6-31g(d).qchem.inp (generated)

004412368.b3lyp_6-31g(d).gjf (generated)

004412368.b3lyp_6-31g(d).firefly.inp (generated)

004412368.b3lyp_6-31g(d).smash.inp (generated)

004412368.b3lyp_6-31g(d).nwchem.inp (generated) 004412368.b3lyp_6-31g(d).log.xz 004412368.td-b3lyp_6-31g+(d).inp 004412368.td-b3lyp_6-31g+(d).log.xz

004412368.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412368.td-b3lyp_6-31+g(d).gjf (generated)

004412368.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412368.mol 004412368.PUBCHEM 004412368.mol (via Jmol)
004412410.b3lyp_6-31g(d).inp

004412410.b3lyp_6-31g(d).qchem.inp (generated)

004412410.b3lyp_6-31g(d).gjf (generated)

004412410.b3lyp_6-31g(d).firefly.inp (generated)

004412410.b3lyp_6-31g(d).smash.inp (generated)

004412410.b3lyp_6-31g(d).nwchem.inp (generated) 004412410.b3lyp_6-31g(d).log.xz 004412410.mol 004412410.PUBCHEM 004412410.mol (via Jmol)
004412427.b3lyp_6-31g(d).inp

004412427.b3lyp_6-31g(d).qchem.inp (generated)

004412427.b3lyp_6-31g(d).gjf (generated)

004412427.b3lyp_6-31g(d).firefly.inp (generated)

004412427.b3lyp_6-31g(d).smash.inp (generated)

004412427.b3lyp_6-31g(d).nwchem.inp (generated) 004412427.b3lyp_6-31g(d).log.xz 004412427.td-b3lyp_6-31g+(d).inp 004412427.td-b3lyp_6-31g+(d).log.xz

004412427.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412427.td-b3lyp_6-31+g(d).gjf (generated)

004412427.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412427.mol 004412427.PUBCHEM 004412427.mol (via Jmol)
004412504.b3lyp_6-31g(d).inp

004412504.b3lyp_6-31g(d).qchem.inp (generated)

004412504.b3lyp_6-31g(d).gjf (generated)

004412504.b3lyp_6-31g(d).firefly.inp (generated)

004412504.b3lyp_6-31g(d).smash.inp (generated)

004412504.b3lyp_6-31g(d).nwchem.inp (generated) 004412504.b3lyp_6-31g(d).log.xz 004412504.td-b3lyp_6-31g+(d).inp 004412504.td-b3lyp_6-31g+(d).log.xz

004412504.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412504.td-b3lyp_6-31+g(d).gjf (generated)

004412504.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412504.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412504.mol 004412504.PUBCHEM 004412504.mol (via Jmol)
004412514.b3lyp_6-31g(d).inp

004412514.b3lyp_6-31g(d).qchem.inp (generated)

004412514.b3lyp_6-31g(d).gjf (generated)

004412514.b3lyp_6-31g(d).firefly.inp (generated)

004412514.b3lyp_6-31g(d).smash.inp (generated)

004412514.b3lyp_6-31g(d).nwchem.inp (generated) 004412514.b3lyp_6-31g(d).log.xz 004412514.mol 004412514.PUBCHEM 004412514.mol (via Jmol)
004412536.b3lyp_6-31g(d).inp

004412536.b3lyp_6-31g(d).qchem.inp (generated)

004412536.b3lyp_6-31g(d).gjf (generated)

004412536.b3lyp_6-31g(d).firefly.inp (generated)

004412536.b3lyp_6-31g(d).smash.inp (generated)

004412536.b3lyp_6-31g(d).nwchem.inp (generated) 004412536.b3lyp_6-31g(d).log.xz 004412536.td-b3lyp_6-31g+(d).inp 004412536.td-b3lyp_6-31g+(d).log.xz

004412536.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412536.td-b3lyp_6-31+g(d).gjf (generated)

004412536.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412536.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412536.mol 004412536.PUBCHEM 004412536.mol (via Jmol)
004412540.b3lyp_6-31g(d).inp

004412540.b3lyp_6-31g(d).qchem.inp (generated)

004412540.b3lyp_6-31g(d).gjf (generated)

004412540.b3lyp_6-31g(d).firefly.inp (generated)

004412540.b3lyp_6-31g(d).smash.inp (generated)

004412540.b3lyp_6-31g(d).nwchem.inp (generated) 004412540.b3lyp_6-31g(d).log.xz 004412540.td-b3lyp_6-31g+(d).inp 004412540.td-b3lyp_6-31g+(d).log.xz

004412540.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412540.td-b3lyp_6-31+g(d).gjf (generated)

004412540.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412540.mol 004412540.PUBCHEM 004412540.mol (via Jmol)
004412542.b3lyp_6-31g(d).inp

004412542.b3lyp_6-31g(d).qchem.inp (generated)

004412542.b3lyp_6-31g(d).gjf (generated)

004412542.b3lyp_6-31g(d).firefly.inp (generated)

004412542.b3lyp_6-31g(d).smash.inp (generated)

004412542.b3lyp_6-31g(d).nwchem.inp (generated) 004412542.b3lyp_6-31g(d).log.xz 004412542.td-b3lyp_6-31g+(d).inp 004412542.td-b3lyp_6-31g+(d).log.xz

004412542.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412542.td-b3lyp_6-31+g(d).gjf (generated)

004412542.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412542.mol 004412542.PUBCHEM 004412542.mol (via Jmol)
004412564.b3lyp_6-31g(d).inp

004412564.b3lyp_6-31g(d).qchem.inp (generated)

004412564.b3lyp_6-31g(d).gjf (generated)

004412564.b3lyp_6-31g(d).firefly.inp (generated)

004412564.b3lyp_6-31g(d).smash.inp (generated)

004412564.b3lyp_6-31g(d).nwchem.inp (generated) 004412564.b3lyp_6-31g(d).log.xz 004412564.td-b3lyp_6-31g+(d).inp 004412564.td-b3lyp_6-31g+(d).log.xz

004412564.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412564.td-b3lyp_6-31+g(d).gjf (generated)

004412564.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412564.mol 004412564.PUBCHEM 004412564.mol (via Jmol)
004412573.b3lyp_6-31g(d).inp

004412573.b3lyp_6-31g(d).qchem.inp (generated)

004412573.b3lyp_6-31g(d).gjf (generated)

004412573.b3lyp_6-31g(d).firefly.inp (generated)

004412573.b3lyp_6-31g(d).smash.inp (generated)

004412573.b3lyp_6-31g(d).nwchem.inp (generated) 004412573.b3lyp_6-31g(d).log.xz 004412573.mol 004412573.PUBCHEM 004412573.mol (via Jmol)
004412583.b3lyp_6-31g(d).inp

004412583.b3lyp_6-31g(d).qchem.inp (generated)

004412583.b3lyp_6-31g(d).gjf (generated)

004412583.b3lyp_6-31g(d).firefly.inp (generated)

004412583.b3lyp_6-31g(d).smash.inp (generated)

004412583.b3lyp_6-31g(d).nwchem.inp (generated) 004412583.b3lyp_6-31g(d).log.xz 004412583.td-b3lyp_6-31g+(d).inp 004412583.td-b3lyp_6-31g+(d).log.xz

004412583.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412583.td-b3lyp_6-31+g(d).gjf (generated)

004412583.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412583.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412583.mol 004412583.PUBCHEM 004412583.mol (via Jmol)
004412674.b3lyp_6-31g(d).inp

004412674.b3lyp_6-31g(d).qchem.inp (generated)

004412674.b3lyp_6-31g(d).gjf (generated)

004412674.b3lyp_6-31g(d).firefly.inp (generated)

004412674.b3lyp_6-31g(d).smash.inp (generated)

004412674.b3lyp_6-31g(d).nwchem.inp (generated) 004412674.b3lyp_6-31g(d).log.xz 004412674.td-b3lyp_6-31g+(d).inp 004412674.td-b3lyp_6-31g+(d).log.xz

004412674.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412674.td-b3lyp_6-31+g(d).gjf (generated)

004412674.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412674.mol 004412674.PUBCHEM 004412674.mol (via Jmol)
004412930.b3lyp_6-31g(d).inp

004412930.b3lyp_6-31g(d).qchem.inp (generated)

004412930.b3lyp_6-31g(d).gjf (generated)

004412930.b3lyp_6-31g(d).firefly.inp (generated)

004412930.b3lyp_6-31g(d).smash.inp (generated)

004412930.b3lyp_6-31g(d).nwchem.inp (generated) 004412930.b3lyp_6-31g(d).log.xz 004412930.td-b3lyp_6-31g+(d).inp 004412930.td-b3lyp_6-31g+(d).log.xz

004412930.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412930.td-b3lyp_6-31+g(d).gjf (generated)

004412930.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412930.mol 004412930.PUBCHEM 004412930.mol (via Jmol)
004412986.b3lyp_6-31g(d).inp

004412986.b3lyp_6-31g(d).qchem.inp (generated)

004412986.b3lyp_6-31g(d).gjf (generated)

004412986.b3lyp_6-31g(d).firefly.inp (generated)

004412986.b3lyp_6-31g(d).smash.inp (generated)

004412986.b3lyp_6-31g(d).nwchem.inp (generated) 004412986.b3lyp_6-31g(d).log.xz 004412986.td-b3lyp_6-31g+(d).inp 004412986.td-b3lyp_6-31g+(d).log.xz

004412986.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412986.td-b3lyp_6-31+g(d).gjf (generated)

004412986.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412986.mol 004412986.PUBCHEM 004412986.mol (via Jmol)
004412988.b3lyp_6-31g(d).inp

004412988.b3lyp_6-31g(d).qchem.inp (generated)

004412988.b3lyp_6-31g(d).gjf (generated)

004412988.b3lyp_6-31g(d).firefly.inp (generated)

004412988.b3lyp_6-31g(d).smash.inp (generated)

004412988.b3lyp_6-31g(d).nwchem.inp (generated) 004412988.b3lyp_6-31g(d).log.xz 004412988.td-b3lyp_6-31g+(d).inp 004412988.td-b3lyp_6-31g+(d).log.xz

004412988.td-b3lyp_6-31+g(d).qchem.inp (generated)

004412988.td-b3lyp_6-31+g(d).gjf (generated)

004412988.td-b3lyp_6-31+g(d).firefly.inp (generated)

004412988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004412988.mol 004412988.PUBCHEM 004412988.mol (via Jmol)
004413081.b3lyp_6-31g(d).inp

004413081.b3lyp_6-31g(d).qchem.inp (generated)

004413081.b3lyp_6-31g(d).gjf (generated)

004413081.b3lyp_6-31g(d).firefly.inp (generated)

004413081.b3lyp_6-31g(d).smash.inp (generated)

004413081.b3lyp_6-31g(d).nwchem.inp (generated) 004413081.b3lyp_6-31g(d).log.xz 004413081.td-b3lyp_6-31g+(d).inp 004413081.td-b3lyp_6-31g+(d).log.xz

004413081.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413081.td-b3lyp_6-31+g(d).gjf (generated)

004413081.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413081.mol 004413081.PUBCHEM 004413081.mol (via Jmol)
004413115.b3lyp_6-31g(d).inp

004413115.b3lyp_6-31g(d).qchem.inp (generated)

004413115.b3lyp_6-31g(d).gjf (generated)

004413115.b3lyp_6-31g(d).firefly.inp (generated)

004413115.b3lyp_6-31g(d).smash.inp (generated)

004413115.b3lyp_6-31g(d).nwchem.inp (generated) 004413115.b3lyp_6-31g(d).log.xz 004413115.td-b3lyp_6-31g+(d).inp 004413115.td-b3lyp_6-31g+(d).log.xz

004413115.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413115.td-b3lyp_6-31+g(d).gjf (generated)

004413115.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413115.mol 004413115.PUBCHEM 004413115.mol (via Jmol)
004413138.b3lyp_6-31g(d).inp

004413138.b3lyp_6-31g(d).qchem.inp (generated)

004413138.b3lyp_6-31g(d).gjf (generated)

004413138.b3lyp_6-31g(d).firefly.inp (generated)

004413138.b3lyp_6-31g(d).smash.inp (generated)

004413138.b3lyp_6-31g(d).nwchem.inp (generated) 004413138.b3lyp_6-31g(d).log.xz 004413138.td-b3lyp_6-31g+(d).inp 004413138.td-b3lyp_6-31g+(d).log.xz

004413138.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413138.td-b3lyp_6-31+g(d).gjf (generated)

004413138.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413138.mol 004413138.PUBCHEM 004413138.mol (via Jmol)
004413170.b3lyp_6-31g(d).inp

004413170.b3lyp_6-31g(d).qchem.inp (generated)

004413170.b3lyp_6-31g(d).gjf (generated)

004413170.b3lyp_6-31g(d).firefly.inp (generated)

004413170.b3lyp_6-31g(d).smash.inp (generated)

004413170.b3lyp_6-31g(d).nwchem.inp (generated) 004413170.b3lyp_6-31g(d).log.xz 004413170.mol 004413170.PUBCHEM 004413170.mol (via Jmol)
004413246.b3lyp_6-31g(d).inp

004413246.b3lyp_6-31g(d).qchem.inp (generated)

004413246.b3lyp_6-31g(d).gjf (generated)

004413246.b3lyp_6-31g(d).firefly.inp (generated)

004413246.b3lyp_6-31g(d).smash.inp (generated)

004413246.b3lyp_6-31g(d).nwchem.inp (generated) 004413246.b3lyp_6-31g(d).log.xz 004413246.td-b3lyp_6-31g+(d).inp 004413246.td-b3lyp_6-31g+(d).log.xz

004413246.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413246.td-b3lyp_6-31+g(d).gjf (generated)

004413246.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413246.mol 004413246.PUBCHEM 004413246.mol (via Jmol)
004413304.b3lyp_6-31g(d).inp

004413304.b3lyp_6-31g(d).qchem.inp (generated)

004413304.b3lyp_6-31g(d).gjf (generated)

004413304.b3lyp_6-31g(d).firefly.inp (generated)

004413304.b3lyp_6-31g(d).smash.inp (generated)

004413304.b3lyp_6-31g(d).nwchem.inp (generated) 004413304.b3lyp_6-31g(d).log.xz 004413304.td-b3lyp_6-31g+(d).inp 004413304.td-b3lyp_6-31g+(d).log.xz

004413304.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413304.td-b3lyp_6-31+g(d).gjf (generated)

004413304.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413304.mol 004413304.PUBCHEM 004413304.mol (via Jmol)
004413315.b3lyp_6-31g(d).inp

004413315.b3lyp_6-31g(d).qchem.inp (generated)

004413315.b3lyp_6-31g(d).gjf (generated)

004413315.b3lyp_6-31g(d).firefly.inp (generated)

004413315.b3lyp_6-31g(d).smash.inp (generated)

004413315.b3lyp_6-31g(d).nwchem.inp (generated) 004413315.b3lyp_6-31g(d).log.xz 004413315.td-b3lyp_6-31g+(d).inp 004413315.td-b3lyp_6-31g+(d).log.xz

004413315.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413315.td-b3lyp_6-31+g(d).gjf (generated)

004413315.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413315.mol 004413315.PUBCHEM 004413315.mol (via Jmol)
004413316.b3lyp_6-31g(d).inp

004413316.b3lyp_6-31g(d).qchem.inp (generated)

004413316.b3lyp_6-31g(d).gjf (generated)

004413316.b3lyp_6-31g(d).firefly.inp (generated)

004413316.b3lyp_6-31g(d).smash.inp (generated)

004413316.b3lyp_6-31g(d).nwchem.inp (generated) 004413316.b3lyp_6-31g(d).log.xz 004413316.td-b3lyp_6-31g+(d).inp 004413316.td-b3lyp_6-31g+(d).log.xz

004413316.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413316.td-b3lyp_6-31+g(d).gjf (generated)

004413316.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413316.mol 004413316.PUBCHEM 004413316.mol (via Jmol)
004413325.b3lyp_6-31g(d).inp

004413325.b3lyp_6-31g(d).qchem.inp (generated)

004413325.b3lyp_6-31g(d).gjf (generated)

004413325.b3lyp_6-31g(d).firefly.inp (generated)

004413325.b3lyp_6-31g(d).smash.inp (generated)

004413325.b3lyp_6-31g(d).nwchem.inp (generated) 004413325.b3lyp_6-31g(d).log.xz 004413325.td-b3lyp_6-31g+(d).inp 004413325.td-b3lyp_6-31g+(d).log.xz

004413325.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413325.td-b3lyp_6-31+g(d).gjf (generated)

004413325.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413325.mol 004413325.PUBCHEM 004413325.mol (via Jmol)
004413393.b3lyp_6-31g(d).inp

004413393.b3lyp_6-31g(d).qchem.inp (generated)

004413393.b3lyp_6-31g(d).gjf (generated)

004413393.b3lyp_6-31g(d).firefly.inp (generated)

004413393.b3lyp_6-31g(d).smash.inp (generated)

004413393.b3lyp_6-31g(d).nwchem.inp (generated) 004413393.b3lyp_6-31g(d).log.xz 004413393.td-b3lyp_6-31g+(d).inp 004413393.td-b3lyp_6-31g+(d).log.xz

004413393.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413393.td-b3lyp_6-31+g(d).gjf (generated)

004413393.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413393.mol 004413393.PUBCHEM 004413393.mol (via Jmol)
004413496.b3lyp_6-31g(d).inp

004413496.b3lyp_6-31g(d).qchem.inp (generated)

004413496.b3lyp_6-31g(d).gjf (generated)

004413496.b3lyp_6-31g(d).firefly.inp (generated)

004413496.b3lyp_6-31g(d).smash.inp (generated)

004413496.b3lyp_6-31g(d).nwchem.inp (generated) 004413496.b3lyp_6-31g(d).log.xz 004413496.td-b3lyp_6-31g+(d).inp 004413496.td-b3lyp_6-31g+(d).log.xz

004413496.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413496.td-b3lyp_6-31+g(d).gjf (generated)

004413496.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413496.mol 004413496.PUBCHEM 004413496.mol (via Jmol)
004413549.b3lyp_6-31g(d).inp

004413549.b3lyp_6-31g(d).qchem.inp (generated)

004413549.b3lyp_6-31g(d).gjf (generated)

004413549.b3lyp_6-31g(d).firefly.inp (generated)

004413549.b3lyp_6-31g(d).smash.inp (generated)

004413549.b3lyp_6-31g(d).nwchem.inp (generated) 004413549.b3lyp_6-31g(d).log.xz 004413549.td-b3lyp_6-31g+(d).inp 004413549.td-b3lyp_6-31g+(d).log.xz

004413549.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413549.td-b3lyp_6-31+g(d).gjf (generated)

004413549.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413549.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413549.mol 004413549.PUBCHEM 004413549.mol (via Jmol)
004413601.b3lyp_6-31g(d).inp

004413601.b3lyp_6-31g(d).qchem.inp (generated)

004413601.b3lyp_6-31g(d).gjf (generated)

004413601.b3lyp_6-31g(d).firefly.inp (generated)

004413601.b3lyp_6-31g(d).smash.inp (generated)

004413601.b3lyp_6-31g(d).nwchem.inp (generated) 004413601.b3lyp_6-31g(d).log.xz 004413601.td-b3lyp_6-31g+(d).inp 004413601.td-b3lyp_6-31g+(d).log.xz

004413601.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413601.td-b3lyp_6-31+g(d).gjf (generated)

004413601.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413601.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413601.mol 004413601.PUBCHEM 004413601.mol (via Jmol)
004413673.b3lyp_6-31g(d).inp

004413673.b3lyp_6-31g(d).qchem.inp (generated)

004413673.b3lyp_6-31g(d).gjf (generated)

004413673.b3lyp_6-31g(d).firefly.inp (generated)

004413673.b3lyp_6-31g(d).smash.inp (generated)

004413673.b3lyp_6-31g(d).nwchem.inp (generated) 004413673.b3lyp_6-31g(d).log.xz 004413673.td-b3lyp_6-31g+(d).inp 004413673.td-b3lyp_6-31g+(d).log.xz

004413673.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413673.td-b3lyp_6-31+g(d).gjf (generated)

004413673.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413673.mol 004413673.PUBCHEM 004413673.mol (via Jmol)
004413677.b3lyp_6-31g(d).inp

004413677.b3lyp_6-31g(d).qchem.inp (generated)

004413677.b3lyp_6-31g(d).gjf (generated)

004413677.b3lyp_6-31g(d).firefly.inp (generated)

004413677.b3lyp_6-31g(d).smash.inp (generated)

004413677.b3lyp_6-31g(d).nwchem.inp (generated) 004413677.b3lyp_6-31g(d).log.xz 004413677.mol 004413677.PUBCHEM 004413677.mol (via Jmol)
004413679.b3lyp_6-31g(d).inp

004413679.b3lyp_6-31g(d).qchem.inp (generated)

004413679.b3lyp_6-31g(d).gjf (generated)

004413679.b3lyp_6-31g(d).firefly.inp (generated)

004413679.b3lyp_6-31g(d).smash.inp (generated)

004413679.b3lyp_6-31g(d).nwchem.inp (generated) 004413679.b3lyp_6-31g(d).log.xz 004413679.td-b3lyp_6-31g+(d).inp 004413679.td-b3lyp_6-31g+(d).log.xz

004413679.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413679.td-b3lyp_6-31+g(d).gjf (generated)

004413679.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413679.mol 004413679.PUBCHEM 004413679.mol (via Jmol)
004413699.b3lyp_6-31g(d).inp

004413699.b3lyp_6-31g(d).qchem.inp (generated)

004413699.b3lyp_6-31g(d).gjf (generated)

004413699.b3lyp_6-31g(d).firefly.inp (generated)

004413699.b3lyp_6-31g(d).smash.inp (generated)

004413699.b3lyp_6-31g(d).nwchem.inp (generated) 004413699.b3lyp_6-31g(d).log.xz 004413699.td-b3lyp_6-31g+(d).inp 004413699.td-b3lyp_6-31g+(d).log.xz

004413699.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413699.td-b3lyp_6-31+g(d).gjf (generated)

004413699.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413699.mol 004413699.PUBCHEM 004413699.mol (via Jmol)
004413708.b3lyp_6-31g(d).inp

004413708.b3lyp_6-31g(d).qchem.inp (generated)

004413708.b3lyp_6-31g(d).gjf (generated)

004413708.b3lyp_6-31g(d).firefly.inp (generated)

004413708.b3lyp_6-31g(d).smash.inp (generated)

004413708.b3lyp_6-31g(d).nwchem.inp (generated) 004413708.b3lyp_6-31g(d).log.xz 004413708.td-b3lyp_6-31g+(d).inp 004413708.td-b3lyp_6-31g+(d).log.xz

004413708.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413708.td-b3lyp_6-31+g(d).gjf (generated)

004413708.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413708.mol 004413708.PUBCHEM 004413708.mol (via Jmol)
004413713.b3lyp_6-31g(d).inp

004413713.b3lyp_6-31g(d).qchem.inp (generated)

004413713.b3lyp_6-31g(d).gjf (generated)

004413713.b3lyp_6-31g(d).firefly.inp (generated)

004413713.b3lyp_6-31g(d).smash.inp (generated)

004413713.b3lyp_6-31g(d).nwchem.inp (generated) 004413713.b3lyp_6-31g(d).log.xz 004413713.td-b3lyp_6-31g+(d).inp 004413713.td-b3lyp_6-31g+(d).log.xz

004413713.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413713.td-b3lyp_6-31+g(d).gjf (generated)

004413713.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413713.mol 004413713.PUBCHEM 004413713.mol (via Jmol)
004413753.b3lyp_6-31g(d).inp

004413753.b3lyp_6-31g(d).qchem.inp (generated)

004413753.b3lyp_6-31g(d).gjf (generated)

004413753.b3lyp_6-31g(d).firefly.inp (generated)

004413753.b3lyp_6-31g(d).smash.inp (generated)

004413753.b3lyp_6-31g(d).nwchem.inp (generated) 004413753.b3lyp_6-31g(d).log.xz 004413753.td-b3lyp_6-31g+(d).inp 004413753.td-b3lyp_6-31g+(d).log.xz

004413753.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413753.td-b3lyp_6-31+g(d).gjf (generated)

004413753.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413753.mol 004413753.PUBCHEM 004413753.mol (via Jmol)
004413767.b3lyp_6-31g(d).inp

004413767.b3lyp_6-31g(d).qchem.inp (generated)

004413767.b3lyp_6-31g(d).gjf (generated)

004413767.b3lyp_6-31g(d).firefly.inp (generated)

004413767.b3lyp_6-31g(d).smash.inp (generated)

004413767.b3lyp_6-31g(d).nwchem.inp (generated) 004413767.b3lyp_6-31g(d).log.xz 004413767.mol 004413767.PUBCHEM 004413767.mol (via Jmol)
004413768.b3lyp_6-31g(d).inp

004413768.b3lyp_6-31g(d).qchem.inp (generated)

004413768.b3lyp_6-31g(d).gjf (generated)

004413768.b3lyp_6-31g(d).firefly.inp (generated)

004413768.b3lyp_6-31g(d).smash.inp (generated)

004413768.b3lyp_6-31g(d).nwchem.inp (generated) 004413768.b3lyp_6-31g(d).log.xz 004413768.td-b3lyp_6-31g+(d).inp 004413768.td-b3lyp_6-31g+(d).log.xz

004413768.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413768.td-b3lyp_6-31+g(d).gjf (generated)

004413768.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413768.mol 004413768.PUBCHEM 004413768.mol (via Jmol)
004413769.b3lyp_6-31g(d).inp

004413769.b3lyp_6-31g(d).qchem.inp (generated)

004413769.b3lyp_6-31g(d).gjf (generated)

004413769.b3lyp_6-31g(d).firefly.inp (generated)

004413769.b3lyp_6-31g(d).smash.inp (generated)

004413769.b3lyp_6-31g(d).nwchem.inp (generated) 004413769.b3lyp_6-31g(d).log.xz 004413769.td-b3lyp_6-31g+(d).inp 004413769.td-b3lyp_6-31g+(d).log.xz

004413769.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413769.td-b3lyp_6-31+g(d).gjf (generated)

004413769.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413769.mol 004413769.PUBCHEM 004413769.mol (via Jmol)
004413805.b3lyp_6-31g(d).inp

004413805.b3lyp_6-31g(d).qchem.inp (generated)

004413805.b3lyp_6-31g(d).gjf (generated)

004413805.b3lyp_6-31g(d).firefly.inp (generated)

004413805.b3lyp_6-31g(d).smash.inp (generated)

004413805.b3lyp_6-31g(d).nwchem.inp (generated) 004413805.b3lyp_6-31g(d).log.xz 004413805.td-b3lyp_6-31g+(d).inp 004413805.td-b3lyp_6-31g+(d).log.xz

004413805.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413805.td-b3lyp_6-31+g(d).gjf (generated)

004413805.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413805.mol 004413805.PUBCHEM 004413805.mol (via Jmol)
004413838.b3lyp_6-31g(d).inp

004413838.b3lyp_6-31g(d).qchem.inp (generated)

004413838.b3lyp_6-31g(d).gjf (generated)

004413838.b3lyp_6-31g(d).firefly.inp (generated)

004413838.b3lyp_6-31g(d).smash.inp (generated)

004413838.b3lyp_6-31g(d).nwchem.inp (generated) 004413838.b3lyp_6-31g(d).log.xz 004413838.td-b3lyp_6-31g+(d).inp 004413838.td-b3lyp_6-31g+(d).log.xz

004413838.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413838.td-b3lyp_6-31+g(d).gjf (generated)

004413838.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413838.mol 004413838.PUBCHEM 004413838.mol (via Jmol)
004413840.b3lyp_6-31g(d).inp

004413840.b3lyp_6-31g(d).qchem.inp (generated)

004413840.b3lyp_6-31g(d).gjf (generated)

004413840.b3lyp_6-31g(d).firefly.inp (generated)

004413840.b3lyp_6-31g(d).smash.inp (generated)

004413840.b3lyp_6-31g(d).nwchem.inp (generated) 004413840.b3lyp_6-31g(d).log.xz 004413840.td-b3lyp_6-31g+(d).inp 004413840.td-b3lyp_6-31g+(d).log.xz

004413840.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413840.td-b3lyp_6-31+g(d).gjf (generated)

004413840.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413840.mol 004413840.PUBCHEM 004413840.mol (via Jmol)
004413842.b3lyp_6-31g(d).inp

004413842.b3lyp_6-31g(d).qchem.inp (generated)

004413842.b3lyp_6-31g(d).gjf (generated)

004413842.b3lyp_6-31g(d).firefly.inp (generated)

004413842.b3lyp_6-31g(d).smash.inp (generated)

004413842.b3lyp_6-31g(d).nwchem.inp (generated) 004413842.b3lyp_6-31g(d).log.xz 004413842.td-b3lyp_6-31g+(d).inp 004413842.td-b3lyp_6-31g+(d).log.xz

004413842.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413842.td-b3lyp_6-31+g(d).gjf (generated)

004413842.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413842.mol 004413842.PUBCHEM 004413842.mol (via Jmol)
004413988.b3lyp_6-31g(d).inp

004413988.b3lyp_6-31g(d).qchem.inp (generated)

004413988.b3lyp_6-31g(d).gjf (generated)

004413988.b3lyp_6-31g(d).firefly.inp (generated)

004413988.b3lyp_6-31g(d).smash.inp (generated)

004413988.b3lyp_6-31g(d).nwchem.inp (generated) 004413988.b3lyp_6-31g(d).log.xz 004413988.td-b3lyp_6-31g+(d).inp 004413988.td-b3lyp_6-31g+(d).log.xz

004413988.td-b3lyp_6-31+g(d).qchem.inp (generated)

004413988.td-b3lyp_6-31+g(d).gjf (generated)

004413988.td-b3lyp_6-31+g(d).firefly.inp (generated)

004413988.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004413988.mol 004413988.PUBCHEM 004413988.mol (via Jmol)
004413989.b3lyp_6-31g(d).inp

004413989.b3lyp_6-31g(d).qchem.inp (generated)

004413989.b3lyp_6-31g(d).gjf (generated)

004413989.b3lyp_6-31g(d).firefly.inp (generated)

004413989.b3lyp_6-31g(d).smash.inp (generated)

004413989.b3lyp_6-31g(d).nwchem.inp (generated) 004413989.b3lyp_6-31g(d).log.xz 004413989.mol 004413989.PUBCHEM 004413989.mol (via Jmol)
004414084.b3lyp_6-31g(d).inp

004414084.b3lyp_6-31g(d).qchem.inp (generated)

004414084.b3lyp_6-31g(d).gjf (generated)

004414084.b3lyp_6-31g(d).firefly.inp (generated)

004414084.b3lyp_6-31g(d).smash.inp (generated)

004414084.b3lyp_6-31g(d).nwchem.inp (generated) 004414084.b3lyp_6-31g(d).log.xz 004414084.td-b3lyp_6-31g+(d).inp 004414084.td-b3lyp_6-31g+(d).log.xz

004414084.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414084.td-b3lyp_6-31+g(d).gjf (generated)

004414084.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414084.mol 004414084.PUBCHEM 004414084.mol (via Jmol)
004414086.b3lyp_6-31g(d).inp

004414086.b3lyp_6-31g(d).qchem.inp (generated)

004414086.b3lyp_6-31g(d).gjf (generated)

004414086.b3lyp_6-31g(d).firefly.inp (generated)

004414086.b3lyp_6-31g(d).smash.inp (generated)

004414086.b3lyp_6-31g(d).nwchem.inp (generated) 004414086.b3lyp_6-31g(d).log.xz 004414086.td-b3lyp_6-31g+(d).inp 004414086.td-b3lyp_6-31g+(d).log.xz

004414086.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414086.td-b3lyp_6-31+g(d).gjf (generated)

004414086.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414086.mol 004414086.PUBCHEM 004414086.mol (via Jmol)
004414161.b3lyp_6-31g(d).inp

004414161.b3lyp_6-31g(d).qchem.inp (generated)

004414161.b3lyp_6-31g(d).gjf (generated)

004414161.b3lyp_6-31g(d).firefly.inp (generated)

004414161.b3lyp_6-31g(d).smash.inp (generated)

004414161.b3lyp_6-31g(d).nwchem.inp (generated) 004414161.b3lyp_6-31g(d).log.xz 004414161.td-b3lyp_6-31g+(d).inp 004414161.td-b3lyp_6-31g+(d).log.xz

004414161.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414161.td-b3lyp_6-31+g(d).gjf (generated)

004414161.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414161.mol 004414161.PUBCHEM 004414161.mol (via Jmol)
004414185.b3lyp_6-31g(d).inp

004414185.b3lyp_6-31g(d).qchem.inp (generated)

004414185.b3lyp_6-31g(d).gjf (generated)

004414185.b3lyp_6-31g(d).firefly.inp (generated)

004414185.b3lyp_6-31g(d).smash.inp (generated)

004414185.b3lyp_6-31g(d).nwchem.inp (generated) 004414185.b3lyp_6-31g(d).log.xz 004414185.mol 004414185.PUBCHEM 004414185.mol (via Jmol)
004414225.b3lyp_6-31g(d).inp

004414225.b3lyp_6-31g(d).qchem.inp (generated)

004414225.b3lyp_6-31g(d).gjf (generated)

004414225.b3lyp_6-31g(d).firefly.inp (generated)

004414225.b3lyp_6-31g(d).smash.inp (generated)

004414225.b3lyp_6-31g(d).nwchem.inp (generated) 004414225.b3lyp_6-31g(d).log.xz 004414225.td-b3lyp_6-31g+(d).inp 004414225.td-b3lyp_6-31g+(d).log.xz

004414225.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414225.td-b3lyp_6-31+g(d).gjf (generated)

004414225.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414225.mol 004414225.PUBCHEM 004414225.mol (via Jmol)
004414241.b3lyp_6-31g(d).inp

004414241.b3lyp_6-31g(d).qchem.inp (generated)

004414241.b3lyp_6-31g(d).gjf (generated)

004414241.b3lyp_6-31g(d).firefly.inp (generated)

004414241.b3lyp_6-31g(d).smash.inp (generated)

004414241.b3lyp_6-31g(d).nwchem.inp (generated) 004414241.b3lyp_6-31g(d).log.xz 004414241.td-b3lyp_6-31g+(d).inp 004414241.td-b3lyp_6-31g+(d).log.xz

004414241.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414241.td-b3lyp_6-31+g(d).gjf (generated)

004414241.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414241.mol 004414241.PUBCHEM 004414241.mol (via Jmol)
004414242.b3lyp_6-31g(d).inp

004414242.b3lyp_6-31g(d).qchem.inp (generated)

004414242.b3lyp_6-31g(d).gjf (generated)

004414242.b3lyp_6-31g(d).firefly.inp (generated)

004414242.b3lyp_6-31g(d).smash.inp (generated)

004414242.b3lyp_6-31g(d).nwchem.inp (generated) 004414242.b3lyp_6-31g(d).log.xz 004414242.td-b3lyp_6-31g+(d).inp 004414242.td-b3lyp_6-31g+(d).log.xz

004414242.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414242.td-b3lyp_6-31+g(d).gjf (generated)

004414242.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414242.mol 004414242.PUBCHEM 004414242.mol (via Jmol)
004414319.b3lyp_6-31g(d).inp

004414319.b3lyp_6-31g(d).qchem.inp (generated)

004414319.b3lyp_6-31g(d).gjf (generated)

004414319.b3lyp_6-31g(d).firefly.inp (generated)

004414319.b3lyp_6-31g(d).smash.inp (generated)

004414319.b3lyp_6-31g(d).nwchem.inp (generated) 004414319.b3lyp_6-31g(d).log.xz 004414319.td-b3lyp_6-31g+(d).inp 004414319.td-b3lyp_6-31g+(d).log.xz

004414319.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414319.td-b3lyp_6-31+g(d).gjf (generated)

004414319.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414319.mol 004414319.PUBCHEM 004414319.mol (via Jmol)
004414327.b3lyp_6-31g(d).inp

004414327.b3lyp_6-31g(d).qchem.inp (generated)

004414327.b3lyp_6-31g(d).gjf (generated)

004414327.b3lyp_6-31g(d).firefly.inp (generated)

004414327.b3lyp_6-31g(d).smash.inp (generated)

004414327.b3lyp_6-31g(d).nwchem.inp (generated) 004414327.b3lyp_6-31g(d).log.xz 004414327.td-b3lyp_6-31g+(d).inp 004414327.td-b3lyp_6-31g+(d).log.xz

004414327.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414327.td-b3lyp_6-31+g(d).gjf (generated)

004414327.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414327.mol 004414327.PUBCHEM 004414327.mol (via Jmol)
004414331.b3lyp_6-31g(d).inp

004414331.b3lyp_6-31g(d).qchem.inp (generated)

004414331.b3lyp_6-31g(d).gjf (generated)

004414331.b3lyp_6-31g(d).firefly.inp (generated)

004414331.b3lyp_6-31g(d).smash.inp (generated)

004414331.b3lyp_6-31g(d).nwchem.inp (generated) 004414331.b3lyp_6-31g(d).log.xz 004414331.td-b3lyp_6-31g+(d).inp 004414331.td-b3lyp_6-31g+(d).log.xz

004414331.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414331.td-b3lyp_6-31+g(d).gjf (generated)

004414331.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414331.mol 004414331.PUBCHEM 004414331.mol (via Jmol)
004414373.b3lyp_6-31g(d).inp

004414373.b3lyp_6-31g(d).qchem.inp (generated)

004414373.b3lyp_6-31g(d).gjf (generated)

004414373.b3lyp_6-31g(d).firefly.inp (generated)

004414373.b3lyp_6-31g(d).smash.inp (generated)

004414373.b3lyp_6-31g(d).nwchem.inp (generated) 004414373.b3lyp_6-31g(d).log.xz 004414373.td-b3lyp_6-31g+(d).inp 004414373.td-b3lyp_6-31g+(d).log.xz

004414373.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414373.td-b3lyp_6-31+g(d).gjf (generated)

004414373.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414373.mol 004414373.PUBCHEM 004414373.mol (via Jmol)
004414416.b3lyp_6-31g(d).inp

004414416.b3lyp_6-31g(d).qchem.inp (generated)

004414416.b3lyp_6-31g(d).gjf (generated)

004414416.b3lyp_6-31g(d).firefly.inp (generated)

004414416.b3lyp_6-31g(d).smash.inp (generated)

004414416.b3lyp_6-31g(d).nwchem.inp (generated) 004414416.b3lyp_6-31g(d).log.xz 004414416.td-b3lyp_6-31g+(d).inp 004414416.td-b3lyp_6-31g+(d).log.xz

004414416.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414416.td-b3lyp_6-31+g(d).gjf (generated)

004414416.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414416.mol 004414416.PUBCHEM 004414416.mol (via Jmol)
004414463.b3lyp_6-31g(d).inp

004414463.b3lyp_6-31g(d).qchem.inp (generated)

004414463.b3lyp_6-31g(d).gjf (generated)

004414463.b3lyp_6-31g(d).firefly.inp (generated)

004414463.b3lyp_6-31g(d).smash.inp (generated)

004414463.b3lyp_6-31g(d).nwchem.inp (generated) 004414463.b3lyp_6-31g(d).log.xz 004414463.mol 004414463.PUBCHEM 004414463.mol (via Jmol)
004414521.b3lyp_6-31g(d).inp

004414521.b3lyp_6-31g(d).qchem.inp (generated)

004414521.b3lyp_6-31g(d).gjf (generated)

004414521.b3lyp_6-31g(d).firefly.inp (generated)

004414521.b3lyp_6-31g(d).smash.inp (generated)

004414521.b3lyp_6-31g(d).nwchem.inp (generated) 004414521.b3lyp_6-31g(d).log.xz 004414521.td-b3lyp_6-31g+(d).inp 004414521.td-b3lyp_6-31g+(d).log.xz

004414521.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414521.td-b3lyp_6-31+g(d).gjf (generated)

004414521.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414521.mol 004414521.PUBCHEM 004414521.mol (via Jmol)
004414648.b3lyp_6-31g(d).inp

004414648.b3lyp_6-31g(d).qchem.inp (generated)

004414648.b3lyp_6-31g(d).gjf (generated)

004414648.b3lyp_6-31g(d).firefly.inp (generated)

004414648.b3lyp_6-31g(d).smash.inp (generated)

004414648.b3lyp_6-31g(d).nwchem.inp (generated) 004414648.b3lyp_6-31g(d).log.xz 004414648.td-b3lyp_6-31g+(d).inp 004414648.td-b3lyp_6-31g+(d).log.xz

004414648.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414648.td-b3lyp_6-31+g(d).gjf (generated)

004414648.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414648.mol 004414648.PUBCHEM 004414648.mol (via Jmol)
004414661.b3lyp_6-31g(d).inp

004414661.b3lyp_6-31g(d).qchem.inp (generated)

004414661.b3lyp_6-31g(d).gjf (generated)

004414661.b3lyp_6-31g(d).firefly.inp (generated)

004414661.b3lyp_6-31g(d).smash.inp (generated)

004414661.b3lyp_6-31g(d).nwchem.inp (generated) 004414661.b3lyp_6-31g(d).log.xz 004414661.td-b3lyp_6-31g+(d).inp 004414661.td-b3lyp_6-31g+(d).log.xz

004414661.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414661.td-b3lyp_6-31+g(d).gjf (generated)

004414661.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414661.mol 004414661.PUBCHEM 004414661.mol (via Jmol)
004414673.b3lyp_6-31g(d).inp

004414673.b3lyp_6-31g(d).qchem.inp (generated)

004414673.b3lyp_6-31g(d).gjf (generated)

004414673.b3lyp_6-31g(d).firefly.inp (generated)

004414673.b3lyp_6-31g(d).smash.inp (generated)

004414673.b3lyp_6-31g(d).nwchem.inp (generated) 004414673.b3lyp_6-31g(d).log.xz 004414673.td-b3lyp_6-31g+(d).inp 004414673.td-b3lyp_6-31g+(d).log.xz

004414673.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414673.td-b3lyp_6-31+g(d).gjf (generated)

004414673.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414673.mol 004414673.PUBCHEM 004414673.mol (via Jmol)
004414747.b3lyp_6-31g(d).inp

004414747.b3lyp_6-31g(d).qchem.inp (generated)

004414747.b3lyp_6-31g(d).gjf (generated)

004414747.b3lyp_6-31g(d).firefly.inp (generated)

004414747.b3lyp_6-31g(d).smash.inp (generated)

004414747.b3lyp_6-31g(d).nwchem.inp (generated) 004414747.b3lyp_6-31g(d).log.xz 004414747.td-b3lyp_6-31g+(d).inp 004414747.td-b3lyp_6-31g+(d).log.xz

004414747.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414747.td-b3lyp_6-31+g(d).gjf (generated)

004414747.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414747.mol 004414747.PUBCHEM 004414747.mol (via Jmol)
004414796.b3lyp_6-31g(d).inp

004414796.b3lyp_6-31g(d).qchem.inp (generated)

004414796.b3lyp_6-31g(d).gjf (generated)

004414796.b3lyp_6-31g(d).firefly.inp (generated)

004414796.b3lyp_6-31g(d).smash.inp (generated)

004414796.b3lyp_6-31g(d).nwchem.inp (generated) 004414796.b3lyp_6-31g(d).log.xz 004414796.td-b3lyp_6-31g+(d).inp 004414796.td-b3lyp_6-31g+(d).log.xz

004414796.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414796.td-b3lyp_6-31+g(d).gjf (generated)

004414796.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414796.mol 004414796.PUBCHEM 004414796.mol (via Jmol)
004414824.b3lyp_6-31g(d).inp

004414824.b3lyp_6-31g(d).qchem.inp (generated)

004414824.b3lyp_6-31g(d).gjf (generated)

004414824.b3lyp_6-31g(d).firefly.inp (generated)

004414824.b3lyp_6-31g(d).smash.inp (generated)

004414824.b3lyp_6-31g(d).nwchem.inp (generated) 004414824.b3lyp_6-31g(d).log.xz 004414824.mol 004414824.PUBCHEM 004414824.mol (via Jmol)
004414833.b3lyp_6-31g(d).inp

004414833.b3lyp_6-31g(d).qchem.inp (generated)

004414833.b3lyp_6-31g(d).gjf (generated)

004414833.b3lyp_6-31g(d).firefly.inp (generated)

004414833.b3lyp_6-31g(d).smash.inp (generated)

004414833.b3lyp_6-31g(d).nwchem.inp (generated) 004414833.b3lyp_6-31g(d).log.xz 004414833.mol 004414833.PUBCHEM 004414833.mol (via Jmol)
004414850.b3lyp_6-31g(d).inp

004414850.b3lyp_6-31g(d).qchem.inp (generated)

004414850.b3lyp_6-31g(d).gjf (generated)

004414850.b3lyp_6-31g(d).firefly.inp (generated)

004414850.b3lyp_6-31g(d).smash.inp (generated)

004414850.b3lyp_6-31g(d).nwchem.inp (generated) 004414850.b3lyp_6-31g(d).log.xz 004414850.td-b3lyp_6-31g+(d).inp 004414850.td-b3lyp_6-31g+(d).log.xz

004414850.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414850.td-b3lyp_6-31+g(d).gjf (generated)

004414850.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414850.mol 004414850.PUBCHEM 004414850.mol (via Jmol)
004414913.b3lyp_6-31g(d).inp

004414913.b3lyp_6-31g(d).qchem.inp (generated)

004414913.b3lyp_6-31g(d).gjf (generated)

004414913.b3lyp_6-31g(d).firefly.inp (generated)

004414913.b3lyp_6-31g(d).smash.inp (generated)

004414913.b3lyp_6-31g(d).nwchem.inp (generated) 004414913.b3lyp_6-31g(d).log.xz 004414913.td-b3lyp_6-31g+(d).inp 004414913.td-b3lyp_6-31g+(d).log.xz

004414913.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414913.td-b3lyp_6-31+g(d).gjf (generated)

004414913.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414913.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414913.mol 004414913.PUBCHEM 004414913.mol (via Jmol)
004414922.b3lyp_6-31g(d).inp

004414922.b3lyp_6-31g(d).qchem.inp (generated)

004414922.b3lyp_6-31g(d).gjf (generated)

004414922.b3lyp_6-31g(d).firefly.inp (generated)

004414922.b3lyp_6-31g(d).smash.inp (generated)

004414922.b3lyp_6-31g(d).nwchem.inp (generated) 004414922.b3lyp_6-31g(d).log.xz 004414922.td-b3lyp_6-31g+(d).inp 004414922.td-b3lyp_6-31g+(d).log.xz

004414922.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414922.td-b3lyp_6-31+g(d).gjf (generated)

004414922.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414922.mol 004414922.PUBCHEM 004414922.mol (via Jmol)
004414972.b3lyp_6-31g(d).inp

004414972.b3lyp_6-31g(d).qchem.inp (generated)

004414972.b3lyp_6-31g(d).gjf (generated)

004414972.b3lyp_6-31g(d).firefly.inp (generated)

004414972.b3lyp_6-31g(d).smash.inp (generated)

004414972.b3lyp_6-31g(d).nwchem.inp (generated) 004414972.b3lyp_6-31g(d).log.xz 004414972.td-b3lyp_6-31g+(d).inp 004414972.td-b3lyp_6-31g+(d).log.xz

004414972.td-b3lyp_6-31+g(d).qchem.inp (generated)

004414972.td-b3lyp_6-31+g(d).gjf (generated)

004414972.td-b3lyp_6-31+g(d).firefly.inp (generated)

004414972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004414972.mol 004414972.PUBCHEM 004414972.mol (via Jmol)
004415034.b3lyp_6-31g(d).inp

004415034.b3lyp_6-31g(d).qchem.inp (generated)

004415034.b3lyp_6-31g(d).gjf (generated)

004415034.b3lyp_6-31g(d).firefly.inp (generated)

004415034.b3lyp_6-31g(d).smash.inp (generated)

004415034.b3lyp_6-31g(d).nwchem.inp (generated) 004415034.b3lyp_6-31g(d).log.xz 004415034.td-b3lyp_6-31g+(d).inp 004415034.td-b3lyp_6-31g+(d).log.xz

004415034.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415034.td-b3lyp_6-31+g(d).gjf (generated)

004415034.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415034.mol 004415034.PUBCHEM 004415034.mol (via Jmol)
004415050.b3lyp_6-31g(d).inp

004415050.b3lyp_6-31g(d).qchem.inp (generated)

004415050.b3lyp_6-31g(d).gjf (generated)

004415050.b3lyp_6-31g(d).firefly.inp (generated)

004415050.b3lyp_6-31g(d).smash.inp (generated)

004415050.b3lyp_6-31g(d).nwchem.inp (generated) 004415050.b3lyp_6-31g(d).log.xz 004415050.mol 004415050.PUBCHEM 004415050.mol (via Jmol)
004415064.b3lyp_6-31g(d).inp

004415064.b3lyp_6-31g(d).qchem.inp (generated)

004415064.b3lyp_6-31g(d).gjf (generated)

004415064.b3lyp_6-31g(d).firefly.inp (generated)

004415064.b3lyp_6-31g(d).smash.inp (generated)

004415064.b3lyp_6-31g(d).nwchem.inp (generated) 004415064.b3lyp_6-31g(d).log.xz 004415064.td-b3lyp_6-31g+(d).inp 004415064.td-b3lyp_6-31g+(d).log.xz

004415064.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415064.td-b3lyp_6-31+g(d).gjf (generated)

004415064.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415064.mol 004415064.PUBCHEM 004415064.mol (via Jmol)
004415100.b3lyp_6-31g(d).inp

004415100.b3lyp_6-31g(d).qchem.inp (generated)

004415100.b3lyp_6-31g(d).gjf (generated)

004415100.b3lyp_6-31g(d).firefly.inp (generated)

004415100.b3lyp_6-31g(d).smash.inp (generated)

004415100.b3lyp_6-31g(d).nwchem.inp (generated) 004415100.b3lyp_6-31g(d).log.xz 004415100.td-b3lyp_6-31g+(d).inp 004415100.td-b3lyp_6-31g+(d).log.xz

004415100.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415100.td-b3lyp_6-31+g(d).gjf (generated)

004415100.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415100.mol 004415100.PUBCHEM 004415100.mol (via Jmol)
004415103.b3lyp_6-31g(d).inp

004415103.b3lyp_6-31g(d).qchem.inp (generated)

004415103.b3lyp_6-31g(d).gjf (generated)

004415103.b3lyp_6-31g(d).firefly.inp (generated)

004415103.b3lyp_6-31g(d).smash.inp (generated)

004415103.b3lyp_6-31g(d).nwchem.inp (generated) 004415103.b3lyp_6-31g(d).log.xz 004415103.td-b3lyp_6-31g+(d).inp 004415103.td-b3lyp_6-31g+(d).log.xz

004415103.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415103.td-b3lyp_6-31+g(d).gjf (generated)

004415103.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415103.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415103.mol 004415103.PUBCHEM 004415103.mol (via Jmol)
004415125.b3lyp_6-31g(d).inp

004415125.b3lyp_6-31g(d).qchem.inp (generated)

004415125.b3lyp_6-31g(d).gjf (generated)

004415125.b3lyp_6-31g(d).firefly.inp (generated)

004415125.b3lyp_6-31g(d).smash.inp (generated)

004415125.b3lyp_6-31g(d).nwchem.inp (generated) 004415125.b3lyp_6-31g(d).log.xz 004415125.td-b3lyp_6-31g+(d).inp 004415125.td-b3lyp_6-31g+(d).log.xz

004415125.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415125.td-b3lyp_6-31+g(d).gjf (generated)

004415125.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415125.mol 004415125.PUBCHEM 004415125.mol (via Jmol)
004415184.b3lyp_6-31g(d).inp

004415184.b3lyp_6-31g(d).qchem.inp (generated)

004415184.b3lyp_6-31g(d).gjf (generated)

004415184.b3lyp_6-31g(d).firefly.inp (generated)

004415184.b3lyp_6-31g(d).smash.inp (generated)

004415184.b3lyp_6-31g(d).nwchem.inp (generated) 004415184.b3lyp_6-31g(d).log.xz 004415184.td-b3lyp_6-31g+(d).inp 004415184.td-b3lyp_6-31g+(d).log.xz

004415184.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415184.td-b3lyp_6-31+g(d).gjf (generated)

004415184.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415184.mol 004415184.PUBCHEM 004415184.mol (via Jmol)
004415205.b3lyp_6-31g(d).inp

004415205.b3lyp_6-31g(d).qchem.inp (generated)

004415205.b3lyp_6-31g(d).gjf (generated)

004415205.b3lyp_6-31g(d).firefly.inp (generated)

004415205.b3lyp_6-31g(d).smash.inp (generated)

004415205.b3lyp_6-31g(d).nwchem.inp (generated) 004415205.b3lyp_6-31g(d).log.xz 004415205.td-b3lyp_6-31g+(d).inp 004415205.td-b3lyp_6-31g+(d).log.xz

004415205.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415205.td-b3lyp_6-31+g(d).gjf (generated)

004415205.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415205.mol 004415205.PUBCHEM 004415205.mol (via Jmol)
004415230.b3lyp_6-31g(d).inp

004415230.b3lyp_6-31g(d).qchem.inp (generated)

004415230.b3lyp_6-31g(d).gjf (generated)

004415230.b3lyp_6-31g(d).firefly.inp (generated)

004415230.b3lyp_6-31g(d).smash.inp (generated)

004415230.b3lyp_6-31g(d).nwchem.inp (generated) 004415230.b3lyp_6-31g(d).log.xz 004415230.mol 004415230.PUBCHEM 004415230.mol (via Jmol)
004415233.b3lyp_6-31g(d).inp

004415233.b3lyp_6-31g(d).qchem.inp (generated)

004415233.b3lyp_6-31g(d).gjf (generated)

004415233.b3lyp_6-31g(d).firefly.inp (generated)

004415233.b3lyp_6-31g(d).smash.inp (generated)

004415233.b3lyp_6-31g(d).nwchem.inp (generated) 004415233.b3lyp_6-31g(d).log.xz 004415233.mol 004415233.PUBCHEM 004415233.mol (via Jmol)
004415275.b3lyp_6-31g(d).inp

004415275.b3lyp_6-31g(d).qchem.inp (generated)

004415275.b3lyp_6-31g(d).gjf (generated)

004415275.b3lyp_6-31g(d).firefly.inp (generated)

004415275.b3lyp_6-31g(d).smash.inp (generated)

004415275.b3lyp_6-31g(d).nwchem.inp (generated) 004415275.b3lyp_6-31g(d).log.xz 004415275.td-b3lyp_6-31g+(d).inp 004415275.td-b3lyp_6-31g+(d).log.xz

004415275.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415275.td-b3lyp_6-31+g(d).gjf (generated)

004415275.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415275.mol 004415275.PUBCHEM 004415275.mol (via Jmol)
004415276.b3lyp_6-31g(d).inp

004415276.b3lyp_6-31g(d).qchem.inp (generated)

004415276.b3lyp_6-31g(d).gjf (generated)

004415276.b3lyp_6-31g(d).firefly.inp (generated)

004415276.b3lyp_6-31g(d).smash.inp (generated)

004415276.b3lyp_6-31g(d).nwchem.inp (generated) 004415276.b3lyp_6-31g(d).log.xz 004415276.td-b3lyp_6-31g+(d).inp 004415276.td-b3lyp_6-31g+(d).log.xz

004415276.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415276.td-b3lyp_6-31+g(d).gjf (generated)

004415276.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415276.mol 004415276.PUBCHEM 004415276.mol (via Jmol)
004415278.b3lyp_6-31g(d).inp

004415278.b3lyp_6-31g(d).qchem.inp (generated)

004415278.b3lyp_6-31g(d).gjf (generated)

004415278.b3lyp_6-31g(d).firefly.inp (generated)

004415278.b3lyp_6-31g(d).smash.inp (generated)

004415278.b3lyp_6-31g(d).nwchem.inp (generated) 004415278.b3lyp_6-31g(d).log.xz 004415278.td-b3lyp_6-31g+(d).inp 004415278.td-b3lyp_6-31g+(d).log.xz

004415278.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415278.td-b3lyp_6-31+g(d).gjf (generated)

004415278.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415278.mol 004415278.PUBCHEM 004415278.mol (via Jmol)
004415287.b3lyp_6-31g(d).inp

004415287.b3lyp_6-31g(d).qchem.inp (generated)

004415287.b3lyp_6-31g(d).gjf (generated)

004415287.b3lyp_6-31g(d).firefly.inp (generated)

004415287.b3lyp_6-31g(d).smash.inp (generated)

004415287.b3lyp_6-31g(d).nwchem.inp (generated) 004415287.b3lyp_6-31g(d).log.xz 004415287.mol 004415287.PUBCHEM 004415287.mol (via Jmol)
004415353.b3lyp_6-31g(d).inp

004415353.b3lyp_6-31g(d).qchem.inp (generated)

004415353.b3lyp_6-31g(d).gjf (generated)

004415353.b3lyp_6-31g(d).firefly.inp (generated)

004415353.b3lyp_6-31g(d).smash.inp (generated)

004415353.b3lyp_6-31g(d).nwchem.inp (generated) 004415353.b3lyp_6-31g(d).log.xz 004415353.td-b3lyp_6-31g+(d).inp 004415353.td-b3lyp_6-31g+(d).log.xz

004415353.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415353.td-b3lyp_6-31+g(d).gjf (generated)

004415353.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415353.mol 004415353.PUBCHEM 004415353.mol (via Jmol)
004415400.b3lyp_6-31g(d).inp

004415400.b3lyp_6-31g(d).qchem.inp (generated)

004415400.b3lyp_6-31g(d).gjf (generated)

004415400.b3lyp_6-31g(d).firefly.inp (generated)

004415400.b3lyp_6-31g(d).smash.inp (generated)

004415400.b3lyp_6-31g(d).nwchem.inp (generated) 004415400.b3lyp_6-31g(d).log.xz 004415400.td-b3lyp_6-31g+(d).inp 004415400.td-b3lyp_6-31g+(d).log.xz

004415400.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415400.td-b3lyp_6-31+g(d).gjf (generated)

004415400.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415400.mol 004415400.PUBCHEM 004415400.mol (via Jmol)
004415433.b3lyp_6-31g(d).inp

004415433.b3lyp_6-31g(d).qchem.inp (generated)

004415433.b3lyp_6-31g(d).gjf (generated)

004415433.b3lyp_6-31g(d).firefly.inp (generated)

004415433.b3lyp_6-31g(d).smash.inp (generated)

004415433.b3lyp_6-31g(d).nwchem.inp (generated) 004415433.b3lyp_6-31g(d).log.xz 004415433.td-b3lyp_6-31g+(d).inp 004415433.td-b3lyp_6-31g+(d).log.xz

004415433.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415433.td-b3lyp_6-31+g(d).gjf (generated)

004415433.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415433.mol 004415433.PUBCHEM 004415433.mol (via Jmol)
004415475.b3lyp_6-31g(d).inp

004415475.b3lyp_6-31g(d).qchem.inp (generated)

004415475.b3lyp_6-31g(d).gjf (generated)

004415475.b3lyp_6-31g(d).firefly.inp (generated)

004415475.b3lyp_6-31g(d).smash.inp (generated)

004415475.b3lyp_6-31g(d).nwchem.inp (generated) 004415475.b3lyp_6-31g(d).log.xz 004415475.mol 004415475.PUBCHEM 004415475.mol (via Jmol)
004415476.b3lyp_6-31g(d).inp

004415476.b3lyp_6-31g(d).qchem.inp (generated)

004415476.b3lyp_6-31g(d).gjf (generated)

004415476.b3lyp_6-31g(d).firefly.inp (generated)

004415476.b3lyp_6-31g(d).smash.inp (generated)

004415476.b3lyp_6-31g(d).nwchem.inp (generated) 004415476.b3lyp_6-31g(d).log.xz 004415476.td-b3lyp_6-31g+(d).inp 004415476.td-b3lyp_6-31g+(d).log.xz

004415476.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415476.td-b3lyp_6-31+g(d).gjf (generated)

004415476.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415476.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415476.mol 004415476.PUBCHEM 004415476.mol (via Jmol)
004415478.b3lyp_6-31g(d).inp

004415478.b3lyp_6-31g(d).qchem.inp (generated)

004415478.b3lyp_6-31g(d).gjf (generated)

004415478.b3lyp_6-31g(d).firefly.inp (generated)

004415478.b3lyp_6-31g(d).smash.inp (generated)

004415478.b3lyp_6-31g(d).nwchem.inp (generated) 004415478.b3lyp_6-31g(d).log.xz 004415478.td-b3lyp_6-31g+(d).inp 004415478.td-b3lyp_6-31g+(d).log.xz

004415478.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415478.td-b3lyp_6-31+g(d).gjf (generated)

004415478.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415478.mol 004415478.PUBCHEM 004415478.mol (via Jmol)
004415496.b3lyp_6-31g(d).inp

004415496.b3lyp_6-31g(d).qchem.inp (generated)

004415496.b3lyp_6-31g(d).gjf (generated)

004415496.b3lyp_6-31g(d).firefly.inp (generated)

004415496.b3lyp_6-31g(d).smash.inp (generated)

004415496.b3lyp_6-31g(d).nwchem.inp (generated) 004415496.b3lyp_6-31g(d).log.xz 004415496.td-b3lyp_6-31g+(d).inp 004415496.td-b3lyp_6-31g+(d).log.xz

004415496.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415496.td-b3lyp_6-31+g(d).gjf (generated)

004415496.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415496.mol 004415496.PUBCHEM 004415496.mol (via Jmol)
004415664.b3lyp_6-31g(d).inp

004415664.b3lyp_6-31g(d).qchem.inp (generated)

004415664.b3lyp_6-31g(d).gjf (generated)

004415664.b3lyp_6-31g(d).firefly.inp (generated)

004415664.b3lyp_6-31g(d).smash.inp (generated)

004415664.b3lyp_6-31g(d).nwchem.inp (generated) 004415664.b3lyp_6-31g(d).log.xz 004415664.td-b3lyp_6-31g+(d).inp 004415664.td-b3lyp_6-31g+(d).log.xz

004415664.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415664.td-b3lyp_6-31+g(d).gjf (generated)

004415664.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415664.mol 004415664.PUBCHEM 004415664.mol (via Jmol)
004415670.b3lyp_6-31g(d).inp

004415670.b3lyp_6-31g(d).qchem.inp (generated)

004415670.b3lyp_6-31g(d).gjf (generated)

004415670.b3lyp_6-31g(d).firefly.inp (generated)

004415670.b3lyp_6-31g(d).smash.inp (generated)

004415670.b3lyp_6-31g(d).nwchem.inp (generated) 004415670.b3lyp_6-31g(d).log.xz 004415670.td-b3lyp_6-31g+(d).inp 004415670.td-b3lyp_6-31g+(d).log.xz

004415670.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415670.td-b3lyp_6-31+g(d).gjf (generated)

004415670.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415670.mol 004415670.PUBCHEM 004415670.mol (via Jmol)
004415685.b3lyp_6-31g(d).inp

004415685.b3lyp_6-31g(d).qchem.inp (generated)

004415685.b3lyp_6-31g(d).gjf (generated)

004415685.b3lyp_6-31g(d).firefly.inp (generated)

004415685.b3lyp_6-31g(d).smash.inp (generated)

004415685.b3lyp_6-31g(d).nwchem.inp (generated) 004415685.b3lyp_6-31g(d).log.xz 004415685.td-b3lyp_6-31g+(d).inp 004415685.td-b3lyp_6-31g+(d).log.xz

004415685.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415685.td-b3lyp_6-31+g(d).gjf (generated)

004415685.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415685.mol 004415685.PUBCHEM 004415685.mol (via Jmol)
004415686.b3lyp_6-31g(d).inp

004415686.b3lyp_6-31g(d).qchem.inp (generated)

004415686.b3lyp_6-31g(d).gjf (generated)

004415686.b3lyp_6-31g(d).firefly.inp (generated)

004415686.b3lyp_6-31g(d).smash.inp (generated)

004415686.b3lyp_6-31g(d).nwchem.inp (generated) 004415686.b3lyp_6-31g(d).log.xz 004415686.td-b3lyp_6-31g+(d).inp 004415686.td-b3lyp_6-31g+(d).log.xz

004415686.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415686.td-b3lyp_6-31+g(d).gjf (generated)

004415686.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415686.mol 004415686.PUBCHEM 004415686.mol (via Jmol)
004415757.b3lyp_6-31g(d).inp

004415757.b3lyp_6-31g(d).qchem.inp (generated)

004415757.b3lyp_6-31g(d).gjf (generated)

004415757.b3lyp_6-31g(d).firefly.inp (generated)

004415757.b3lyp_6-31g(d).smash.inp (generated)

004415757.b3lyp_6-31g(d).nwchem.inp (generated) 004415757.b3lyp_6-31g(d).log.xz 004415757.td-b3lyp_6-31g+(d).inp 004415757.td-b3lyp_6-31g+(d).log.xz

004415757.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415757.td-b3lyp_6-31+g(d).gjf (generated)

004415757.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415757.mol 004415757.PUBCHEM 004415757.mol (via Jmol)
004415770.b3lyp_6-31g(d).inp

004415770.b3lyp_6-31g(d).qchem.inp (generated)

004415770.b3lyp_6-31g(d).gjf (generated)

004415770.b3lyp_6-31g(d).firefly.inp (generated)

004415770.b3lyp_6-31g(d).smash.inp (generated)

004415770.b3lyp_6-31g(d).nwchem.inp (generated) 004415770.b3lyp_6-31g(d).log.xz 004415770.td-b3lyp_6-31g+(d).inp 004415770.td-b3lyp_6-31g+(d).log.xz

004415770.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415770.td-b3lyp_6-31+g(d).gjf (generated)

004415770.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415770.mol 004415770.PUBCHEM 004415770.mol (via Jmol)
004415856.b3lyp_6-31g(d).inp

004415856.b3lyp_6-31g(d).qchem.inp (generated)

004415856.b3lyp_6-31g(d).gjf (generated)

004415856.b3lyp_6-31g(d).firefly.inp (generated)

004415856.b3lyp_6-31g(d).smash.inp (generated)

004415856.b3lyp_6-31g(d).nwchem.inp (generated) 004415856.b3lyp_6-31g(d).log.xz 004415856.td-b3lyp_6-31g+(d).inp 004415856.td-b3lyp_6-31g+(d).log.xz

004415856.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415856.td-b3lyp_6-31+g(d).gjf (generated)

004415856.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415856.mol 004415856.PUBCHEM 004415856.mol (via Jmol)
004415859.b3lyp_6-31g(d).inp

004415859.b3lyp_6-31g(d).qchem.inp (generated)

004415859.b3lyp_6-31g(d).gjf (generated)

004415859.b3lyp_6-31g(d).firefly.inp (generated)

004415859.b3lyp_6-31g(d).smash.inp (generated)

004415859.b3lyp_6-31g(d).nwchem.inp (generated) 004415859.b3lyp_6-31g(d).log.xz 004415859.td-b3lyp_6-31g+(d).inp 004415859.td-b3lyp_6-31g+(d).log.xz

004415859.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415859.td-b3lyp_6-31+g(d).gjf (generated)

004415859.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415859.mol 004415859.PUBCHEM 004415859.mol (via Jmol)
004415903.b3lyp_6-31g(d).inp

004415903.b3lyp_6-31g(d).qchem.inp (generated)

004415903.b3lyp_6-31g(d).gjf (generated)

004415903.b3lyp_6-31g(d).firefly.inp (generated)

004415903.b3lyp_6-31g(d).smash.inp (generated)

004415903.b3lyp_6-31g(d).nwchem.inp (generated) 004415903.b3lyp_6-31g(d).log.xz 004415903.td-b3lyp_6-31g+(d).inp 004415903.td-b3lyp_6-31g+(d).log.xz

004415903.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415903.td-b3lyp_6-31+g(d).gjf (generated)

004415903.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415903.mol 004415903.PUBCHEM 004415903.mol (via Jmol)
004415914.b3lyp_6-31g(d).inp

004415914.b3lyp_6-31g(d).qchem.inp (generated)

004415914.b3lyp_6-31g(d).gjf (generated)

004415914.b3lyp_6-31g(d).firefly.inp (generated)

004415914.b3lyp_6-31g(d).smash.inp (generated)

004415914.b3lyp_6-31g(d).nwchem.inp (generated) 004415914.b3lyp_6-31g(d).log.xz 004415914.td-b3lyp_6-31g+(d).inp 004415914.td-b3lyp_6-31g+(d).log.xz

004415914.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415914.td-b3lyp_6-31+g(d).gjf (generated)

004415914.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415914.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415914.mol 004415914.PUBCHEM 004415914.mol (via Jmol)
004415947.b3lyp_6-31g(d).inp

004415947.b3lyp_6-31g(d).qchem.inp (generated)

004415947.b3lyp_6-31g(d).gjf (generated)

004415947.b3lyp_6-31g(d).firefly.inp (generated)

004415947.b3lyp_6-31g(d).smash.inp (generated)

004415947.b3lyp_6-31g(d).nwchem.inp (generated) 004415947.b3lyp_6-31g(d).log.xz 004415947.td-b3lyp_6-31g+(d).inp 004415947.td-b3lyp_6-31g+(d).log.xz

004415947.td-b3lyp_6-31+g(d).qchem.inp (generated)

004415947.td-b3lyp_6-31+g(d).gjf (generated)

004415947.td-b3lyp_6-31+g(d).firefly.inp (generated)

004415947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004415947.mol 004415947.PUBCHEM 004415947.mol (via Jmol)
004416029.b3lyp_6-31g(d).inp

004416029.b3lyp_6-31g(d).qchem.inp (generated)

004416029.b3lyp_6-31g(d).gjf (generated)

004416029.b3lyp_6-31g(d).firefly.inp (generated)

004416029.b3lyp_6-31g(d).smash.inp (generated)

004416029.b3lyp_6-31g(d).nwchem.inp (generated) 004416029.b3lyp_6-31g(d).log.xz 004416029.td-b3lyp_6-31g+(d).inp 004416029.td-b3lyp_6-31g+(d).log.xz

004416029.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416029.td-b3lyp_6-31+g(d).gjf (generated)

004416029.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416029.mol 004416029.PUBCHEM 004416029.mol (via Jmol)
004416031.b3lyp_6-31g(d).inp

004416031.b3lyp_6-31g(d).qchem.inp (generated)

004416031.b3lyp_6-31g(d).gjf (generated)

004416031.b3lyp_6-31g(d).firefly.inp (generated)

004416031.b3lyp_6-31g(d).smash.inp (generated)

004416031.b3lyp_6-31g(d).nwchem.inp (generated) 004416031.b3lyp_6-31g(d).log.xz 004416031.td-b3lyp_6-31g+(d).inp 004416031.td-b3lyp_6-31g+(d).log.xz

004416031.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416031.td-b3lyp_6-31+g(d).gjf (generated)

004416031.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416031.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416031.mol 004416031.PUBCHEM 004416031.mol (via Jmol)
004416033.b3lyp_6-31g(d).inp

004416033.b3lyp_6-31g(d).qchem.inp (generated)

004416033.b3lyp_6-31g(d).gjf (generated)

004416033.b3lyp_6-31g(d).firefly.inp (generated)

004416033.b3lyp_6-31g(d).smash.inp (generated)

004416033.b3lyp_6-31g(d).nwchem.inp (generated) 004416033.b3lyp_6-31g(d).log.xz 004416033.mol 004416033.PUBCHEM 004416033.mol (via Jmol)
004416034.b3lyp_6-31g(d).inp

004416034.b3lyp_6-31g(d).qchem.inp (generated)

004416034.b3lyp_6-31g(d).gjf (generated)

004416034.b3lyp_6-31g(d).firefly.inp (generated)

004416034.b3lyp_6-31g(d).smash.inp (generated)

004416034.b3lyp_6-31g(d).nwchem.inp (generated) 004416034.b3lyp_6-31g(d).log.xz 004416034.td-b3lyp_6-31g+(d).inp 004416034.td-b3lyp_6-31g+(d).log.xz

004416034.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416034.td-b3lyp_6-31+g(d).gjf (generated)

004416034.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416034.mol 004416034.PUBCHEM 004416034.mol (via Jmol)
004416065.b3lyp_6-31g(d).inp

004416065.b3lyp_6-31g(d).qchem.inp (generated)

004416065.b3lyp_6-31g(d).gjf (generated)

004416065.b3lyp_6-31g(d).firefly.inp (generated)

004416065.b3lyp_6-31g(d).smash.inp (generated)

004416065.b3lyp_6-31g(d).nwchem.inp (generated) 004416065.b3lyp_6-31g(d).log.xz 004416065.td-b3lyp_6-31g+(d).inp 004416065.td-b3lyp_6-31g+(d).log.xz

004416065.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416065.td-b3lyp_6-31+g(d).gjf (generated)

004416065.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416065.mol 004416065.PUBCHEM 004416065.mol (via Jmol)
004416104.b3lyp_6-31g(d).inp

004416104.b3lyp_6-31g(d).qchem.inp (generated)

004416104.b3lyp_6-31g(d).gjf (generated)

004416104.b3lyp_6-31g(d).firefly.inp (generated)

004416104.b3lyp_6-31g(d).smash.inp (generated)

004416104.b3lyp_6-31g(d).nwchem.inp (generated) 004416104.b3lyp_6-31g(d).log.xz 004416104.td-b3lyp_6-31g+(d).inp 004416104.td-b3lyp_6-31g+(d).log.xz

004416104.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416104.td-b3lyp_6-31+g(d).gjf (generated)

004416104.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416104.mol 004416104.PUBCHEM 004416104.mol (via Jmol)
004416116.b3lyp_6-31g(d).inp

004416116.b3lyp_6-31g(d).qchem.inp (generated)

004416116.b3lyp_6-31g(d).gjf (generated)

004416116.b3lyp_6-31g(d).firefly.inp (generated)

004416116.b3lyp_6-31g(d).smash.inp (generated)

004416116.b3lyp_6-31g(d).nwchem.inp (generated) 004416116.b3lyp_6-31g(d).log.xz 004416116.td-b3lyp_6-31g+(d).inp 004416116.td-b3lyp_6-31g+(d).log.xz

004416116.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416116.td-b3lyp_6-31+g(d).gjf (generated)

004416116.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416116.mol 004416116.PUBCHEM 004416116.mol (via Jmol)
004416172.b3lyp_6-31g(d).inp

004416172.b3lyp_6-31g(d).qchem.inp (generated)

004416172.b3lyp_6-31g(d).gjf (generated)

004416172.b3lyp_6-31g(d).firefly.inp (generated)

004416172.b3lyp_6-31g(d).smash.inp (generated)

004416172.b3lyp_6-31g(d).nwchem.inp (generated) 004416172.b3lyp_6-31g(d).log.xz 004416172.td-b3lyp_6-31g+(d).inp 004416172.td-b3lyp_6-31g+(d).log.xz

004416172.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416172.td-b3lyp_6-31+g(d).gjf (generated)

004416172.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416172.mol 004416172.PUBCHEM 004416172.mol (via Jmol)
004416174.b3lyp_6-31g(d).inp

004416174.b3lyp_6-31g(d).qchem.inp (generated)

004416174.b3lyp_6-31g(d).gjf (generated)

004416174.b3lyp_6-31g(d).firefly.inp (generated)

004416174.b3lyp_6-31g(d).smash.inp (generated)

004416174.b3lyp_6-31g(d).nwchem.inp (generated) 004416174.b3lyp_6-31g(d).log.xz 004416174.td-b3lyp_6-31g+(d).inp 004416174.td-b3lyp_6-31g+(d).log.xz

004416174.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416174.td-b3lyp_6-31+g(d).gjf (generated)

004416174.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416174.mol 004416174.PUBCHEM 004416174.mol (via Jmol)
004416179.b3lyp_6-31g(d).inp

004416179.b3lyp_6-31g(d).qchem.inp (generated)

004416179.b3lyp_6-31g(d).gjf (generated)

004416179.b3lyp_6-31g(d).firefly.inp (generated)

004416179.b3lyp_6-31g(d).smash.inp (generated)

004416179.b3lyp_6-31g(d).nwchem.inp (generated) 004416179.b3lyp_6-31g(d).log.xz 004416179.mol 004416179.PUBCHEM 004416179.mol (via Jmol)
004416180.b3lyp_6-31g(d).inp

004416180.b3lyp_6-31g(d).qchem.inp (generated)

004416180.b3lyp_6-31g(d).gjf (generated)

004416180.b3lyp_6-31g(d).firefly.inp (generated)

004416180.b3lyp_6-31g(d).smash.inp (generated)

004416180.b3lyp_6-31g(d).nwchem.inp (generated) 004416180.b3lyp_6-31g(d).log.xz 004416180.td-b3lyp_6-31g+(d).inp 004416180.td-b3lyp_6-31g+(d).log.xz

004416180.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416180.td-b3lyp_6-31+g(d).gjf (generated)

004416180.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416180.mol 004416180.PUBCHEM 004416180.mol (via Jmol)
004416192.b3lyp_6-31g(d).inp

004416192.b3lyp_6-31g(d).qchem.inp (generated)

004416192.b3lyp_6-31g(d).gjf (generated)

004416192.b3lyp_6-31g(d).firefly.inp (generated)

004416192.b3lyp_6-31g(d).smash.inp (generated)

004416192.b3lyp_6-31g(d).nwchem.inp (generated) 004416192.b3lyp_6-31g(d).log.xz 004416192.td-b3lyp_6-31g+(d).inp 004416192.td-b3lyp_6-31g+(d).log.xz

004416192.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416192.td-b3lyp_6-31+g(d).gjf (generated)

004416192.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416192.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416192.mol 004416192.PUBCHEM 004416192.mol (via Jmol)
004416223.b3lyp_6-31g(d).inp

004416223.b3lyp_6-31g(d).qchem.inp (generated)

004416223.b3lyp_6-31g(d).gjf (generated)

004416223.b3lyp_6-31g(d).firefly.inp (generated)

004416223.b3lyp_6-31g(d).smash.inp (generated)

004416223.b3lyp_6-31g(d).nwchem.inp (generated) 004416223.b3lyp_6-31g(d).log.xz 004416223.td-b3lyp_6-31g+(d).inp 004416223.td-b3lyp_6-31g+(d).log.xz

004416223.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416223.td-b3lyp_6-31+g(d).gjf (generated)

004416223.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416223.mol 004416223.PUBCHEM 004416223.mol (via Jmol)
004416234.b3lyp_6-31g(d).inp

004416234.b3lyp_6-31g(d).qchem.inp (generated)

004416234.b3lyp_6-31g(d).gjf (generated)

004416234.b3lyp_6-31g(d).firefly.inp (generated)

004416234.b3lyp_6-31g(d).smash.inp (generated)

004416234.b3lyp_6-31g(d).nwchem.inp (generated) 004416234.b3lyp_6-31g(d).log.xz 004416234.td-b3lyp_6-31g+(d).inp 004416234.td-b3lyp_6-31g+(d).log.xz

004416234.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416234.td-b3lyp_6-31+g(d).gjf (generated)

004416234.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416234.mol 004416234.PUBCHEM 004416234.mol (via Jmol)
004416240.b3lyp_6-31g(d).inp

004416240.b3lyp_6-31g(d).qchem.inp (generated)

004416240.b3lyp_6-31g(d).gjf (generated)

004416240.b3lyp_6-31g(d).firefly.inp (generated)

004416240.b3lyp_6-31g(d).smash.inp (generated)

004416240.b3lyp_6-31g(d).nwchem.inp (generated) 004416240.b3lyp_6-31g(d).log.xz 004416240.td-b3lyp_6-31g+(d).inp 004416240.td-b3lyp_6-31g+(d).log.xz

004416240.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416240.td-b3lyp_6-31+g(d).gjf (generated)

004416240.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416240.mol 004416240.PUBCHEM 004416240.mol (via Jmol)
004416259.b3lyp_6-31g(d).inp

004416259.b3lyp_6-31g(d).qchem.inp (generated)

004416259.b3lyp_6-31g(d).gjf (generated)

004416259.b3lyp_6-31g(d).firefly.inp (generated)

004416259.b3lyp_6-31g(d).smash.inp (generated)

004416259.b3lyp_6-31g(d).nwchem.inp (generated) 004416259.b3lyp_6-31g(d).log.xz 004416259.td-b3lyp_6-31g+(d).inp 004416259.td-b3lyp_6-31g+(d).log.xz

004416259.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416259.td-b3lyp_6-31+g(d).gjf (generated)

004416259.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416259.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416259.mol 004416259.PUBCHEM 004416259.mol (via Jmol)
004416277.b3lyp_6-31g(d).inp

004416277.b3lyp_6-31g(d).qchem.inp (generated)

004416277.b3lyp_6-31g(d).gjf (generated)

004416277.b3lyp_6-31g(d).firefly.inp (generated)

004416277.b3lyp_6-31g(d).smash.inp (generated)

004416277.b3lyp_6-31g(d).nwchem.inp (generated) 004416277.b3lyp_6-31g(d).log.xz 004416277.td-b3lyp_6-31g+(d).inp 004416277.td-b3lyp_6-31g+(d).log.xz

004416277.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416277.td-b3lyp_6-31+g(d).gjf (generated)

004416277.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416277.mol 004416277.PUBCHEM 004416277.mol (via Jmol)
004416278.b3lyp_6-31g(d).inp

004416278.b3lyp_6-31g(d).qchem.inp (generated)

004416278.b3lyp_6-31g(d).gjf (generated)

004416278.b3lyp_6-31g(d).firefly.inp (generated)

004416278.b3lyp_6-31g(d).smash.inp (generated)

004416278.b3lyp_6-31g(d).nwchem.inp (generated) 004416278.b3lyp_6-31g(d).log.xz 004416278.td-b3lyp_6-31g+(d).inp 004416278.td-b3lyp_6-31g+(d).log.xz

004416278.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416278.td-b3lyp_6-31+g(d).gjf (generated)

004416278.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416278.mol 004416278.PUBCHEM 004416278.mol (via Jmol)
004416279.b3lyp_6-31g(d).inp

004416279.b3lyp_6-31g(d).qchem.inp (generated)

004416279.b3lyp_6-31g(d).gjf (generated)

004416279.b3lyp_6-31g(d).firefly.inp (generated)

004416279.b3lyp_6-31g(d).smash.inp (generated)

004416279.b3lyp_6-31g(d).nwchem.inp (generated) 004416279.b3lyp_6-31g(d).log.xz 004416279.td-b3lyp_6-31g+(d).inp 004416279.td-b3lyp_6-31g+(d).log.xz

004416279.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416279.td-b3lyp_6-31+g(d).gjf (generated)

004416279.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416279.mol 004416279.PUBCHEM 004416279.mol (via Jmol)
004416281.b3lyp_6-31g(d).inp

004416281.b3lyp_6-31g(d).qchem.inp (generated)

004416281.b3lyp_6-31g(d).gjf (generated)

004416281.b3lyp_6-31g(d).firefly.inp (generated)

004416281.b3lyp_6-31g(d).smash.inp (generated)

004416281.b3lyp_6-31g(d).nwchem.inp (generated) 004416281.b3lyp_6-31g(d).log.xz 004416281.td-b3lyp_6-31g+(d).inp 004416281.td-b3lyp_6-31g+(d).log.xz

004416281.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416281.td-b3lyp_6-31+g(d).gjf (generated)

004416281.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416281.mol 004416281.PUBCHEM 004416281.mol (via Jmol)
004416282.b3lyp_6-31g(d).inp

004416282.b3lyp_6-31g(d).qchem.inp (generated)

004416282.b3lyp_6-31g(d).gjf (generated)

004416282.b3lyp_6-31g(d).firefly.inp (generated)

004416282.b3lyp_6-31g(d).smash.inp (generated)

004416282.b3lyp_6-31g(d).nwchem.inp (generated) 004416282.b3lyp_6-31g(d).log.xz 004416282.td-b3lyp_6-31g+(d).inp 004416282.td-b3lyp_6-31g+(d).log.xz

004416282.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416282.td-b3lyp_6-31+g(d).gjf (generated)

004416282.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416282.mol 004416282.PUBCHEM 004416282.mol (via Jmol)
004416298.b3lyp_6-31g(d).inp

004416298.b3lyp_6-31g(d).qchem.inp (generated)

004416298.b3lyp_6-31g(d).gjf (generated)

004416298.b3lyp_6-31g(d).firefly.inp (generated)

004416298.b3lyp_6-31g(d).smash.inp (generated)

004416298.b3lyp_6-31g(d).nwchem.inp (generated) 004416298.b3lyp_6-31g(d).log.xz 004416298.td-b3lyp_6-31g+(d).inp 004416298.td-b3lyp_6-31g+(d).log.xz

004416298.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416298.td-b3lyp_6-31+g(d).gjf (generated)

004416298.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416298.mol 004416298.PUBCHEM 004416298.mol (via Jmol)
004416416.b3lyp_6-31g(d).inp

004416416.b3lyp_6-31g(d).qchem.inp (generated)

004416416.b3lyp_6-31g(d).gjf (generated)

004416416.b3lyp_6-31g(d).firefly.inp (generated)

004416416.b3lyp_6-31g(d).smash.inp (generated)

004416416.b3lyp_6-31g(d).nwchem.inp (generated) 004416416.b3lyp_6-31g(d).log.xz 004416416.mol 004416416.PUBCHEM 004416416.mol (via Jmol)
004416506.b3lyp_6-31g(d).inp

004416506.b3lyp_6-31g(d).qchem.inp (generated)

004416506.b3lyp_6-31g(d).gjf (generated)

004416506.b3lyp_6-31g(d).firefly.inp (generated)

004416506.b3lyp_6-31g(d).smash.inp (generated)

004416506.b3lyp_6-31g(d).nwchem.inp (generated) 004416506.b3lyp_6-31g(d).log.xz 004416506.mol 004416506.PUBCHEM 004416506.mol (via Jmol)
004416554.b3lyp_6-31g(d).inp

004416554.b3lyp_6-31g(d).qchem.inp (generated)

004416554.b3lyp_6-31g(d).gjf (generated)

004416554.b3lyp_6-31g(d).firefly.inp (generated)

004416554.b3lyp_6-31g(d).smash.inp (generated)

004416554.b3lyp_6-31g(d).nwchem.inp (generated) 004416554.b3lyp_6-31g(d).log.xz 004416554.td-b3lyp_6-31g+(d).inp 004416554.td-b3lyp_6-31g+(d).log.xz

004416554.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416554.td-b3lyp_6-31+g(d).gjf (generated)

004416554.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416554.mol 004416554.PUBCHEM 004416554.mol (via Jmol)
004416663.b3lyp_6-31g(d).inp

004416663.b3lyp_6-31g(d).qchem.inp (generated)

004416663.b3lyp_6-31g(d).gjf (generated)

004416663.b3lyp_6-31g(d).firefly.inp (generated)

004416663.b3lyp_6-31g(d).smash.inp (generated)

004416663.b3lyp_6-31g(d).nwchem.inp (generated) 004416663.b3lyp_6-31g(d).log.xz 004416663.td-b3lyp_6-31g+(d).inp 004416663.td-b3lyp_6-31g+(d).log.xz

004416663.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416663.td-b3lyp_6-31+g(d).gjf (generated)

004416663.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416663.mol 004416663.PUBCHEM 004416663.mol (via Jmol)
004416694.b3lyp_6-31g(d).inp

004416694.b3lyp_6-31g(d).qchem.inp (generated)

004416694.b3lyp_6-31g(d).gjf (generated)

004416694.b3lyp_6-31g(d).firefly.inp (generated)

004416694.b3lyp_6-31g(d).smash.inp (generated)

004416694.b3lyp_6-31g(d).nwchem.inp (generated) 004416694.b3lyp_6-31g(d).log.xz 004416694.td-b3lyp_6-31g+(d).inp 004416694.td-b3lyp_6-31g+(d).log.xz

004416694.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416694.td-b3lyp_6-31+g(d).gjf (generated)

004416694.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416694.mol 004416694.PUBCHEM 004416694.mol (via Jmol)
004416716.b3lyp_6-31g(d).inp

004416716.b3lyp_6-31g(d).qchem.inp (generated)

004416716.b3lyp_6-31g(d).gjf (generated)

004416716.b3lyp_6-31g(d).firefly.inp (generated)

004416716.b3lyp_6-31g(d).smash.inp (generated)

004416716.b3lyp_6-31g(d).nwchem.inp (generated) 004416716.b3lyp_6-31g(d).log.xz 004416716.td-b3lyp_6-31g+(d).inp 004416716.td-b3lyp_6-31g+(d).log.xz

004416716.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416716.td-b3lyp_6-31+g(d).gjf (generated)

004416716.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416716.mol 004416716.PUBCHEM 004416716.mol (via Jmol)
004416720.b3lyp_6-31g(d).inp

004416720.b3lyp_6-31g(d).qchem.inp (generated)

004416720.b3lyp_6-31g(d).gjf (generated)

004416720.b3lyp_6-31g(d).firefly.inp (generated)

004416720.b3lyp_6-31g(d).smash.inp (generated)

004416720.b3lyp_6-31g(d).nwchem.inp (generated) 004416720.b3lyp_6-31g(d).log.xz 004416720.td-b3lyp_6-31g+(d).inp 004416720.td-b3lyp_6-31g+(d).log.xz

004416720.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416720.td-b3lyp_6-31+g(d).gjf (generated)

004416720.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416720.mol 004416720.PUBCHEM 004416720.mol (via Jmol)
004416721.b3lyp_6-31g(d).inp

004416721.b3lyp_6-31g(d).qchem.inp (generated)

004416721.b3lyp_6-31g(d).gjf (generated)

004416721.b3lyp_6-31g(d).firefly.inp (generated)

004416721.b3lyp_6-31g(d).smash.inp (generated)

004416721.b3lyp_6-31g(d).nwchem.inp (generated) 004416721.b3lyp_6-31g(d).log.xz 004416721.td-b3lyp_6-31g+(d).inp 004416721.td-b3lyp_6-31g+(d).log.xz

004416721.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416721.td-b3lyp_6-31+g(d).gjf (generated)

004416721.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416721.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416721.mol 004416721.PUBCHEM 004416721.mol (via Jmol)
004416733.b3lyp_6-31g(d).inp

004416733.b3lyp_6-31g(d).qchem.inp (generated)

004416733.b3lyp_6-31g(d).gjf (generated)

004416733.b3lyp_6-31g(d).firefly.inp (generated)

004416733.b3lyp_6-31g(d).smash.inp (generated)

004416733.b3lyp_6-31g(d).nwchem.inp (generated) 004416733.b3lyp_6-31g(d).log.xz 004416733.td-b3lyp_6-31g+(d).inp 004416733.td-b3lyp_6-31g+(d).log.xz

004416733.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416733.td-b3lyp_6-31+g(d).gjf (generated)

004416733.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416733.mol 004416733.PUBCHEM 004416733.mol (via Jmol)
004416753.b3lyp_6-31g(d).inp

004416753.b3lyp_6-31g(d).qchem.inp (generated)

004416753.b3lyp_6-31g(d).gjf (generated)

004416753.b3lyp_6-31g(d).firefly.inp (generated)

004416753.b3lyp_6-31g(d).smash.inp (generated)

004416753.b3lyp_6-31g(d).nwchem.inp (generated) 004416753.b3lyp_6-31g(d).log.xz 004416753.td-b3lyp_6-31g+(d).inp 004416753.td-b3lyp_6-31g+(d).log.xz

004416753.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416753.td-b3lyp_6-31+g(d).gjf (generated)

004416753.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416753.mol 004416753.PUBCHEM 004416753.mol (via Jmol)
004416842.b3lyp_6-31g(d).inp

004416842.b3lyp_6-31g(d).qchem.inp (generated)

004416842.b3lyp_6-31g(d).gjf (generated)

004416842.b3lyp_6-31g(d).firefly.inp (generated)

004416842.b3lyp_6-31g(d).smash.inp (generated)

004416842.b3lyp_6-31g(d).nwchem.inp (generated) 004416842.b3lyp_6-31g(d).log.xz 004416842.td-b3lyp_6-31g+(d).inp 004416842.td-b3lyp_6-31g+(d).log.xz

004416842.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416842.td-b3lyp_6-31+g(d).gjf (generated)

004416842.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416842.mol 004416842.PUBCHEM 004416842.mol (via Jmol)
004416939.b3lyp_6-31g(d).inp

004416939.b3lyp_6-31g(d).qchem.inp (generated)

004416939.b3lyp_6-31g(d).gjf (generated)

004416939.b3lyp_6-31g(d).firefly.inp (generated)

004416939.b3lyp_6-31g(d).smash.inp (generated)

004416939.b3lyp_6-31g(d).nwchem.inp (generated) 004416939.b3lyp_6-31g(d).log.xz 004416939.td-b3lyp_6-31g+(d).inp 004416939.td-b3lyp_6-31g+(d).log.xz

004416939.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416939.td-b3lyp_6-31+g(d).gjf (generated)

004416939.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416939.mol 004416939.PUBCHEM 004416939.mol (via Jmol)
004416958.b3lyp_6-31g(d).inp

004416958.b3lyp_6-31g(d).qchem.inp (generated)

004416958.b3lyp_6-31g(d).gjf (generated)

004416958.b3lyp_6-31g(d).firefly.inp (generated)

004416958.b3lyp_6-31g(d).smash.inp (generated)

004416958.b3lyp_6-31g(d).nwchem.inp (generated) 004416958.b3lyp_6-31g(d).log.xz 004416958.td-b3lyp_6-31g+(d).inp 004416958.td-b3lyp_6-31g+(d).log.xz

004416958.td-b3lyp_6-31+g(d).qchem.inp (generated)

004416958.td-b3lyp_6-31+g(d).gjf (generated)

004416958.td-b3lyp_6-31+g(d).firefly.inp (generated)

004416958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004416958.mol 004416958.PUBCHEM 004416958.mol (via Jmol)
004417023.b3lyp_6-31g(d).inp

004417023.b3lyp_6-31g(d).qchem.inp (generated)

004417023.b3lyp_6-31g(d).gjf (generated)

004417023.b3lyp_6-31g(d).firefly.inp (generated)

004417023.b3lyp_6-31g(d).smash.inp (generated)

004417023.b3lyp_6-31g(d).nwchem.inp (generated) 004417023.b3lyp_6-31g(d).log.xz 004417023.td-b3lyp_6-31g+(d).inp 004417023.td-b3lyp_6-31g+(d).log.xz

004417023.td-b3lyp_6-31+g(d).qchem.inp (generated)

004417023.td-b3lyp_6-31+g(d).gjf (generated)

004417023.td-b3lyp_6-31+g(d).firefly.inp (generated)

004417023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004417023.mol 004417023.PUBCHEM 004417023.mol (via Jmol)
004417043.b3lyp_6-31g(d).inp

004417043.b3lyp_6-31g(d).qchem.inp (generated)

004417043.b3lyp_6-31g(d).gjf (generated)

004417043.b3lyp_6-31g(d).firefly.inp (generated)

004417043.b3lyp_6-31g(d).smash.inp (generated)

004417043.b3lyp_6-31g(d).nwchem.inp (generated) 004417043.b3lyp_6-31g(d).log.xz 004417043.td-b3lyp_6-31g+(d).inp 004417043.td-b3lyp_6-31g+(d).log.xz

004417043.td-b3lyp_6-31+g(d).qchem.inp (generated)

004417043.td-b3lyp_6-31+g(d).gjf (generated)

004417043.td-b3lyp_6-31+g(d).firefly.inp (generated)

004417043.td-b3lyp_6-31+g(d).nwchem.inp (generated) 004417043.mol 004417043.PUBCHEM 004417043.mol (via Jmol)
004417068.b3lyp_6-31g(d).inp

004417068.b3lyp_6-31g(d).qchem.inp (generated)

004417068.b3lyp_6-31g(d).gjf (generated)

004417068.b3lyp_6-31g(d).firefly.inp (generated)

004417068.b3lyp_6-31g(d).smash.inp (generat