Index of

Last updated : Thu Apr 20 01:52:35 JST 2017
Total : 394 (316) in this page
003975007.b3lyp_6-31g(d).inp

003975007.b3lyp_6-31g(d).qchem.inp (generated)

003975007.b3lyp_6-31g(d).gjf (generated)

003975007.b3lyp_6-31g(d).firefly.inp (generated)

003975007.b3lyp_6-31g(d).smash.inp (generated)

003975007.b3lyp_6-31g(d).nwchem.inp (generated) 003975007.b3lyp_6-31g(d).log.xz 003975007.td-b3lyp_6-31g+(d).inp 003975007.td-b3lyp_6-31g+(d).log.xz

003975007.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975007.td-b3lyp_6-31+g(d).gjf (generated)

003975007.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975007.mol 003975007.PUBCHEM 003975007.mol (via Jmol)
003975056.b3lyp_6-31g(d).inp

003975056.b3lyp_6-31g(d).qchem.inp (generated)

003975056.b3lyp_6-31g(d).gjf (generated)

003975056.b3lyp_6-31g(d).firefly.inp (generated)

003975056.b3lyp_6-31g(d).smash.inp (generated)

003975056.b3lyp_6-31g(d).nwchem.inp (generated) 003975056.b3lyp_6-31g(d).log.xz 003975056.td-b3lyp_6-31g+(d).inp 003975056.td-b3lyp_6-31g+(d).log.xz

003975056.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975056.td-b3lyp_6-31+g(d).gjf (generated)

003975056.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975056.mol 003975056.PUBCHEM 003975056.mol (via Jmol)
003975269.b3lyp_6-31g(d).inp

003975269.b3lyp_6-31g(d).qchem.inp (generated)

003975269.b3lyp_6-31g(d).gjf (generated)

003975269.b3lyp_6-31g(d).firefly.inp (generated)

003975269.b3lyp_6-31g(d).smash.inp (generated)

003975269.b3lyp_6-31g(d).nwchem.inp (generated) 003975269.b3lyp_6-31g(d).log.xz 003975269.mol 003975269.PUBCHEM 003975269.mol (via Jmol)
003975441.b3lyp_6-31g(d).inp

003975441.b3lyp_6-31g(d).qchem.inp (generated)

003975441.b3lyp_6-31g(d).gjf (generated)

003975441.b3lyp_6-31g(d).firefly.inp (generated)

003975441.b3lyp_6-31g(d).smash.inp (generated)

003975441.b3lyp_6-31g(d).nwchem.inp (generated) 003975441.b3lyp_6-31g(d).log.xz 003975441.td-b3lyp_6-31g+(d).inp 003975441.td-b3lyp_6-31g+(d).log.xz

003975441.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975441.td-b3lyp_6-31+g(d).gjf (generated)

003975441.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975441.mol 003975441.PUBCHEM 003975441.mol (via Jmol)
003975444.b3lyp_6-31g(d).inp

003975444.b3lyp_6-31g(d).qchem.inp (generated)

003975444.b3lyp_6-31g(d).gjf (generated)

003975444.b3lyp_6-31g(d).firefly.inp (generated)

003975444.b3lyp_6-31g(d).smash.inp (generated)

003975444.b3lyp_6-31g(d).nwchem.inp (generated) 003975444.b3lyp_6-31g(d).log.xz 003975444.td-b3lyp_6-31g+(d).inp 003975444.td-b3lyp_6-31g+(d).log.xz

003975444.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975444.td-b3lyp_6-31+g(d).gjf (generated)

003975444.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975444.mol 003975444.PUBCHEM 003975444.mol (via Jmol)
003975474.b3lyp_6-31g(d).inp

003975474.b3lyp_6-31g(d).qchem.inp (generated)

003975474.b3lyp_6-31g(d).gjf (generated)

003975474.b3lyp_6-31g(d).firefly.inp (generated)

003975474.b3lyp_6-31g(d).smash.inp (generated)

003975474.b3lyp_6-31g(d).nwchem.inp (generated) 003975474.b3lyp_6-31g(d).log.xz 003975474.td-b3lyp_6-31g+(d).inp 003975474.td-b3lyp_6-31g+(d).log.xz

003975474.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975474.td-b3lyp_6-31+g(d).gjf (generated)

003975474.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975474.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975474.mol 003975474.PUBCHEM 003975474.mol (via Jmol)
003975541.b3lyp_6-31g(d).inp

003975541.b3lyp_6-31g(d).qchem.inp (generated)

003975541.b3lyp_6-31g(d).gjf (generated)

003975541.b3lyp_6-31g(d).firefly.inp (generated)

003975541.b3lyp_6-31g(d).smash.inp (generated)

003975541.b3lyp_6-31g(d).nwchem.inp (generated) 003975541.b3lyp_6-31g(d).log.xz 003975541.td-b3lyp_6-31g+(d).inp 003975541.td-b3lyp_6-31g+(d).log.xz

003975541.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975541.td-b3lyp_6-31+g(d).gjf (generated)

003975541.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975541.mol 003975541.PUBCHEM 003975541.mol (via Jmol)
003975593.b3lyp_6-31g(d).inp

003975593.b3lyp_6-31g(d).qchem.inp (generated)

003975593.b3lyp_6-31g(d).gjf (generated)

003975593.b3lyp_6-31g(d).firefly.inp (generated)

003975593.b3lyp_6-31g(d).smash.inp (generated)

003975593.b3lyp_6-31g(d).nwchem.inp (generated) 003975593.b3lyp_6-31g(d).log.xz 003975593.td-b3lyp_6-31g+(d).inp 003975593.td-b3lyp_6-31g+(d).log.xz

003975593.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975593.td-b3lyp_6-31+g(d).gjf (generated)

003975593.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975593.mol 003975593.PUBCHEM 003975593.mol (via Jmol)
003975605.b3lyp_6-31g(d).inp

003975605.b3lyp_6-31g(d).qchem.inp (generated)

003975605.b3lyp_6-31g(d).gjf (generated)

003975605.b3lyp_6-31g(d).firefly.inp (generated)

003975605.b3lyp_6-31g(d).smash.inp (generated)

003975605.b3lyp_6-31g(d).nwchem.inp (generated) 003975605.b3lyp_6-31g(d).log.xz 003975605.td-b3lyp_6-31g+(d).inp 003975605.td-b3lyp_6-31g+(d).log.xz

003975605.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975605.td-b3lyp_6-31+g(d).gjf (generated)

003975605.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975605.mol 003975605.PUBCHEM 003975605.mol (via Jmol)
003975712.b3lyp_6-31g(d).inp

003975712.b3lyp_6-31g(d).qchem.inp (generated)

003975712.b3lyp_6-31g(d).gjf (generated)

003975712.b3lyp_6-31g(d).firefly.inp (generated)

003975712.b3lyp_6-31g(d).smash.inp (generated)

003975712.b3lyp_6-31g(d).nwchem.inp (generated) 003975712.b3lyp_6-31g(d).log.xz 003975712.td-b3lyp_6-31g+(d).inp 003975712.td-b3lyp_6-31g+(d).log.xz

003975712.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975712.td-b3lyp_6-31+g(d).gjf (generated)

003975712.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975712.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975712.mol 003975712.PUBCHEM 003975712.mol (via Jmol)
003975713.b3lyp_6-31g(d).inp

003975713.b3lyp_6-31g(d).qchem.inp (generated)

003975713.b3lyp_6-31g(d).gjf (generated)

003975713.b3lyp_6-31g(d).firefly.inp (generated)

003975713.b3lyp_6-31g(d).smash.inp (generated)

003975713.b3lyp_6-31g(d).nwchem.inp (generated) 003975713.b3lyp_6-31g(d).log.xz 003975713.mol 003975713.PUBCHEM 003975713.mol (via Jmol)
003975869.b3lyp_6-31g(d).inp

003975869.b3lyp_6-31g(d).qchem.inp (generated)

003975869.b3lyp_6-31g(d).gjf (generated)

003975869.b3lyp_6-31g(d).firefly.inp (generated)

003975869.b3lyp_6-31g(d).smash.inp (generated)

003975869.b3lyp_6-31g(d).nwchem.inp (generated) 003975869.b3lyp_6-31g(d).log.xz 003975869.td-b3lyp_6-31g+(d).inp 003975869.td-b3lyp_6-31g+(d).log.xz

003975869.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975869.td-b3lyp_6-31+g(d).gjf (generated)

003975869.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975869.mol 003975869.PUBCHEM 003975869.mol (via Jmol)
003975874.b3lyp_6-31g(d).inp

003975874.b3lyp_6-31g(d).qchem.inp (generated)

003975874.b3lyp_6-31g(d).gjf (generated)

003975874.b3lyp_6-31g(d).firefly.inp (generated)

003975874.b3lyp_6-31g(d).smash.inp (generated)

003975874.b3lyp_6-31g(d).nwchem.inp (generated) 003975874.b3lyp_6-31g(d).log.xz 003975874.mol 003975874.PUBCHEM 003975874.mol (via Jmol)
003975922.b3lyp_6-31g(d).inp

003975922.b3lyp_6-31g(d).qchem.inp (generated)

003975922.b3lyp_6-31g(d).gjf (generated)

003975922.b3lyp_6-31g(d).firefly.inp (generated)

003975922.b3lyp_6-31g(d).smash.inp (generated)

003975922.b3lyp_6-31g(d).nwchem.inp (generated) 003975922.b3lyp_6-31g(d).log.xz 003975922.td-b3lyp_6-31g+(d).inp 003975922.td-b3lyp_6-31g+(d).log.xz

003975922.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975922.td-b3lyp_6-31+g(d).gjf (generated)

003975922.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975922.mol 003975922.PUBCHEM 003975922.mol (via Jmol)
003975998.b3lyp_6-31g(d).inp

003975998.b3lyp_6-31g(d).qchem.inp (generated)

003975998.b3lyp_6-31g(d).gjf (generated)

003975998.b3lyp_6-31g(d).firefly.inp (generated)

003975998.b3lyp_6-31g(d).smash.inp (generated)

003975998.b3lyp_6-31g(d).nwchem.inp (generated) 003975998.b3lyp_6-31g(d).log.xz 003975998.td-b3lyp_6-31g+(d).inp 003975998.td-b3lyp_6-31g+(d).log.xz

003975998.td-b3lyp_6-31+g(d).qchem.inp (generated)

003975998.td-b3lyp_6-31+g(d).gjf (generated)

003975998.td-b3lyp_6-31+g(d).firefly.inp (generated)

003975998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003975998.mol 003975998.PUBCHEM 003975998.mol (via Jmol)
003976076.b3lyp_6-31g(d).inp

003976076.b3lyp_6-31g(d).qchem.inp (generated)

003976076.b3lyp_6-31g(d).gjf (generated)

003976076.b3lyp_6-31g(d).firefly.inp (generated)

003976076.b3lyp_6-31g(d).smash.inp (generated)

003976076.b3lyp_6-31g(d).nwchem.inp (generated) 003976076.b3lyp_6-31g(d).log.xz 003976076.td-b3lyp_6-31g+(d).inp 003976076.td-b3lyp_6-31g+(d).log.xz

003976076.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976076.td-b3lyp_6-31+g(d).gjf (generated)

003976076.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976076.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976076.mol 003976076.PUBCHEM 003976076.mol (via Jmol)
003976085.b3lyp_6-31g(d).inp

003976085.b3lyp_6-31g(d).qchem.inp (generated)

003976085.b3lyp_6-31g(d).gjf (generated)

003976085.b3lyp_6-31g(d).firefly.inp (generated)

003976085.b3lyp_6-31g(d).smash.inp (generated)

003976085.b3lyp_6-31g(d).nwchem.inp (generated) 003976085.b3lyp_6-31g(d).log.xz 003976085.td-b3lyp_6-31g+(d).inp 003976085.td-b3lyp_6-31g+(d).log.xz

003976085.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976085.td-b3lyp_6-31+g(d).gjf (generated)

003976085.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976085.mol 003976085.PUBCHEM 003976085.mol (via Jmol)
003976171.b3lyp_6-31g(d).inp

003976171.b3lyp_6-31g(d).qchem.inp (generated)

003976171.b3lyp_6-31g(d).gjf (generated)

003976171.b3lyp_6-31g(d).firefly.inp (generated)

003976171.b3lyp_6-31g(d).smash.inp (generated)

003976171.b3lyp_6-31g(d).nwchem.inp (generated) 003976171.b3lyp_6-31g(d).log.xz 003976171.td-b3lyp_6-31g+(d).inp 003976171.td-b3lyp_6-31g+(d).log.xz

003976171.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976171.td-b3lyp_6-31+g(d).gjf (generated)

003976171.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976171.mol 003976171.PUBCHEM 003976171.mol (via Jmol)
003976174.b3lyp_6-31g(d).inp

003976174.b3lyp_6-31g(d).qchem.inp (generated)

003976174.b3lyp_6-31g(d).gjf (generated)

003976174.b3lyp_6-31g(d).firefly.inp (generated)

003976174.b3lyp_6-31g(d).smash.inp (generated)

003976174.b3lyp_6-31g(d).nwchem.inp (generated) 003976174.b3lyp_6-31g(d).log.xz 003976174.td-b3lyp_6-31g+(d).inp 003976174.td-b3lyp_6-31g+(d).log.xz

003976174.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976174.td-b3lyp_6-31+g(d).gjf (generated)

003976174.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976174.mol 003976174.PUBCHEM 003976174.mol (via Jmol)
003976253.b3lyp_6-31g(d).inp

003976253.b3lyp_6-31g(d).qchem.inp (generated)

003976253.b3lyp_6-31g(d).gjf (generated)

003976253.b3lyp_6-31g(d).firefly.inp (generated)

003976253.b3lyp_6-31g(d).smash.inp (generated)

003976253.b3lyp_6-31g(d).nwchem.inp (generated) 003976253.b3lyp_6-31g(d).log.xz 003976253.td-b3lyp_6-31g+(d).inp 003976253.td-b3lyp_6-31g+(d).log.xz

003976253.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976253.td-b3lyp_6-31+g(d).gjf (generated)

003976253.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976253.mol 003976253.PUBCHEM 003976253.mol (via Jmol)
003976514.b3lyp_6-31g(d).inp

003976514.b3lyp_6-31g(d).qchem.inp (generated)

003976514.b3lyp_6-31g(d).gjf (generated)

003976514.b3lyp_6-31g(d).firefly.inp (generated)

003976514.b3lyp_6-31g(d).smash.inp (generated)

003976514.b3lyp_6-31g(d).nwchem.inp (generated) 003976514.b3lyp_6-31g(d).log.xz 003976514.mol 003976514.PUBCHEM 003976514.mol (via Jmol)
003976593.b3lyp_6-31g(d).inp

003976593.b3lyp_6-31g(d).qchem.inp (generated)

003976593.b3lyp_6-31g(d).gjf (generated)

003976593.b3lyp_6-31g(d).firefly.inp (generated)

003976593.b3lyp_6-31g(d).smash.inp (generated)

003976593.b3lyp_6-31g(d).nwchem.inp (generated) 003976593.b3lyp_6-31g(d).log.xz 003976593.td-b3lyp_6-31g+(d).inp 003976593.td-b3lyp_6-31g+(d).log.xz

003976593.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976593.td-b3lyp_6-31+g(d).gjf (generated)

003976593.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976593.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976593.mol 003976593.PUBCHEM 003976593.mol (via Jmol)
003976595.b3lyp_6-31g(d).inp

003976595.b3lyp_6-31g(d).qchem.inp (generated)

003976595.b3lyp_6-31g(d).gjf (generated)

003976595.b3lyp_6-31g(d).firefly.inp (generated)

003976595.b3lyp_6-31g(d).smash.inp (generated)

003976595.b3lyp_6-31g(d).nwchem.inp (generated) 003976595.b3lyp_6-31g(d).log.xz 003976595.td-b3lyp_6-31g+(d).inp 003976595.td-b3lyp_6-31g+(d).log.xz

003976595.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976595.td-b3lyp_6-31+g(d).gjf (generated)

003976595.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976595.mol 003976595.PUBCHEM 003976595.mol (via Jmol)
003976596.b3lyp_6-31g(d).inp

003976596.b3lyp_6-31g(d).qchem.inp (generated)

003976596.b3lyp_6-31g(d).gjf (generated)

003976596.b3lyp_6-31g(d).firefly.inp (generated)

003976596.b3lyp_6-31g(d).smash.inp (generated)

003976596.b3lyp_6-31g(d).nwchem.inp (generated) 003976596.b3lyp_6-31g(d).log.xz 003976596.td-b3lyp_6-31g+(d).inp 003976596.td-b3lyp_6-31g+(d).log.xz

003976596.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976596.td-b3lyp_6-31+g(d).gjf (generated)

003976596.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976596.mol 003976596.PUBCHEM 003976596.mol (via Jmol)
003976608.b3lyp_6-31g(d).inp

003976608.b3lyp_6-31g(d).qchem.inp (generated)

003976608.b3lyp_6-31g(d).gjf (generated)

003976608.b3lyp_6-31g(d).firefly.inp (generated)

003976608.b3lyp_6-31g(d).smash.inp (generated)

003976608.b3lyp_6-31g(d).nwchem.inp (generated) 003976608.b3lyp_6-31g(d).log.xz 003976608.mol 003976608.PUBCHEM 003976608.mol (via Jmol)
003976613.b3lyp_6-31g(d).inp

003976613.b3lyp_6-31g(d).qchem.inp (generated)

003976613.b3lyp_6-31g(d).gjf (generated)

003976613.b3lyp_6-31g(d).firefly.inp (generated)

003976613.b3lyp_6-31g(d).smash.inp (generated)

003976613.b3lyp_6-31g(d).nwchem.inp (generated) 003976613.b3lyp_6-31g(d).log.xz 003976613.td-b3lyp_6-31g+(d).inp 003976613.td-b3lyp_6-31g+(d).log.xz

003976613.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976613.td-b3lyp_6-31+g(d).gjf (generated)

003976613.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976613.mol 003976613.PUBCHEM 003976613.mol (via Jmol)
003976656.b3lyp_6-31g(d).inp

003976656.b3lyp_6-31g(d).qchem.inp (generated)

003976656.b3lyp_6-31g(d).gjf (generated)

003976656.b3lyp_6-31g(d).firefly.inp (generated)

003976656.b3lyp_6-31g(d).smash.inp (generated)

003976656.b3lyp_6-31g(d).nwchem.inp (generated) 003976656.b3lyp_6-31g(d).log.xz 003976656.td-b3lyp_6-31g+(d).inp 003976656.td-b3lyp_6-31g+(d).log.xz

003976656.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976656.td-b3lyp_6-31+g(d).gjf (generated)

003976656.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976656.mol 003976656.PUBCHEM 003976656.mol (via Jmol)
003976808.b3lyp_6-31g(d).inp

003976808.b3lyp_6-31g(d).qchem.inp (generated)

003976808.b3lyp_6-31g(d).gjf (generated)

003976808.b3lyp_6-31g(d).firefly.inp (generated)

003976808.b3lyp_6-31g(d).smash.inp (generated)

003976808.b3lyp_6-31g(d).nwchem.inp (generated) 003976808.b3lyp_6-31g(d).log.xz 003976808.td-b3lyp_6-31g+(d).inp 003976808.td-b3lyp_6-31g+(d).log.xz

003976808.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976808.td-b3lyp_6-31+g(d).gjf (generated)

003976808.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976808.mol 003976808.PUBCHEM 003976808.mol (via Jmol)
003976810.b3lyp_6-31g(d).inp

003976810.b3lyp_6-31g(d).qchem.inp (generated)

003976810.b3lyp_6-31g(d).gjf (generated)

003976810.b3lyp_6-31g(d).firefly.inp (generated)

003976810.b3lyp_6-31g(d).smash.inp (generated)

003976810.b3lyp_6-31g(d).nwchem.inp (generated) 003976810.b3lyp_6-31g(d).log.xz 003976810.mol 003976810.PUBCHEM 003976810.mol (via Jmol)
003976897.b3lyp_6-31g(d).inp

003976897.b3lyp_6-31g(d).qchem.inp (generated)

003976897.b3lyp_6-31g(d).gjf (generated)

003976897.b3lyp_6-31g(d).firefly.inp (generated)

003976897.b3lyp_6-31g(d).smash.inp (generated)

003976897.b3lyp_6-31g(d).nwchem.inp (generated) 003976897.b3lyp_6-31g(d).log.xz 003976897.td-b3lyp_6-31g+(d).inp 003976897.td-b3lyp_6-31g+(d).log.xz

003976897.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976897.td-b3lyp_6-31+g(d).gjf (generated)

003976897.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976897.mol 003976897.PUBCHEM 003976897.mol (via Jmol)
003976899.b3lyp_6-31g(d).inp

003976899.b3lyp_6-31g(d).qchem.inp (generated)

003976899.b3lyp_6-31g(d).gjf (generated)

003976899.b3lyp_6-31g(d).firefly.inp (generated)

003976899.b3lyp_6-31g(d).smash.inp (generated)

003976899.b3lyp_6-31g(d).nwchem.inp (generated) 003976899.b3lyp_6-31g(d).log.xz 003976899.td-b3lyp_6-31g+(d).inp 003976899.td-b3lyp_6-31g+(d).log.xz

003976899.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976899.td-b3lyp_6-31+g(d).gjf (generated)

003976899.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976899.mol 003976899.PUBCHEM 003976899.mol (via Jmol)
003976906.b3lyp_6-31g(d).inp

003976906.b3lyp_6-31g(d).qchem.inp (generated)

003976906.b3lyp_6-31g(d).gjf (generated)

003976906.b3lyp_6-31g(d).firefly.inp (generated)

003976906.b3lyp_6-31g(d).smash.inp (generated)

003976906.b3lyp_6-31g(d).nwchem.inp (generated) 003976906.b3lyp_6-31g(d).log.xz 003976906.td-b3lyp_6-31g+(d).inp 003976906.td-b3lyp_6-31g+(d).log.xz

003976906.td-b3lyp_6-31+g(d).qchem.inp (generated)

003976906.td-b3lyp_6-31+g(d).gjf (generated)

003976906.td-b3lyp_6-31+g(d).firefly.inp (generated)

003976906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003976906.mol 003976906.PUBCHEM 003976906.mol (via Jmol)
003977101.b3lyp_6-31g(d).inp

003977101.b3lyp_6-31g(d).qchem.inp (generated)

003977101.b3lyp_6-31g(d).gjf (generated)

003977101.b3lyp_6-31g(d).firefly.inp (generated)

003977101.b3lyp_6-31g(d).smash.inp (generated)

003977101.b3lyp_6-31g(d).nwchem.inp (generated) 003977101.b3lyp_6-31g(d).log.xz 003977101.td-b3lyp_6-31g+(d).inp 003977101.td-b3lyp_6-31g+(d).log.xz

003977101.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977101.td-b3lyp_6-31+g(d).gjf (generated)

003977101.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977101.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977101.mol 003977101.PUBCHEM 003977101.mol (via Jmol)
003977142.b3lyp_6-31g(d).inp

003977142.b3lyp_6-31g(d).qchem.inp (generated)

003977142.b3lyp_6-31g(d).gjf (generated)

003977142.b3lyp_6-31g(d).firefly.inp (generated)

003977142.b3lyp_6-31g(d).smash.inp (generated)

003977142.b3lyp_6-31g(d).nwchem.inp (generated) 003977142.b3lyp_6-31g(d).log.xz 003977142.td-b3lyp_6-31g+(d).inp 003977142.td-b3lyp_6-31g+(d).log.xz

003977142.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977142.td-b3lyp_6-31+g(d).gjf (generated)

003977142.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977142.mol 003977142.PUBCHEM 003977142.mol (via Jmol)
003977238.b3lyp_6-31g(d).inp

003977238.b3lyp_6-31g(d).qchem.inp (generated)

003977238.b3lyp_6-31g(d).gjf (generated)

003977238.b3lyp_6-31g(d).firefly.inp (generated)

003977238.b3lyp_6-31g(d).smash.inp (generated)

003977238.b3lyp_6-31g(d).nwchem.inp (generated) 003977238.b3lyp_6-31g(d).log.xz 003977238.td-b3lyp_6-31g+(d).inp 003977238.td-b3lyp_6-31g+(d).log.xz

003977238.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977238.td-b3lyp_6-31+g(d).gjf (generated)

003977238.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977238.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977238.mol 003977238.PUBCHEM 003977238.mol (via Jmol)
003977287.b3lyp_6-31g(d).inp

003977287.b3lyp_6-31g(d).qchem.inp (generated)

003977287.b3lyp_6-31g(d).gjf (generated)

003977287.b3lyp_6-31g(d).firefly.inp (generated)

003977287.b3lyp_6-31g(d).smash.inp (generated)

003977287.b3lyp_6-31g(d).nwchem.inp (generated) 003977287.b3lyp_6-31g(d).log.xz 003977287.td-b3lyp_6-31g+(d).inp 003977287.td-b3lyp_6-31g+(d).log.xz

003977287.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977287.td-b3lyp_6-31+g(d).gjf (generated)

003977287.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977287.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977287.mol 003977287.PUBCHEM 003977287.mol (via Jmol)
003977346.b3lyp_6-31g(d).inp

003977346.b3lyp_6-31g(d).qchem.inp (generated)

003977346.b3lyp_6-31g(d).gjf (generated)

003977346.b3lyp_6-31g(d).firefly.inp (generated)

003977346.b3lyp_6-31g(d).smash.inp (generated)

003977346.b3lyp_6-31g(d).nwchem.inp (generated) 003977346.b3lyp_6-31g(d).log.xz 003977346.td-b3lyp_6-31g+(d).inp 003977346.td-b3lyp_6-31g+(d).log.xz

003977346.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977346.td-b3lyp_6-31+g(d).gjf (generated)

003977346.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977346.mol 003977346.PUBCHEM 003977346.mol (via Jmol)
003977533.b3lyp_6-31g(d).inp

003977533.b3lyp_6-31g(d).qchem.inp (generated)

003977533.b3lyp_6-31g(d).gjf (generated)

003977533.b3lyp_6-31g(d).firefly.inp (generated)

003977533.b3lyp_6-31g(d).smash.inp (generated)

003977533.b3lyp_6-31g(d).nwchem.inp (generated) 003977533.b3lyp_6-31g(d).log.xz 003977533.td-b3lyp_6-31g+(d).inp 003977533.td-b3lyp_6-31g+(d).log.xz

003977533.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977533.td-b3lyp_6-31+g(d).gjf (generated)

003977533.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977533.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977533.mol 003977533.PUBCHEM 003977533.mol (via Jmol)
003977547.b3lyp_6-31g(d).inp

003977547.b3lyp_6-31g(d).qchem.inp (generated)

003977547.b3lyp_6-31g(d).gjf (generated)

003977547.b3lyp_6-31g(d).firefly.inp (generated)

003977547.b3lyp_6-31g(d).smash.inp (generated)

003977547.b3lyp_6-31g(d).nwchem.inp (generated) 003977547.b3lyp_6-31g(d).log.xz 003977547.td-b3lyp_6-31g+(d).inp 003977547.td-b3lyp_6-31g+(d).log.xz

003977547.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977547.td-b3lyp_6-31+g(d).gjf (generated)

003977547.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977547.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977547.mol 003977547.PUBCHEM 003977547.mol (via Jmol)
003977557.b3lyp_6-31g(d).inp

003977557.b3lyp_6-31g(d).qchem.inp (generated)

003977557.b3lyp_6-31g(d).gjf (generated)

003977557.b3lyp_6-31g(d).firefly.inp (generated)

003977557.b3lyp_6-31g(d).smash.inp (generated)

003977557.b3lyp_6-31g(d).nwchem.inp (generated) 003977557.b3lyp_6-31g(d).log.xz 003977557.td-b3lyp_6-31g+(d).inp 003977557.td-b3lyp_6-31g+(d).log.xz

003977557.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977557.td-b3lyp_6-31+g(d).gjf (generated)

003977557.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977557.mol 003977557.PUBCHEM 003977557.mol (via Jmol)
003977558.b3lyp_6-31g(d).inp

003977558.b3lyp_6-31g(d).qchem.inp (generated)

003977558.b3lyp_6-31g(d).gjf (generated)

003977558.b3lyp_6-31g(d).firefly.inp (generated)

003977558.b3lyp_6-31g(d).smash.inp (generated)

003977558.b3lyp_6-31g(d).nwchem.inp (generated) 003977558.b3lyp_6-31g(d).log.xz 003977558.td-b3lyp_6-31g+(d).inp 003977558.td-b3lyp_6-31g+(d).log.xz

003977558.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977558.td-b3lyp_6-31+g(d).gjf (generated)

003977558.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977558.mol 003977558.PUBCHEM 003977558.mol (via Jmol)
003977625.b3lyp_6-31g(d).inp

003977625.b3lyp_6-31g(d).qchem.inp (generated)

003977625.b3lyp_6-31g(d).gjf (generated)

003977625.b3lyp_6-31g(d).firefly.inp (generated)

003977625.b3lyp_6-31g(d).smash.inp (generated)

003977625.b3lyp_6-31g(d).nwchem.inp (generated) 003977625.b3lyp_6-31g(d).log.xz 003977625.mol 003977625.PUBCHEM 003977625.mol (via Jmol)
003977659.b3lyp_6-31g(d).inp

003977659.b3lyp_6-31g(d).qchem.inp (generated)

003977659.b3lyp_6-31g(d).gjf (generated)

003977659.b3lyp_6-31g(d).firefly.inp (generated)

003977659.b3lyp_6-31g(d).smash.inp (generated)

003977659.b3lyp_6-31g(d).nwchem.inp (generated) 003977659.b3lyp_6-31g(d).log.xz 003977659.mol 003977659.PUBCHEM 003977659.mol (via Jmol)
003977732.b3lyp_6-31g(d).inp

003977732.b3lyp_6-31g(d).qchem.inp (generated)

003977732.b3lyp_6-31g(d).gjf (generated)

003977732.b3lyp_6-31g(d).firefly.inp (generated)

003977732.b3lyp_6-31g(d).smash.inp (generated)

003977732.b3lyp_6-31g(d).nwchem.inp (generated) 003977732.b3lyp_6-31g(d).log.xz 003977732.td-b3lyp_6-31g+(d).inp 003977732.td-b3lyp_6-31g+(d).log.xz

003977732.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977732.td-b3lyp_6-31+g(d).gjf (generated)

003977732.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977732.mol 003977732.PUBCHEM 003977732.mol (via Jmol)
003977738.b3lyp_6-31g(d).inp

003977738.b3lyp_6-31g(d).qchem.inp (generated)

003977738.b3lyp_6-31g(d).gjf (generated)

003977738.b3lyp_6-31g(d).firefly.inp (generated)

003977738.b3lyp_6-31g(d).smash.inp (generated)

003977738.b3lyp_6-31g(d).nwchem.inp (generated) 003977738.b3lyp_6-31g(d).log.xz 003977738.td-b3lyp_6-31g+(d).inp 003977738.td-b3lyp_6-31g+(d).log.xz

003977738.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977738.td-b3lyp_6-31+g(d).gjf (generated)

003977738.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977738.mol 003977738.PUBCHEM 003977738.mol (via Jmol)
003977752.b3lyp_6-31g(d).inp

003977752.b3lyp_6-31g(d).qchem.inp (generated)

003977752.b3lyp_6-31g(d).gjf (generated)

003977752.b3lyp_6-31g(d).firefly.inp (generated)

003977752.b3lyp_6-31g(d).smash.inp (generated)

003977752.b3lyp_6-31g(d).nwchem.inp (generated) 003977752.b3lyp_6-31g(d).log.xz 003977752.td-b3lyp_6-31g+(d).inp 003977752.td-b3lyp_6-31g+(d).log.xz

003977752.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977752.td-b3lyp_6-31+g(d).gjf (generated)

003977752.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977752.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977752.mol 003977752.PUBCHEM 003977752.mol (via Jmol)
003977757.b3lyp_6-31g(d).inp

003977757.b3lyp_6-31g(d).qchem.inp (generated)

003977757.b3lyp_6-31g(d).gjf (generated)

003977757.b3lyp_6-31g(d).firefly.inp (generated)

003977757.b3lyp_6-31g(d).smash.inp (generated)

003977757.b3lyp_6-31g(d).nwchem.inp (generated) 003977757.b3lyp_6-31g(d).log.xz 003977757.td-b3lyp_6-31g+(d).inp 003977757.td-b3lyp_6-31g+(d).log.xz

003977757.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977757.td-b3lyp_6-31+g(d).gjf (generated)

003977757.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977757.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977757.mol 003977757.PUBCHEM 003977757.mol (via Jmol)
003977789.b3lyp_6-31g(d).inp

003977789.b3lyp_6-31g(d).qchem.inp (generated)

003977789.b3lyp_6-31g(d).gjf (generated)

003977789.b3lyp_6-31g(d).firefly.inp (generated)

003977789.b3lyp_6-31g(d).smash.inp (generated)

003977789.b3lyp_6-31g(d).nwchem.inp (generated) 003977789.b3lyp_6-31g(d).log.xz 003977789.td-b3lyp_6-31g+(d).inp 003977789.td-b3lyp_6-31g+(d).log.xz

003977789.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977789.td-b3lyp_6-31+g(d).gjf (generated)

003977789.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977789.mol 003977789.PUBCHEM 003977789.mol (via Jmol)
003977972.b3lyp_6-31g(d).inp

003977972.b3lyp_6-31g(d).qchem.inp (generated)

003977972.b3lyp_6-31g(d).gjf (generated)

003977972.b3lyp_6-31g(d).firefly.inp (generated)

003977972.b3lyp_6-31g(d).smash.inp (generated)

003977972.b3lyp_6-31g(d).nwchem.inp (generated) 003977972.b3lyp_6-31g(d).log.xz 003977972.td-b3lyp_6-31g+(d).inp 003977972.td-b3lyp_6-31g+(d).log.xz

003977972.td-b3lyp_6-31+g(d).qchem.inp (generated)

003977972.td-b3lyp_6-31+g(d).gjf (generated)

003977972.td-b3lyp_6-31+g(d).firefly.inp (generated)

003977972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003977972.mol 003977972.PUBCHEM 003977972.mol (via Jmol)
003978000.b3lyp_6-31g(d).inp

003978000.b3lyp_6-31g(d).qchem.inp (generated)

003978000.b3lyp_6-31g(d).gjf (generated)

003978000.b3lyp_6-31g(d).firefly.inp (generated)

003978000.b3lyp_6-31g(d).smash.inp (generated)

003978000.b3lyp_6-31g(d).nwchem.inp (generated) 003978000.b3lyp_6-31g(d).log.xz 003978000.td-b3lyp_6-31g+(d).inp 003978000.td-b3lyp_6-31g+(d).log.xz

003978000.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978000.td-b3lyp_6-31+g(d).gjf (generated)

003978000.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978000.mol 003978000.PUBCHEM 003978000.mol (via Jmol)
003978029.b3lyp_6-31g(d).inp

003978029.b3lyp_6-31g(d).qchem.inp (generated)

003978029.b3lyp_6-31g(d).gjf (generated)

003978029.b3lyp_6-31g(d).firefly.inp (generated)

003978029.b3lyp_6-31g(d).smash.inp (generated)

003978029.b3lyp_6-31g(d).nwchem.inp (generated) 003978029.b3lyp_6-31g(d).log.xz 003978029.td-b3lyp_6-31g+(d).inp 003978029.td-b3lyp_6-31g+(d).log.xz

003978029.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978029.td-b3lyp_6-31+g(d).gjf (generated)

003978029.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978029.mol 003978029.PUBCHEM 003978029.mol (via Jmol)
003978062.b3lyp_6-31g(d).inp

003978062.b3lyp_6-31g(d).qchem.inp (generated)

003978062.b3lyp_6-31g(d).gjf (generated)

003978062.b3lyp_6-31g(d).firefly.inp (generated)

003978062.b3lyp_6-31g(d).smash.inp (generated)

003978062.b3lyp_6-31g(d).nwchem.inp (generated) 003978062.b3lyp_6-31g(d).log.xz 003978062.td-b3lyp_6-31g+(d).inp 003978062.td-b3lyp_6-31g+(d).log.xz

003978062.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978062.td-b3lyp_6-31+g(d).gjf (generated)

003978062.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978062.mol 003978062.PUBCHEM 003978062.mol (via Jmol)
003978233.b3lyp_6-31g(d).inp

003978233.b3lyp_6-31g(d).qchem.inp (generated)

003978233.b3lyp_6-31g(d).gjf (generated)

003978233.b3lyp_6-31g(d).firefly.inp (generated)

003978233.b3lyp_6-31g(d).smash.inp (generated)

003978233.b3lyp_6-31g(d).nwchem.inp (generated) 003978233.b3lyp_6-31g(d).log.xz 003978233.td-b3lyp_6-31g+(d).inp 003978233.td-b3lyp_6-31g+(d).log.xz

003978233.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978233.td-b3lyp_6-31+g(d).gjf (generated)

003978233.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978233.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978233.mol 003978233.PUBCHEM 003978233.mol (via Jmol)
003978305.b3lyp_6-31g(d).inp

003978305.b3lyp_6-31g(d).qchem.inp (generated)

003978305.b3lyp_6-31g(d).gjf (generated)

003978305.b3lyp_6-31g(d).firefly.inp (generated)

003978305.b3lyp_6-31g(d).smash.inp (generated)

003978305.b3lyp_6-31g(d).nwchem.inp (generated) 003978305.b3lyp_6-31g(d).log.xz 003978305.mol 003978305.PUBCHEM 003978305.mol (via Jmol)
003978594.b3lyp_6-31g(d).inp

003978594.b3lyp_6-31g(d).qchem.inp (generated)

003978594.b3lyp_6-31g(d).gjf (generated)

003978594.b3lyp_6-31g(d).firefly.inp (generated)

003978594.b3lyp_6-31g(d).smash.inp (generated)

003978594.b3lyp_6-31g(d).nwchem.inp (generated) 003978594.b3lyp_6-31g(d).log.xz 003978594.td-b3lyp_6-31g+(d).inp 003978594.td-b3lyp_6-31g+(d).log.xz

003978594.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978594.td-b3lyp_6-31+g(d).gjf (generated)

003978594.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978594.mol 003978594.PUBCHEM 003978594.mol (via Jmol)
003978624.b3lyp_6-31g(d).inp

003978624.b3lyp_6-31g(d).qchem.inp (generated)

003978624.b3lyp_6-31g(d).gjf (generated)

003978624.b3lyp_6-31g(d).firefly.inp (generated)

003978624.b3lyp_6-31g(d).smash.inp (generated)

003978624.b3lyp_6-31g(d).nwchem.inp (generated) 003978624.b3lyp_6-31g(d).log.xz 003978624.td-b3lyp_6-31g+(d).inp 003978624.td-b3lyp_6-31g+(d).log.xz

003978624.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978624.td-b3lyp_6-31+g(d).gjf (generated)

003978624.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978624.mol 003978624.PUBCHEM 003978624.mol (via Jmol)
003978731.b3lyp_6-31g(d).inp

003978731.b3lyp_6-31g(d).qchem.inp (generated)

003978731.b3lyp_6-31g(d).gjf (generated)

003978731.b3lyp_6-31g(d).firefly.inp (generated)

003978731.b3lyp_6-31g(d).smash.inp (generated)

003978731.b3lyp_6-31g(d).nwchem.inp (generated) 003978731.b3lyp_6-31g(d).log.xz 003978731.td-b3lyp_6-31g+(d).inp 003978731.td-b3lyp_6-31g+(d).log.xz

003978731.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978731.td-b3lyp_6-31+g(d).gjf (generated)

003978731.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978731.mol 003978731.PUBCHEM 003978731.mol (via Jmol)
003978732.b3lyp_6-31g(d).inp

003978732.b3lyp_6-31g(d).qchem.inp (generated)

003978732.b3lyp_6-31g(d).gjf (generated)

003978732.b3lyp_6-31g(d).firefly.inp (generated)

003978732.b3lyp_6-31g(d).smash.inp (generated)

003978732.b3lyp_6-31g(d).nwchem.inp (generated) 003978732.b3lyp_6-31g(d).log.xz 003978732.td-b3lyp_6-31g+(d).inp 003978732.td-b3lyp_6-31g+(d).log.xz

003978732.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978732.td-b3lyp_6-31+g(d).gjf (generated)

003978732.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978732.mol 003978732.PUBCHEM 003978732.mol (via Jmol)
003978733.b3lyp_6-31g(d).inp

003978733.b3lyp_6-31g(d).qchem.inp (generated)

003978733.b3lyp_6-31g(d).gjf (generated)

003978733.b3lyp_6-31g(d).firefly.inp (generated)

003978733.b3lyp_6-31g(d).smash.inp (generated)

003978733.b3lyp_6-31g(d).nwchem.inp (generated) 003978733.b3lyp_6-31g(d).log.xz 003978733.td-b3lyp_6-31g+(d).inp 003978733.td-b3lyp_6-31g+(d).log.xz

003978733.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978733.td-b3lyp_6-31+g(d).gjf (generated)

003978733.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978733.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978733.mol 003978733.PUBCHEM 003978733.mol (via Jmol)
003978818.b3lyp_6-31g(d).inp

003978818.b3lyp_6-31g(d).qchem.inp (generated)

003978818.b3lyp_6-31g(d).gjf (generated)

003978818.b3lyp_6-31g(d).firefly.inp (generated)

003978818.b3lyp_6-31g(d).smash.inp (generated)

003978818.b3lyp_6-31g(d).nwchem.inp (generated) 003978818.b3lyp_6-31g(d).log.xz 003978818.td-b3lyp_6-31g+(d).inp 003978818.td-b3lyp_6-31g+(d).log.xz

003978818.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978818.td-b3lyp_6-31+g(d).gjf (generated)

003978818.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978818.mol 003978818.PUBCHEM 003978818.mol (via Jmol)
003978876.b3lyp_6-31g(d).inp

003978876.b3lyp_6-31g(d).qchem.inp (generated)

003978876.b3lyp_6-31g(d).gjf (generated)

003978876.b3lyp_6-31g(d).firefly.inp (generated)

003978876.b3lyp_6-31g(d).smash.inp (generated)

003978876.b3lyp_6-31g(d).nwchem.inp (generated) 003978876.b3lyp_6-31g(d).log.xz 003978876.td-b3lyp_6-31g+(d).inp 003978876.td-b3lyp_6-31g+(d).log.xz

003978876.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978876.td-b3lyp_6-31+g(d).gjf (generated)

003978876.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978876.mol 003978876.PUBCHEM 003978876.mol (via Jmol)
003978882.b3lyp_6-31g(d).inp

003978882.b3lyp_6-31g(d).qchem.inp (generated)

003978882.b3lyp_6-31g(d).gjf (generated)

003978882.b3lyp_6-31g(d).firefly.inp (generated)

003978882.b3lyp_6-31g(d).smash.inp (generated)

003978882.b3lyp_6-31g(d).nwchem.inp (generated) 003978882.b3lyp_6-31g(d).log.xz 003978882.td-b3lyp_6-31g+(d).inp 003978882.td-b3lyp_6-31g+(d).log.xz

003978882.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978882.td-b3lyp_6-31+g(d).gjf (generated)

003978882.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978882.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978882.mol 003978882.PUBCHEM 003978882.mol (via Jmol)
003978961.b3lyp_6-31g(d).inp

003978961.b3lyp_6-31g(d).qchem.inp (generated)

003978961.b3lyp_6-31g(d).gjf (generated)

003978961.b3lyp_6-31g(d).firefly.inp (generated)

003978961.b3lyp_6-31g(d).smash.inp (generated)

003978961.b3lyp_6-31g(d).nwchem.inp (generated) 003978961.b3lyp_6-31g(d).log.xz 003978961.td-b3lyp_6-31g+(d).inp 003978961.td-b3lyp_6-31g+(d).log.xz

003978961.td-b3lyp_6-31+g(d).qchem.inp (generated)

003978961.td-b3lyp_6-31+g(d).gjf (generated)

003978961.td-b3lyp_6-31+g(d).firefly.inp (generated)

003978961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003978961.mol 003978961.PUBCHEM 003978961.mol (via Jmol)
003979006.b3lyp_6-31g(d).inp

003979006.b3lyp_6-31g(d).qchem.inp (generated)

003979006.b3lyp_6-31g(d).gjf (generated)

003979006.b3lyp_6-31g(d).firefly.inp (generated)

003979006.b3lyp_6-31g(d).smash.inp (generated)

003979006.b3lyp_6-31g(d).nwchem.inp (generated) 003979006.b3lyp_6-31g(d).log.xz 003979006.td-b3lyp_6-31g+(d).inp 003979006.td-b3lyp_6-31g+(d).log.xz

003979006.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979006.td-b3lyp_6-31+g(d).gjf (generated)

003979006.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979006.mol 003979006.PUBCHEM 003979006.mol (via Jmol)
003979021.b3lyp_6-31g(d).inp

003979021.b3lyp_6-31g(d).qchem.inp (generated)

003979021.b3lyp_6-31g(d).gjf (generated)

003979021.b3lyp_6-31g(d).firefly.inp (generated)

003979021.b3lyp_6-31g(d).smash.inp (generated)

003979021.b3lyp_6-31g(d).nwchem.inp (generated) 003979021.b3lyp_6-31g(d).log.xz 003979021.td-b3lyp_6-31g+(d).inp 003979021.td-b3lyp_6-31g+(d).log.xz

003979021.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979021.td-b3lyp_6-31+g(d).gjf (generated)

003979021.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979021.mol 003979021.PUBCHEM 003979021.mol (via Jmol)
003979034.b3lyp_6-31g(d).inp

003979034.b3lyp_6-31g(d).qchem.inp (generated)

003979034.b3lyp_6-31g(d).gjf (generated)

003979034.b3lyp_6-31g(d).firefly.inp (generated)

003979034.b3lyp_6-31g(d).smash.inp (generated)

003979034.b3lyp_6-31g(d).nwchem.inp (generated) 003979034.b3lyp_6-31g(d).log.xz 003979034.td-b3lyp_6-31g+(d).inp 003979034.td-b3lyp_6-31g+(d).log.xz

003979034.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979034.td-b3lyp_6-31+g(d).gjf (generated)

003979034.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979034.mol 003979034.PUBCHEM 003979034.mol (via Jmol)
003979129.b3lyp_6-31g(d).inp

003979129.b3lyp_6-31g(d).qchem.inp (generated)

003979129.b3lyp_6-31g(d).gjf (generated)

003979129.b3lyp_6-31g(d).firefly.inp (generated)

003979129.b3lyp_6-31g(d).smash.inp (generated)

003979129.b3lyp_6-31g(d).nwchem.inp (generated) 003979129.b3lyp_6-31g(d).log.xz 003979129.mol 003979129.PUBCHEM 003979129.mol (via Jmol)
003979242.b3lyp_6-31g(d).inp

003979242.b3lyp_6-31g(d).qchem.inp (generated)

003979242.b3lyp_6-31g(d).gjf (generated)

003979242.b3lyp_6-31g(d).firefly.inp (generated)

003979242.b3lyp_6-31g(d).smash.inp (generated)

003979242.b3lyp_6-31g(d).nwchem.inp (generated) 003979242.b3lyp_6-31g(d).log.xz 003979242.td-b3lyp_6-31g+(d).inp 003979242.td-b3lyp_6-31g+(d).log.xz

003979242.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979242.td-b3lyp_6-31+g(d).gjf (generated)

003979242.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979242.mol 003979242.PUBCHEM 003979242.mol (via Jmol)
003979253.b3lyp_6-31g(d).inp

003979253.b3lyp_6-31g(d).qchem.inp (generated)

003979253.b3lyp_6-31g(d).gjf (generated)

003979253.b3lyp_6-31g(d).firefly.inp (generated)

003979253.b3lyp_6-31g(d).smash.inp (generated)

003979253.b3lyp_6-31g(d).nwchem.inp (generated) 003979253.b3lyp_6-31g(d).log.xz 003979253.td-b3lyp_6-31g+(d).inp 003979253.td-b3lyp_6-31g+(d).log.xz

003979253.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979253.td-b3lyp_6-31+g(d).gjf (generated)

003979253.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979253.mol 003979253.PUBCHEM 003979253.mol (via Jmol)
003979263.b3lyp_6-31g(d).inp

003979263.b3lyp_6-31g(d).qchem.inp (generated)

003979263.b3lyp_6-31g(d).gjf (generated)

003979263.b3lyp_6-31g(d).firefly.inp (generated)

003979263.b3lyp_6-31g(d).smash.inp (generated)

003979263.b3lyp_6-31g(d).nwchem.inp (generated) 003979263.b3lyp_6-31g(d).log.xz 003979263.td-b3lyp_6-31g+(d).inp 003979263.td-b3lyp_6-31g+(d).log.xz

003979263.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979263.td-b3lyp_6-31+g(d).gjf (generated)

003979263.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979263.mol 003979263.PUBCHEM 003979263.mol (via Jmol)
003979264.b3lyp_6-31g(d).inp

003979264.b3lyp_6-31g(d).qchem.inp (generated)

003979264.b3lyp_6-31g(d).gjf (generated)

003979264.b3lyp_6-31g(d).firefly.inp (generated)

003979264.b3lyp_6-31g(d).smash.inp (generated)

003979264.b3lyp_6-31g(d).nwchem.inp (generated) 003979264.b3lyp_6-31g(d).log.xz 003979264.td-b3lyp_6-31g+(d).inp 003979264.td-b3lyp_6-31g+(d).log.xz

003979264.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979264.td-b3lyp_6-31+g(d).gjf (generated)

003979264.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979264.mol 003979264.PUBCHEM 003979264.mol (via Jmol)
003979276.b3lyp_6-31g(d).inp

003979276.b3lyp_6-31g(d).qchem.inp (generated)

003979276.b3lyp_6-31g(d).gjf (generated)

003979276.b3lyp_6-31g(d).firefly.inp (generated)

003979276.b3lyp_6-31g(d).smash.inp (generated)

003979276.b3lyp_6-31g(d).nwchem.inp (generated) 003979276.b3lyp_6-31g(d).log.xz 003979276.mol 003979276.PUBCHEM 003979276.mol (via Jmol)
003979402.b3lyp_6-31g(d).inp

003979402.b3lyp_6-31g(d).qchem.inp (generated)

003979402.b3lyp_6-31g(d).gjf (generated)

003979402.b3lyp_6-31g(d).firefly.inp (generated)

003979402.b3lyp_6-31g(d).smash.inp (generated)

003979402.b3lyp_6-31g(d).nwchem.inp (generated) 003979402.b3lyp_6-31g(d).log.xz 003979402.td-b3lyp_6-31g+(d).inp 003979402.td-b3lyp_6-31g+(d).log.xz

003979402.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979402.td-b3lyp_6-31+g(d).gjf (generated)

003979402.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979402.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979402.mol 003979402.PUBCHEM 003979402.mol (via Jmol)
003979419.b3lyp_6-31g(d).inp

003979419.b3lyp_6-31g(d).qchem.inp (generated)

003979419.b3lyp_6-31g(d).gjf (generated)

003979419.b3lyp_6-31g(d).firefly.inp (generated)

003979419.b3lyp_6-31g(d).smash.inp (generated)

003979419.b3lyp_6-31g(d).nwchem.inp (generated) 003979419.b3lyp_6-31g(d).log.xz 003979419.mol 003979419.PUBCHEM 003979419.mol (via Jmol)
003979453.b3lyp_6-31g(d).inp

003979453.b3lyp_6-31g(d).qchem.inp (generated)

003979453.b3lyp_6-31g(d).gjf (generated)

003979453.b3lyp_6-31g(d).firefly.inp (generated)

003979453.b3lyp_6-31g(d).smash.inp (generated)

003979453.b3lyp_6-31g(d).nwchem.inp (generated) 003979453.b3lyp_6-31g(d).log.xz 003979453.td-b3lyp_6-31g+(d).inp 003979453.td-b3lyp_6-31g+(d).log.xz

003979453.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979453.td-b3lyp_6-31+g(d).gjf (generated)

003979453.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979453.mol 003979453.PUBCHEM 003979453.mol (via Jmol)
003979552.b3lyp_6-31g(d).inp

003979552.b3lyp_6-31g(d).qchem.inp (generated)

003979552.b3lyp_6-31g(d).gjf (generated)

003979552.b3lyp_6-31g(d).firefly.inp (generated)

003979552.b3lyp_6-31g(d).smash.inp (generated)

003979552.b3lyp_6-31g(d).nwchem.inp (generated) 003979552.b3lyp_6-31g(d).log.xz 003979552.td-b3lyp_6-31g+(d).inp 003979552.td-b3lyp_6-31g+(d).log.xz

003979552.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979552.td-b3lyp_6-31+g(d).gjf (generated)

003979552.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979552.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979552.mol 003979552.PUBCHEM 003979552.mol (via Jmol)
003979571.b3lyp_6-31g(d).inp

003979571.b3lyp_6-31g(d).qchem.inp (generated)

003979571.b3lyp_6-31g(d).gjf (generated)

003979571.b3lyp_6-31g(d).firefly.inp (generated)

003979571.b3lyp_6-31g(d).smash.inp (generated)

003979571.b3lyp_6-31g(d).nwchem.inp (generated) 003979571.b3lyp_6-31g(d).log.xz 003979571.td-b3lyp_6-31g+(d).inp 003979571.td-b3lyp_6-31g+(d).log.xz

003979571.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979571.td-b3lyp_6-31+g(d).gjf (generated)

003979571.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979571.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979571.mol 003979571.PUBCHEM 003979571.mol (via Jmol)
003979602.b3lyp_6-31g(d).inp

003979602.b3lyp_6-31g(d).qchem.inp (generated)

003979602.b3lyp_6-31g(d).gjf (generated)

003979602.b3lyp_6-31g(d).firefly.inp (generated)

003979602.b3lyp_6-31g(d).smash.inp (generated)

003979602.b3lyp_6-31g(d).nwchem.inp (generated) 003979602.b3lyp_6-31g(d).log.xz 003979602.td-b3lyp_6-31g+(d).inp 003979602.td-b3lyp_6-31g+(d).log.xz

003979602.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979602.td-b3lyp_6-31+g(d).gjf (generated)

003979602.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979602.mol 003979602.PUBCHEM 003979602.mol (via Jmol)
003979643.b3lyp_6-31g(d).inp

003979643.b3lyp_6-31g(d).qchem.inp (generated)

003979643.b3lyp_6-31g(d).gjf (generated)

003979643.b3lyp_6-31g(d).firefly.inp (generated)

003979643.b3lyp_6-31g(d).smash.inp (generated)

003979643.b3lyp_6-31g(d).nwchem.inp (generated) 003979643.b3lyp_6-31g(d).log.xz 003979643.td-b3lyp_6-31g+(d).inp 003979643.td-b3lyp_6-31g+(d).log.xz

003979643.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979643.td-b3lyp_6-31+g(d).gjf (generated)

003979643.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979643.mol 003979643.PUBCHEM 003979643.mol (via Jmol)
003979706.b3lyp_6-31g(d).inp

003979706.b3lyp_6-31g(d).qchem.inp (generated)

003979706.b3lyp_6-31g(d).gjf (generated)

003979706.b3lyp_6-31g(d).firefly.inp (generated)

003979706.b3lyp_6-31g(d).smash.inp (generated)

003979706.b3lyp_6-31g(d).nwchem.inp (generated) 003979706.b3lyp_6-31g(d).log.xz 003979706.td-b3lyp_6-31g+(d).inp 003979706.td-b3lyp_6-31g+(d).log.xz

003979706.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979706.td-b3lyp_6-31+g(d).gjf (generated)

003979706.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979706.mol 003979706.PUBCHEM 003979706.mol (via Jmol)
003979743.b3lyp_6-31g(d).inp

003979743.b3lyp_6-31g(d).qchem.inp (generated)

003979743.b3lyp_6-31g(d).gjf (generated)

003979743.b3lyp_6-31g(d).firefly.inp (generated)

003979743.b3lyp_6-31g(d).smash.inp (generated)

003979743.b3lyp_6-31g(d).nwchem.inp (generated) 003979743.b3lyp_6-31g(d).log.xz 003979743.td-b3lyp_6-31g+(d).inp 003979743.td-b3lyp_6-31g+(d).log.xz

003979743.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979743.td-b3lyp_6-31+g(d).gjf (generated)

003979743.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979743.mol 003979743.PUBCHEM 003979743.mol (via Jmol)
003979824.b3lyp_6-31g(d).inp

003979824.b3lyp_6-31g(d).qchem.inp (generated)

003979824.b3lyp_6-31g(d).gjf (generated)

003979824.b3lyp_6-31g(d).firefly.inp (generated)

003979824.b3lyp_6-31g(d).smash.inp (generated)

003979824.b3lyp_6-31g(d).nwchem.inp (generated) 003979824.b3lyp_6-31g(d).log.xz 003979824.td-b3lyp_6-31g+(d).inp 003979824.td-b3lyp_6-31g+(d).log.xz

003979824.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979824.td-b3lyp_6-31+g(d).gjf (generated)

003979824.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979824.mol 003979824.PUBCHEM 003979824.mol (via Jmol)
003979841.b3lyp_6-31g(d).inp

003979841.b3lyp_6-31g(d).qchem.inp (generated)

003979841.b3lyp_6-31g(d).gjf (generated)

003979841.b3lyp_6-31g(d).firefly.inp (generated)

003979841.b3lyp_6-31g(d).smash.inp (generated)

003979841.b3lyp_6-31g(d).nwchem.inp (generated) 003979841.b3lyp_6-31g(d).log.xz 003979841.td-b3lyp_6-31g+(d).inp 003979841.td-b3lyp_6-31g+(d).log.xz

003979841.td-b3lyp_6-31+g(d).qchem.inp (generated)

003979841.td-b3lyp_6-31+g(d).gjf (generated)

003979841.td-b3lyp_6-31+g(d).firefly.inp (generated)

003979841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003979841.mol 003979841.PUBCHEM 003979841.mol (via Jmol)
003980030.b3lyp_6-31g(d).inp

003980030.b3lyp_6-31g(d).qchem.inp (generated)

003980030.b3lyp_6-31g(d).gjf (generated)

003980030.b3lyp_6-31g(d).firefly.inp (generated)

003980030.b3lyp_6-31g(d).smash.inp (generated)

003980030.b3lyp_6-31g(d).nwchem.inp (generated) 003980030.b3lyp_6-31g(d).log.xz 003980030.td-b3lyp_6-31g+(d).inp 003980030.td-b3lyp_6-31g+(d).log.xz

003980030.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980030.td-b3lyp_6-31+g(d).gjf (generated)

003980030.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980030.mol 003980030.PUBCHEM 003980030.mol (via Jmol)
003980087.b3lyp_6-31g(d).inp

003980087.b3lyp_6-31g(d).qchem.inp (generated)

003980087.b3lyp_6-31g(d).gjf (generated)

003980087.b3lyp_6-31g(d).firefly.inp (generated)

003980087.b3lyp_6-31g(d).smash.inp (generated)

003980087.b3lyp_6-31g(d).nwchem.inp (generated) 003980087.b3lyp_6-31g(d).log.xz 003980087.mol 003980087.PUBCHEM 003980087.mol (via Jmol)
003980138.b3lyp_6-31g(d).inp

003980138.b3lyp_6-31g(d).qchem.inp (generated)

003980138.b3lyp_6-31g(d).gjf (generated)

003980138.b3lyp_6-31g(d).firefly.inp (generated)

003980138.b3lyp_6-31g(d).smash.inp (generated)

003980138.b3lyp_6-31g(d).nwchem.inp (generated) 003980138.b3lyp_6-31g(d).log.xz 003980138.td-b3lyp_6-31g+(d).inp 003980138.td-b3lyp_6-31g+(d).log.xz

003980138.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980138.td-b3lyp_6-31+g(d).gjf (generated)

003980138.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980138.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980138.mol 003980138.PUBCHEM 003980138.mol (via Jmol)
003980156.b3lyp_6-31g(d).inp

003980156.b3lyp_6-31g(d).qchem.inp (generated)

003980156.b3lyp_6-31g(d).gjf (generated)

003980156.b3lyp_6-31g(d).firefly.inp (generated)

003980156.b3lyp_6-31g(d).smash.inp (generated)

003980156.b3lyp_6-31g(d).nwchem.inp (generated) 003980156.b3lyp_6-31g(d).log.xz 003980156.td-b3lyp_6-31g+(d).inp 003980156.td-b3lyp_6-31g+(d).log.xz

003980156.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980156.td-b3lyp_6-31+g(d).gjf (generated)

003980156.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980156.mol 003980156.PUBCHEM 003980156.mol (via Jmol)
003980190.b3lyp_6-31g(d).inp

003980190.b3lyp_6-31g(d).qchem.inp (generated)

003980190.b3lyp_6-31g(d).gjf (generated)

003980190.b3lyp_6-31g(d).firefly.inp (generated)

003980190.b3lyp_6-31g(d).smash.inp (generated)

003980190.b3lyp_6-31g(d).nwchem.inp (generated) 003980190.b3lyp_6-31g(d).log.xz 003980190.td-b3lyp_6-31g+(d).inp 003980190.td-b3lyp_6-31g+(d).log.xz

003980190.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980190.td-b3lyp_6-31+g(d).gjf (generated)

003980190.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980190.mol 003980190.PUBCHEM 003980190.mol (via Jmol)
003980200.b3lyp_6-31g(d).inp

003980200.b3lyp_6-31g(d).qchem.inp (generated)

003980200.b3lyp_6-31g(d).gjf (generated)

003980200.b3lyp_6-31g(d).firefly.inp (generated)

003980200.b3lyp_6-31g(d).smash.inp (generated)

003980200.b3lyp_6-31g(d).nwchem.inp (generated) 003980200.b3lyp_6-31g(d).log.xz 003980200.td-b3lyp_6-31g+(d).inp 003980200.td-b3lyp_6-31g+(d).log.xz

003980200.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980200.td-b3lyp_6-31+g(d).gjf (generated)

003980200.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980200.mol 003980200.PUBCHEM 003980200.mol (via Jmol)
003980201.b3lyp_6-31g(d).inp

003980201.b3lyp_6-31g(d).qchem.inp (generated)

003980201.b3lyp_6-31g(d).gjf (generated)

003980201.b3lyp_6-31g(d).firefly.inp (generated)

003980201.b3lyp_6-31g(d).smash.inp (generated)

003980201.b3lyp_6-31g(d).nwchem.inp (generated) 003980201.b3lyp_6-31g(d).log.xz 003980201.td-b3lyp_6-31g+(d).inp 003980201.td-b3lyp_6-31g+(d).log.xz

003980201.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980201.td-b3lyp_6-31+g(d).gjf (generated)

003980201.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980201.mol 003980201.PUBCHEM 003980201.mol (via Jmol)
003980291.b3lyp_6-31g(d).inp

003980291.b3lyp_6-31g(d).qchem.inp (generated)

003980291.b3lyp_6-31g(d).gjf (generated)

003980291.b3lyp_6-31g(d).firefly.inp (generated)

003980291.b3lyp_6-31g(d).smash.inp (generated)

003980291.b3lyp_6-31g(d).nwchem.inp (generated) 003980291.b3lyp_6-31g(d).log.xz 003980291.td-b3lyp_6-31g+(d).inp 003980291.td-b3lyp_6-31g+(d).log.xz

003980291.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980291.td-b3lyp_6-31+g(d).gjf (generated)

003980291.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980291.mol 003980291.PUBCHEM 003980291.mol (via Jmol)
003980334.b3lyp_6-31g(d).inp

003980334.b3lyp_6-31g(d).qchem.inp (generated)

003980334.b3lyp_6-31g(d).gjf (generated)

003980334.b3lyp_6-31g(d).firefly.inp (generated)

003980334.b3lyp_6-31g(d).smash.inp (generated)

003980334.b3lyp_6-31g(d).nwchem.inp (generated) 003980334.b3lyp_6-31g(d).log.xz 003980334.td-b3lyp_6-31g+(d).inp 003980334.td-b3lyp_6-31g+(d).log.xz

003980334.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980334.td-b3lyp_6-31+g(d).gjf (generated)

003980334.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980334.mol 003980334.PUBCHEM 003980334.mol (via Jmol)
003980500.b3lyp_6-31g(d).inp

003980500.b3lyp_6-31g(d).qchem.inp (generated)

003980500.b3lyp_6-31g(d).gjf (generated)

003980500.b3lyp_6-31g(d).firefly.inp (generated)

003980500.b3lyp_6-31g(d).smash.inp (generated)

003980500.b3lyp_6-31g(d).nwchem.inp (generated) 003980500.b3lyp_6-31g(d).log.xz 003980500.td-b3lyp_6-31g+(d).inp 003980500.td-b3lyp_6-31g+(d).log.xz

003980500.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980500.td-b3lyp_6-31+g(d).gjf (generated)

003980500.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980500.mol 003980500.PUBCHEM 003980500.mol (via Jmol)
003980505.b3lyp_6-31g(d).inp

003980505.b3lyp_6-31g(d).qchem.inp (generated)

003980505.b3lyp_6-31g(d).gjf (generated)

003980505.b3lyp_6-31g(d).firefly.inp (generated)

003980505.b3lyp_6-31g(d).smash.inp (generated)

003980505.b3lyp_6-31g(d).nwchem.inp (generated) 003980505.b3lyp_6-31g(d).log.xz 003980505.td-b3lyp_6-31g+(d).inp 003980505.td-b3lyp_6-31g+(d).log.xz

003980505.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980505.td-b3lyp_6-31+g(d).gjf (generated)

003980505.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980505.mol 003980505.PUBCHEM 003980505.mol (via Jmol)
003980632.b3lyp_6-31g(d).inp

003980632.b3lyp_6-31g(d).qchem.inp (generated)

003980632.b3lyp_6-31g(d).gjf (generated)

003980632.b3lyp_6-31g(d).firefly.inp (generated)

003980632.b3lyp_6-31g(d).smash.inp (generated)

003980632.b3lyp_6-31g(d).nwchem.inp (generated) 003980632.b3lyp_6-31g(d).log.xz 003980632.td-b3lyp_6-31g+(d).inp 003980632.td-b3lyp_6-31g+(d).log.xz

003980632.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980632.td-b3lyp_6-31+g(d).gjf (generated)

003980632.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980632.mol 003980632.PUBCHEM 003980632.mol (via Jmol)
003980642.b3lyp_6-31g(d).inp

003980642.b3lyp_6-31g(d).qchem.inp (generated)

003980642.b3lyp_6-31g(d).gjf (generated)

003980642.b3lyp_6-31g(d).firefly.inp (generated)

003980642.b3lyp_6-31g(d).smash.inp (generated)

003980642.b3lyp_6-31g(d).nwchem.inp (generated) 003980642.b3lyp_6-31g(d).log.xz 003980642.td-b3lyp_6-31g+(d).inp 003980642.td-b3lyp_6-31g+(d).log.xz

003980642.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980642.td-b3lyp_6-31+g(d).gjf (generated)

003980642.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980642.mol 003980642.PUBCHEM 003980642.mol (via Jmol)
003980668.b3lyp_6-31g(d).inp

003980668.b3lyp_6-31g(d).qchem.inp (generated)

003980668.b3lyp_6-31g(d).gjf (generated)

003980668.b3lyp_6-31g(d).firefly.inp (generated)

003980668.b3lyp_6-31g(d).smash.inp (generated)

003980668.b3lyp_6-31g(d).nwchem.inp (generated) 003980668.b3lyp_6-31g(d).log.xz 003980668.td-b3lyp_6-31g+(d).inp 003980668.td-b3lyp_6-31g+(d).log.xz

003980668.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980668.td-b3lyp_6-31+g(d).gjf (generated)

003980668.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980668.mol 003980668.PUBCHEM 003980668.mol (via Jmol)
003980701.b3lyp_6-31g(d).inp

003980701.b3lyp_6-31g(d).qchem.inp (generated)

003980701.b3lyp_6-31g(d).gjf (generated)

003980701.b3lyp_6-31g(d).firefly.inp (generated)

003980701.b3lyp_6-31g(d).smash.inp (generated)

003980701.b3lyp_6-31g(d).nwchem.inp (generated) 003980701.b3lyp_6-31g(d).log.xz 003980701.td-b3lyp_6-31g+(d).inp 003980701.td-b3lyp_6-31g+(d).log.xz

003980701.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980701.td-b3lyp_6-31+g(d).gjf (generated)

003980701.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980701.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980701.mol 003980701.PUBCHEM 003980701.mol (via Jmol)
003980758.b3lyp_6-31g(d).inp

003980758.b3lyp_6-31g(d).qchem.inp (generated)

003980758.b3lyp_6-31g(d).gjf (generated)

003980758.b3lyp_6-31g(d).firefly.inp (generated)

003980758.b3lyp_6-31g(d).smash.inp (generated)

003980758.b3lyp_6-31g(d).nwchem.inp (generated) 003980758.b3lyp_6-31g(d).log.xz 003980758.td-b3lyp_6-31g+(d).inp 003980758.td-b3lyp_6-31g+(d).log.xz

003980758.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980758.td-b3lyp_6-31+g(d).gjf (generated)

003980758.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980758.mol 003980758.PUBCHEM 003980758.mol (via Jmol)
003980808.b3lyp_6-31g(d).inp

003980808.b3lyp_6-31g(d).qchem.inp (generated)

003980808.b3lyp_6-31g(d).gjf (generated)

003980808.b3lyp_6-31g(d).firefly.inp (generated)

003980808.b3lyp_6-31g(d).smash.inp (generated)

003980808.b3lyp_6-31g(d).nwchem.inp (generated) 003980808.b3lyp_6-31g(d).log.xz 003980808.td-b3lyp_6-31g+(d).inp 003980808.td-b3lyp_6-31g+(d).log.xz

003980808.td-b3lyp_6-31+g(d).qchem.inp (generated)

003980808.td-b3lyp_6-31+g(d).gjf (generated)

003980808.td-b3lyp_6-31+g(d).firefly.inp (generated)

003980808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003980808.mol 003980808.PUBCHEM 003980808.mol (via Jmol)
003980992.b3lyp_6-31g(d).inp

003980992.b3lyp_6-31g(d).qchem.inp (generated)

003980992.b3lyp_6-31g(d).gjf (generated)

003980992.b3lyp_6-31g(d).firefly.inp (generated)

003980992.b3lyp_6-31g(d).smash.inp (generated)

003980992.b3lyp_6-31g(d).nwchem.inp (generated) 003980992.b3lyp_6-31g(d).log.xz 003980992.mol 003980992.PUBCHEM 003980992.mol (via Jmol)
003981044.b3lyp_6-31g(d).inp

003981044.b3lyp_6-31g(d).qchem.inp (generated)

003981044.b3lyp_6-31g(d).gjf (generated)

003981044.b3lyp_6-31g(d).firefly.inp (generated)

003981044.b3lyp_6-31g(d).smash.inp (generated)

003981044.b3lyp_6-31g(d).nwchem.inp (generated) 003981044.b3lyp_6-31g(d).log.xz 003981044.td-b3lyp_6-31g+(d).inp 003981044.td-b3lyp_6-31g+(d).log.xz

003981044.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981044.td-b3lyp_6-31+g(d).gjf (generated)

003981044.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981044.mol 003981044.PUBCHEM 003981044.mol (via Jmol)
003981067.b3lyp_6-31g(d).inp

003981067.b3lyp_6-31g(d).qchem.inp (generated)

003981067.b3lyp_6-31g(d).gjf (generated)

003981067.b3lyp_6-31g(d).firefly.inp (generated)

003981067.b3lyp_6-31g(d).smash.inp (generated)

003981067.b3lyp_6-31g(d).nwchem.inp (generated) 003981067.b3lyp_6-31g(d).log.xz 003981067.td-b3lyp_6-31g+(d).inp 003981067.td-b3lyp_6-31g+(d).log.xz

003981067.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981067.td-b3lyp_6-31+g(d).gjf (generated)

003981067.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981067.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981067.mol 003981067.PUBCHEM 003981067.mol (via Jmol)
003981071.b3lyp_6-31g(d).inp

003981071.b3lyp_6-31g(d).qchem.inp (generated)

003981071.b3lyp_6-31g(d).gjf (generated)

003981071.b3lyp_6-31g(d).firefly.inp (generated)

003981071.b3lyp_6-31g(d).smash.inp (generated)

003981071.b3lyp_6-31g(d).nwchem.inp (generated) 003981071.b3lyp_6-31g(d).log.xz 003981071.td-b3lyp_6-31g+(d).inp 003981071.td-b3lyp_6-31g+(d).log.xz

003981071.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981071.td-b3lyp_6-31+g(d).gjf (generated)

003981071.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981071.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981071.mol 003981071.PUBCHEM 003981071.mol (via Jmol)
003981089.b3lyp_6-31g(d).inp

003981089.b3lyp_6-31g(d).qchem.inp (generated)

003981089.b3lyp_6-31g(d).gjf (generated)

003981089.b3lyp_6-31g(d).firefly.inp (generated)

003981089.b3lyp_6-31g(d).smash.inp (generated)

003981089.b3lyp_6-31g(d).nwchem.inp (generated) 003981089.b3lyp_6-31g(d).log.xz 003981089.mol 003981089.PUBCHEM 003981089.mol (via Jmol)
003981101.b3lyp_6-31g(d).inp

003981101.b3lyp_6-31g(d).qchem.inp (generated)

003981101.b3lyp_6-31g(d).gjf (generated)

003981101.b3lyp_6-31g(d).firefly.inp (generated)

003981101.b3lyp_6-31g(d).smash.inp (generated)

003981101.b3lyp_6-31g(d).nwchem.inp (generated) 003981101.b3lyp_6-31g(d).log.xz 003981101.td-b3lyp_6-31g+(d).inp 003981101.td-b3lyp_6-31g+(d).log.xz

003981101.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981101.td-b3lyp_6-31+g(d).gjf (generated)

003981101.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981101.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981101.mol 003981101.PUBCHEM 003981101.mol (via Jmol)
003981131.b3lyp_6-31g(d).inp

003981131.b3lyp_6-31g(d).qchem.inp (generated)

003981131.b3lyp_6-31g(d).gjf (generated)

003981131.b3lyp_6-31g(d).firefly.inp (generated)

003981131.b3lyp_6-31g(d).smash.inp (generated)

003981131.b3lyp_6-31g(d).nwchem.inp (generated) 003981131.b3lyp_6-31g(d).log.xz 003981131.mol 003981131.PUBCHEM 003981131.mol (via Jmol)
003981182.b3lyp_6-31g(d).inp

003981182.b3lyp_6-31g(d).qchem.inp (generated)

003981182.b3lyp_6-31g(d).gjf (generated)

003981182.b3lyp_6-31g(d).firefly.inp (generated)

003981182.b3lyp_6-31g(d).smash.inp (generated)

003981182.b3lyp_6-31g(d).nwchem.inp (generated) 003981182.b3lyp_6-31g(d).log.xz 003981182.td-b3lyp_6-31g+(d).inp 003981182.td-b3lyp_6-31g+(d).log.xz

003981182.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981182.td-b3lyp_6-31+g(d).gjf (generated)

003981182.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981182.mol 003981182.PUBCHEM 003981182.mol (via Jmol)
003981211.b3lyp_6-31g(d).inp

003981211.b3lyp_6-31g(d).qchem.inp (generated)

003981211.b3lyp_6-31g(d).gjf (generated)

003981211.b3lyp_6-31g(d).firefly.inp (generated)

003981211.b3lyp_6-31g(d).smash.inp (generated)

003981211.b3lyp_6-31g(d).nwchem.inp (generated) 003981211.b3lyp_6-31g(d).log.xz 003981211.td-b3lyp_6-31g+(d).inp 003981211.td-b3lyp_6-31g+(d).log.xz

003981211.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981211.td-b3lyp_6-31+g(d).gjf (generated)

003981211.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981211.mol 003981211.PUBCHEM 003981211.mol (via Jmol)
003981275.b3lyp_6-31g(d).inp

003981275.b3lyp_6-31g(d).qchem.inp (generated)

003981275.b3lyp_6-31g(d).gjf (generated)

003981275.b3lyp_6-31g(d).firefly.inp (generated)

003981275.b3lyp_6-31g(d).smash.inp (generated)

003981275.b3lyp_6-31g(d).nwchem.inp (generated) 003981275.b3lyp_6-31g(d).log.xz 003981275.td-b3lyp_6-31g+(d).inp 003981275.td-b3lyp_6-31g+(d).log.xz

003981275.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981275.td-b3lyp_6-31+g(d).gjf (generated)

003981275.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981275.mol 003981275.PUBCHEM 003981275.mol (via Jmol)
003981304.b3lyp_6-31g(d).inp

003981304.b3lyp_6-31g(d).qchem.inp (generated)

003981304.b3lyp_6-31g(d).gjf (generated)

003981304.b3lyp_6-31g(d).firefly.inp (generated)

003981304.b3lyp_6-31g(d).smash.inp (generated)

003981304.b3lyp_6-31g(d).nwchem.inp (generated) 003981304.b3lyp_6-31g(d).log.xz 003981304.td-b3lyp_6-31g+(d).inp 003981304.td-b3lyp_6-31g+(d).log.xz

003981304.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981304.td-b3lyp_6-31+g(d).gjf (generated)

003981304.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981304.mol 003981304.PUBCHEM 003981304.mol (via Jmol)
003981348.b3lyp_6-31g(d).inp

003981348.b3lyp_6-31g(d).qchem.inp (generated)

003981348.b3lyp_6-31g(d).gjf (generated)

003981348.b3lyp_6-31g(d).firefly.inp (generated)

003981348.b3lyp_6-31g(d).smash.inp (generated)

003981348.b3lyp_6-31g(d).nwchem.inp (generated) 003981348.b3lyp_6-31g(d).log.xz 003981348.td-b3lyp_6-31g+(d).inp 003981348.td-b3lyp_6-31g+(d).log.xz

003981348.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981348.td-b3lyp_6-31+g(d).gjf (generated)

003981348.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981348.mol 003981348.PUBCHEM 003981348.mol (via Jmol)
003981420.b3lyp_6-31g(d).inp

003981420.b3lyp_6-31g(d).qchem.inp (generated)

003981420.b3lyp_6-31g(d).gjf (generated)

003981420.b3lyp_6-31g(d).firefly.inp (generated)

003981420.b3lyp_6-31g(d).smash.inp (generated)

003981420.b3lyp_6-31g(d).nwchem.inp (generated) 003981420.b3lyp_6-31g(d).log.xz 003981420.td-b3lyp_6-31g+(d).inp 003981420.td-b3lyp_6-31g+(d).log.xz

003981420.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981420.td-b3lyp_6-31+g(d).gjf (generated)

003981420.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981420.mol 003981420.PUBCHEM 003981420.mol (via Jmol)
003981421.b3lyp_6-31g(d).inp

003981421.b3lyp_6-31g(d).qchem.inp (generated)

003981421.b3lyp_6-31g(d).gjf (generated)

003981421.b3lyp_6-31g(d).firefly.inp (generated)

003981421.b3lyp_6-31g(d).smash.inp (generated)

003981421.b3lyp_6-31g(d).nwchem.inp (generated) 003981421.b3lyp_6-31g(d).log.xz 003981421.td-b3lyp_6-31g+(d).inp 003981421.td-b3lyp_6-31g+(d).log.xz

003981421.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981421.td-b3lyp_6-31+g(d).gjf (generated)

003981421.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981421.mol 003981421.PUBCHEM 003981421.mol (via Jmol)
003981438.b3lyp_6-31g(d).inp

003981438.b3lyp_6-31g(d).qchem.inp (generated)

003981438.b3lyp_6-31g(d).gjf (generated)

003981438.b3lyp_6-31g(d).firefly.inp (generated)

003981438.b3lyp_6-31g(d).smash.inp (generated)

003981438.b3lyp_6-31g(d).nwchem.inp (generated) 003981438.b3lyp_6-31g(d).log.xz 003981438.td-b3lyp_6-31g+(d).inp 003981438.td-b3lyp_6-31g+(d).log.xz

003981438.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981438.td-b3lyp_6-31+g(d).gjf (generated)

003981438.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981438.mol 003981438.PUBCHEM 003981438.mol (via Jmol)
003981542.b3lyp_6-31g(d).inp

003981542.b3lyp_6-31g(d).qchem.inp (generated)

003981542.b3lyp_6-31g(d).gjf (generated)

003981542.b3lyp_6-31g(d).firefly.inp (generated)

003981542.b3lyp_6-31g(d).smash.inp (generated)

003981542.b3lyp_6-31g(d).nwchem.inp (generated) 003981542.b3lyp_6-31g(d).log.xz 003981542.td-b3lyp_6-31g+(d).inp 003981542.td-b3lyp_6-31g+(d).log.xz

003981542.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981542.td-b3lyp_6-31+g(d).gjf (generated)

003981542.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981542.mol 003981542.PUBCHEM 003981542.mol (via Jmol)
003981548.b3lyp_6-31g(d).inp

003981548.b3lyp_6-31g(d).qchem.inp (generated)

003981548.b3lyp_6-31g(d).gjf (generated)

003981548.b3lyp_6-31g(d).firefly.inp (generated)

003981548.b3lyp_6-31g(d).smash.inp (generated)

003981548.b3lyp_6-31g(d).nwchem.inp (generated) 003981548.b3lyp_6-31g(d).log.xz 003981548.td-b3lyp_6-31g+(d).inp 003981548.td-b3lyp_6-31g+(d).log.xz

003981548.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981548.td-b3lyp_6-31+g(d).gjf (generated)

003981548.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981548.mol 003981548.PUBCHEM 003981548.mol (via Jmol)
003981578.b3lyp_6-31g(d).inp

003981578.b3lyp_6-31g(d).qchem.inp (generated)

003981578.b3lyp_6-31g(d).gjf (generated)

003981578.b3lyp_6-31g(d).firefly.inp (generated)

003981578.b3lyp_6-31g(d).smash.inp (generated)

003981578.b3lyp_6-31g(d).nwchem.inp (generated) 003981578.b3lyp_6-31g(d).log.xz 003981578.mol 003981578.PUBCHEM 003981578.mol (via Jmol)
003981587.b3lyp_6-31g(d).inp

003981587.b3lyp_6-31g(d).qchem.inp (generated)

003981587.b3lyp_6-31g(d).gjf (generated)

003981587.b3lyp_6-31g(d).firefly.inp (generated)

003981587.b3lyp_6-31g(d).smash.inp (generated)

003981587.b3lyp_6-31g(d).nwchem.inp (generated) 003981587.b3lyp_6-31g(d).log.xz 003981587.td-b3lyp_6-31g+(d).inp 003981587.td-b3lyp_6-31g+(d).log.xz

003981587.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981587.td-b3lyp_6-31+g(d).gjf (generated)

003981587.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981587.mol 003981587.PUBCHEM 003981587.mol (via Jmol)
003981598.b3lyp_6-31g(d).inp

003981598.b3lyp_6-31g(d).qchem.inp (generated)

003981598.b3lyp_6-31g(d).gjf (generated)

003981598.b3lyp_6-31g(d).firefly.inp (generated)

003981598.b3lyp_6-31g(d).smash.inp (generated)

003981598.b3lyp_6-31g(d).nwchem.inp (generated) 003981598.b3lyp_6-31g(d).log.xz 003981598.td-b3lyp_6-31g+(d).inp 003981598.td-b3lyp_6-31g+(d).log.xz

003981598.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981598.td-b3lyp_6-31+g(d).gjf (generated)

003981598.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981598.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981598.mol 003981598.PUBCHEM 003981598.mol (via Jmol)
003981810.b3lyp_6-31g(d).inp

003981810.b3lyp_6-31g(d).qchem.inp (generated)

003981810.b3lyp_6-31g(d).gjf (generated)

003981810.b3lyp_6-31g(d).firefly.inp (generated)

003981810.b3lyp_6-31g(d).smash.inp (generated)

003981810.b3lyp_6-31g(d).nwchem.inp (generated) 003981810.b3lyp_6-31g(d).log.xz 003981810.mol 003981810.PUBCHEM 003981810.mol (via Jmol)
003981845.b3lyp_6-31g(d).inp

003981845.b3lyp_6-31g(d).qchem.inp (generated)

003981845.b3lyp_6-31g(d).gjf (generated)

003981845.b3lyp_6-31g(d).firefly.inp (generated)

003981845.b3lyp_6-31g(d).smash.inp (generated)

003981845.b3lyp_6-31g(d).nwchem.inp (generated) 003981845.b3lyp_6-31g(d).log.xz 003981845.td-b3lyp_6-31g+(d).inp 003981845.td-b3lyp_6-31g+(d).log.xz

003981845.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981845.td-b3lyp_6-31+g(d).gjf (generated)

003981845.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981845.mol 003981845.PUBCHEM 003981845.mol (via Jmol)
003981889.b3lyp_6-31g(d).inp

003981889.b3lyp_6-31g(d).qchem.inp (generated)

003981889.b3lyp_6-31g(d).gjf (generated)

003981889.b3lyp_6-31g(d).firefly.inp (generated)

003981889.b3lyp_6-31g(d).smash.inp (generated)

003981889.b3lyp_6-31g(d).nwchem.inp (generated) 003981889.b3lyp_6-31g(d).log.xz 003981889.mol 003981889.PUBCHEM 003981889.mol (via Jmol)
003981972.b3lyp_6-31g(d).inp

003981972.b3lyp_6-31g(d).qchem.inp (generated)

003981972.b3lyp_6-31g(d).gjf (generated)

003981972.b3lyp_6-31g(d).firefly.inp (generated)

003981972.b3lyp_6-31g(d).smash.inp (generated)

003981972.b3lyp_6-31g(d).nwchem.inp (generated) 003981972.b3lyp_6-31g(d).log.xz 003981972.td-b3lyp_6-31g+(d).inp 003981972.td-b3lyp_6-31g+(d).log.xz

003981972.td-b3lyp_6-31+g(d).qchem.inp (generated)

003981972.td-b3lyp_6-31+g(d).gjf (generated)

003981972.td-b3lyp_6-31+g(d).firefly.inp (generated)

003981972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003981972.mol 003981972.PUBCHEM 003981972.mol (via Jmol)
003982000.b3lyp_6-31g(d).inp

003982000.b3lyp_6-31g(d).qchem.inp (generated)

003982000.b3lyp_6-31g(d).gjf (generated)

003982000.b3lyp_6-31g(d).firefly.inp (generated)

003982000.b3lyp_6-31g(d).smash.inp (generated)

003982000.b3lyp_6-31g(d).nwchem.inp (generated) 003982000.b3lyp_6-31g(d).log.xz 003982000.td-b3lyp_6-31g+(d).inp 003982000.td-b3lyp_6-31g+(d).log.xz

003982000.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982000.td-b3lyp_6-31+g(d).gjf (generated)

003982000.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982000.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982000.mol 003982000.PUBCHEM 003982000.mol (via Jmol)
003982053.b3lyp_6-31g(d).inp

003982053.b3lyp_6-31g(d).qchem.inp (generated)

003982053.b3lyp_6-31g(d).gjf (generated)

003982053.b3lyp_6-31g(d).firefly.inp (generated)

003982053.b3lyp_6-31g(d).smash.inp (generated)

003982053.b3lyp_6-31g(d).nwchem.inp (generated) 003982053.b3lyp_6-31g(d).log.xz 003982053.mol 003982053.PUBCHEM 003982053.mol (via Jmol)
003982054.b3lyp_6-31g(d).inp

003982054.b3lyp_6-31g(d).qchem.inp (generated)

003982054.b3lyp_6-31g(d).gjf (generated)

003982054.b3lyp_6-31g(d).firefly.inp (generated)

003982054.b3lyp_6-31g(d).smash.inp (generated)

003982054.b3lyp_6-31g(d).nwchem.inp (generated) 003982054.b3lyp_6-31g(d).log.xz 003982054.td-b3lyp_6-31g+(d).inp 003982054.td-b3lyp_6-31g+(d).log.xz

003982054.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982054.td-b3lyp_6-31+g(d).gjf (generated)

003982054.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982054.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982054.mol 003982054.PUBCHEM 003982054.mol (via Jmol)
003982148.b3lyp_6-31g(d).inp

003982148.b3lyp_6-31g(d).qchem.inp (generated)

003982148.b3lyp_6-31g(d).gjf (generated)

003982148.b3lyp_6-31g(d).firefly.inp (generated)

003982148.b3lyp_6-31g(d).smash.inp (generated)

003982148.b3lyp_6-31g(d).nwchem.inp (generated) 003982148.b3lyp_6-31g(d).log.xz 003982148.td-b3lyp_6-31g+(d).inp 003982148.td-b3lyp_6-31g+(d).log.xz

003982148.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982148.td-b3lyp_6-31+g(d).gjf (generated)

003982148.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982148.mol 003982148.PUBCHEM 003982148.mol (via Jmol)
003982152.b3lyp_6-31g(d).inp

003982152.b3lyp_6-31g(d).qchem.inp (generated)

003982152.b3lyp_6-31g(d).gjf (generated)

003982152.b3lyp_6-31g(d).firefly.inp (generated)

003982152.b3lyp_6-31g(d).smash.inp (generated)

003982152.b3lyp_6-31g(d).nwchem.inp (generated) 003982152.b3lyp_6-31g(d).log.xz 003982152.td-b3lyp_6-31g+(d).inp 003982152.td-b3lyp_6-31g+(d).log.xz

003982152.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982152.td-b3lyp_6-31+g(d).gjf (generated)

003982152.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982152.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982152.mol 003982152.PUBCHEM 003982152.mol (via Jmol)
003982158.b3lyp_6-31g(d).inp

003982158.b3lyp_6-31g(d).qchem.inp (generated)

003982158.b3lyp_6-31g(d).gjf (generated)

003982158.b3lyp_6-31g(d).firefly.inp (generated)

003982158.b3lyp_6-31g(d).smash.inp (generated)

003982158.b3lyp_6-31g(d).nwchem.inp (generated) 003982158.b3lyp_6-31g(d).log.xz 003982158.td-b3lyp_6-31g+(d).inp 003982158.td-b3lyp_6-31g+(d).log.xz

003982158.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982158.td-b3lyp_6-31+g(d).gjf (generated)

003982158.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982158.mol 003982158.PUBCHEM 003982158.mol (via Jmol)
003982162.b3lyp_6-31g(d).inp

003982162.b3lyp_6-31g(d).qchem.inp (generated)

003982162.b3lyp_6-31g(d).gjf (generated)

003982162.b3lyp_6-31g(d).firefly.inp (generated)

003982162.b3lyp_6-31g(d).smash.inp (generated)

003982162.b3lyp_6-31g(d).nwchem.inp (generated) 003982162.b3lyp_6-31g(d).log.xz 003982162.td-b3lyp_6-31g+(d).inp 003982162.td-b3lyp_6-31g+(d).log.xz

003982162.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982162.td-b3lyp_6-31+g(d).gjf (generated)

003982162.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982162.mol 003982162.PUBCHEM 003982162.mol (via Jmol)
003982194.b3lyp_6-31g(d).inp

003982194.b3lyp_6-31g(d).qchem.inp (generated)

003982194.b3lyp_6-31g(d).gjf (generated)

003982194.b3lyp_6-31g(d).firefly.inp (generated)

003982194.b3lyp_6-31g(d).smash.inp (generated)

003982194.b3lyp_6-31g(d).nwchem.inp (generated) 003982194.b3lyp_6-31g(d).log.xz 003982194.td-b3lyp_6-31g+(d).inp 003982194.td-b3lyp_6-31g+(d).log.xz

003982194.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982194.td-b3lyp_6-31+g(d).gjf (generated)

003982194.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982194.mol 003982194.PUBCHEM 003982194.mol (via Jmol)
003982215.b3lyp_6-31g(d).inp

003982215.b3lyp_6-31g(d).qchem.inp (generated)

003982215.b3lyp_6-31g(d).gjf (generated)

003982215.b3lyp_6-31g(d).firefly.inp (generated)

003982215.b3lyp_6-31g(d).smash.inp (generated)

003982215.b3lyp_6-31g(d).nwchem.inp (generated) 003982215.b3lyp_6-31g(d).log.xz 003982215.td-b3lyp_6-31g+(d).inp 003982215.td-b3lyp_6-31g+(d).log.xz

003982215.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982215.td-b3lyp_6-31+g(d).gjf (generated)

003982215.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982215.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982215.mol 003982215.PUBCHEM 003982215.mol (via Jmol)
003982289.b3lyp_6-31g(d).inp

003982289.b3lyp_6-31g(d).qchem.inp (generated)

003982289.b3lyp_6-31g(d).gjf (generated)

003982289.b3lyp_6-31g(d).firefly.inp (generated)

003982289.b3lyp_6-31g(d).smash.inp (generated)

003982289.b3lyp_6-31g(d).nwchem.inp (generated) 003982289.b3lyp_6-31g(d).log.xz 003982289.td-b3lyp_6-31g+(d).inp 003982289.td-b3lyp_6-31g+(d).log.xz

003982289.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982289.td-b3lyp_6-31+g(d).gjf (generated)

003982289.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982289.mol 003982289.PUBCHEM 003982289.mol (via Jmol)
003982419.b3lyp_6-31g(d).inp

003982419.b3lyp_6-31g(d).qchem.inp (generated)

003982419.b3lyp_6-31g(d).gjf (generated)

003982419.b3lyp_6-31g(d).firefly.inp (generated)

003982419.b3lyp_6-31g(d).smash.inp (generated)

003982419.b3lyp_6-31g(d).nwchem.inp (generated) 003982419.b3lyp_6-31g(d).log.xz 003982419.td-b3lyp_6-31g+(d).inp 003982419.td-b3lyp_6-31g+(d).log.xz

003982419.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982419.td-b3lyp_6-31+g(d).gjf (generated)

003982419.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982419.mol 003982419.PUBCHEM 003982419.mol (via Jmol)
003982420.b3lyp_6-31g(d).inp

003982420.b3lyp_6-31g(d).qchem.inp (generated)

003982420.b3lyp_6-31g(d).gjf (generated)

003982420.b3lyp_6-31g(d).firefly.inp (generated)

003982420.b3lyp_6-31g(d).smash.inp (generated)

003982420.b3lyp_6-31g(d).nwchem.inp (generated) 003982420.b3lyp_6-31g(d).log.xz 003982420.td-b3lyp_6-31g+(d).inp 003982420.td-b3lyp_6-31g+(d).log.xz

003982420.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982420.td-b3lyp_6-31+g(d).gjf (generated)

003982420.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982420.mol 003982420.PUBCHEM 003982420.mol (via Jmol)
003982430.b3lyp_6-31g(d).inp

003982430.b3lyp_6-31g(d).qchem.inp (generated)

003982430.b3lyp_6-31g(d).gjf (generated)

003982430.b3lyp_6-31g(d).firefly.inp (generated)

003982430.b3lyp_6-31g(d).smash.inp (generated)

003982430.b3lyp_6-31g(d).nwchem.inp (generated) 003982430.b3lyp_6-31g(d).log.xz 003982430.mol 003982430.PUBCHEM 003982430.mol (via Jmol)
003982522.b3lyp_6-31g(d).inp

003982522.b3lyp_6-31g(d).qchem.inp (generated)

003982522.b3lyp_6-31g(d).gjf (generated)

003982522.b3lyp_6-31g(d).firefly.inp (generated)

003982522.b3lyp_6-31g(d).smash.inp (generated)

003982522.b3lyp_6-31g(d).nwchem.inp (generated) 003982522.b3lyp_6-31g(d).log.xz 003982522.td-b3lyp_6-31g+(d).inp 003982522.td-b3lyp_6-31g+(d).log.xz

003982522.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982522.td-b3lyp_6-31+g(d).gjf (generated)

003982522.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982522.mol 003982522.PUBCHEM 003982522.mol (via Jmol)
003982536.b3lyp_6-31g(d).inp

003982536.b3lyp_6-31g(d).qchem.inp (generated)

003982536.b3lyp_6-31g(d).gjf (generated)

003982536.b3lyp_6-31g(d).firefly.inp (generated)

003982536.b3lyp_6-31g(d).smash.inp (generated)

003982536.b3lyp_6-31g(d).nwchem.inp (generated) 003982536.b3lyp_6-31g(d).log.xz 003982536.mol 003982536.PUBCHEM 003982536.mol (via Jmol)
003982585.b3lyp_6-31g(d).inp

003982585.b3lyp_6-31g(d).qchem.inp (generated)

003982585.b3lyp_6-31g(d).gjf (generated)

003982585.b3lyp_6-31g(d).firefly.inp (generated)

003982585.b3lyp_6-31g(d).smash.inp (generated)

003982585.b3lyp_6-31g(d).nwchem.inp (generated) 003982585.b3lyp_6-31g(d).log.xz 003982585.td-b3lyp_6-31g+(d).inp 003982585.td-b3lyp_6-31g+(d).log.xz

003982585.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982585.td-b3lyp_6-31+g(d).gjf (generated)

003982585.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982585.mol 003982585.PUBCHEM 003982585.mol (via Jmol)
003982632.b3lyp_6-31g(d).inp

003982632.b3lyp_6-31g(d).qchem.inp (generated)

003982632.b3lyp_6-31g(d).gjf (generated)

003982632.b3lyp_6-31g(d).firefly.inp (generated)

003982632.b3lyp_6-31g(d).smash.inp (generated)

003982632.b3lyp_6-31g(d).nwchem.inp (generated) 003982632.b3lyp_6-31g(d).log.xz 003982632.td-b3lyp_6-31g+(d).inp 003982632.td-b3lyp_6-31g+(d).log.xz

003982632.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982632.td-b3lyp_6-31+g(d).gjf (generated)

003982632.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982632.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982632.mol 003982632.PUBCHEM 003982632.mol (via Jmol)
003982654.b3lyp_6-31g(d).inp

003982654.b3lyp_6-31g(d).qchem.inp (generated)

003982654.b3lyp_6-31g(d).gjf (generated)

003982654.b3lyp_6-31g(d).firefly.inp (generated)

003982654.b3lyp_6-31g(d).smash.inp (generated)

003982654.b3lyp_6-31g(d).nwchem.inp (generated) 003982654.b3lyp_6-31g(d).log.xz 003982654.td-b3lyp_6-31g+(d).inp 003982654.td-b3lyp_6-31g+(d).log.xz

003982654.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982654.td-b3lyp_6-31+g(d).gjf (generated)

003982654.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982654.mol 003982654.PUBCHEM 003982654.mol (via Jmol)
003982664.b3lyp_6-31g(d).inp

003982664.b3lyp_6-31g(d).qchem.inp (generated)

003982664.b3lyp_6-31g(d).gjf (generated)

003982664.b3lyp_6-31g(d).firefly.inp (generated)

003982664.b3lyp_6-31g(d).smash.inp (generated)

003982664.b3lyp_6-31g(d).nwchem.inp (generated) 003982664.b3lyp_6-31g(d).log.xz 003982664.td-b3lyp_6-31g+(d).inp 003982664.td-b3lyp_6-31g+(d).log.xz

003982664.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982664.td-b3lyp_6-31+g(d).gjf (generated)

003982664.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982664.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982664.mol 003982664.PUBCHEM 003982664.mol (via Jmol)
003982666.b3lyp_6-31g(d).inp

003982666.b3lyp_6-31g(d).qchem.inp (generated)

003982666.b3lyp_6-31g(d).gjf (generated)

003982666.b3lyp_6-31g(d).firefly.inp (generated)

003982666.b3lyp_6-31g(d).smash.inp (generated)

003982666.b3lyp_6-31g(d).nwchem.inp (generated) 003982666.b3lyp_6-31g(d).log.xz 003982666.td-b3lyp_6-31g+(d).inp 003982666.td-b3lyp_6-31g+(d).log.xz

003982666.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982666.td-b3lyp_6-31+g(d).gjf (generated)

003982666.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982666.mol 003982666.PUBCHEM 003982666.mol (via Jmol)
003982767.b3lyp_6-31g(d).inp

003982767.b3lyp_6-31g(d).qchem.inp (generated)

003982767.b3lyp_6-31g(d).gjf (generated)

003982767.b3lyp_6-31g(d).firefly.inp (generated)

003982767.b3lyp_6-31g(d).smash.inp (generated)

003982767.b3lyp_6-31g(d).nwchem.inp (generated) 003982767.b3lyp_6-31g(d).log.xz 003982767.td-b3lyp_6-31g+(d).inp 003982767.td-b3lyp_6-31g+(d).log.xz

003982767.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982767.td-b3lyp_6-31+g(d).gjf (generated)

003982767.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982767.mol 003982767.PUBCHEM 003982767.mol (via Jmol)
003982804.b3lyp_6-31g(d).inp

003982804.b3lyp_6-31g(d).qchem.inp (generated)

003982804.b3lyp_6-31g(d).gjf (generated)

003982804.b3lyp_6-31g(d).firefly.inp (generated)

003982804.b3lyp_6-31g(d).smash.inp (generated)

003982804.b3lyp_6-31g(d).nwchem.inp (generated) 003982804.b3lyp_6-31g(d).log.xz 003982804.td-b3lyp_6-31g+(d).inp 003982804.td-b3lyp_6-31g+(d).log.xz

003982804.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982804.td-b3lyp_6-31+g(d).gjf (generated)

003982804.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982804.mol 003982804.PUBCHEM 003982804.mol (via Jmol)
003982819.b3lyp_6-31g(d).inp

003982819.b3lyp_6-31g(d).qchem.inp (generated)

003982819.b3lyp_6-31g(d).gjf (generated)

003982819.b3lyp_6-31g(d).firefly.inp (generated)

003982819.b3lyp_6-31g(d).smash.inp (generated)

003982819.b3lyp_6-31g(d).nwchem.inp (generated) 003982819.b3lyp_6-31g(d).log.xz 003982819.td-b3lyp_6-31g+(d).inp 003982819.td-b3lyp_6-31g+(d).log.xz

003982819.td-b3lyp_6-31+g(d).qchem.inp (generated)

003982819.td-b3lyp_6-31+g(d).gjf (generated)

003982819.td-b3lyp_6-31+g(d).firefly.inp (generated)

003982819.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003982819.mol 003982819.PUBCHEM 003982819.mol (via Jmol)
003982846.b3lyp_6-31g(d).inp

003982846.b3lyp_6-31g(d).qchem.inp (generated)

003982846.b3lyp_6-31g(d).gjf (generated)

003982846.b3lyp_6-31g(d).firefly.inp (generated)

003982846.b3lyp_6-31g(d).smash.inp (generated)

003982846.b3lyp_6-31g(d).nwchem.inp (generated) 003982846.b3lyp_6-31g(d).log.xz 003982846.mol 003982846.PUBCHEM 003982846.mol (via Jmol)
003983129.b3lyp_6-31g(d).inp

003983129.b3lyp_6-31g(d).qchem.inp (generated)

003983129.b3lyp_6-31g(d).gjf (generated)

003983129.b3lyp_6-31g(d).firefly.inp (generated)

003983129.b3lyp_6-31g(d).smash.inp (generated)

003983129.b3lyp_6-31g(d).nwchem.inp (generated) 003983129.b3lyp_6-31g(d).log.xz 003983129.td-b3lyp_6-31g+(d).inp 003983129.td-b3lyp_6-31g+(d).log.xz

003983129.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983129.td-b3lyp_6-31+g(d).gjf (generated)

003983129.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983129.mol 003983129.PUBCHEM 003983129.mol (via Jmol)
003983357.b3lyp_6-31g(d).inp

003983357.b3lyp_6-31g(d).qchem.inp (generated)

003983357.b3lyp_6-31g(d).gjf (generated)

003983357.b3lyp_6-31g(d).firefly.inp (generated)

003983357.b3lyp_6-31g(d).smash.inp (generated)

003983357.b3lyp_6-31g(d).nwchem.inp (generated) 003983357.b3lyp_6-31g(d).log.xz 003983357.td-b3lyp_6-31g+(d).inp 003983357.td-b3lyp_6-31g+(d).log.xz

003983357.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983357.td-b3lyp_6-31+g(d).gjf (generated)

003983357.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983357.mol 003983357.PUBCHEM 003983357.mol (via Jmol)
003983397.b3lyp_6-31g(d).inp

003983397.b3lyp_6-31g(d).qchem.inp (generated)

003983397.b3lyp_6-31g(d).gjf (generated)

003983397.b3lyp_6-31g(d).firefly.inp (generated)

003983397.b3lyp_6-31g(d).smash.inp (generated)

003983397.b3lyp_6-31g(d).nwchem.inp (generated) 003983397.b3lyp_6-31g(d).log.xz 003983397.td-b3lyp_6-31g+(d).inp 003983397.td-b3lyp_6-31g+(d).log.xz

003983397.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983397.td-b3lyp_6-31+g(d).gjf (generated)

003983397.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983397.mol 003983397.PUBCHEM 003983397.mol (via Jmol)
003983561.b3lyp_6-31g(d).inp

003983561.b3lyp_6-31g(d).qchem.inp (generated)

003983561.b3lyp_6-31g(d).gjf (generated)

003983561.b3lyp_6-31g(d).firefly.inp (generated)

003983561.b3lyp_6-31g(d).smash.inp (generated)

003983561.b3lyp_6-31g(d).nwchem.inp (generated) 003983561.b3lyp_6-31g(d).log.xz 003983561.td-b3lyp_6-31g+(d).inp 003983561.td-b3lyp_6-31g+(d).log.xz

003983561.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983561.td-b3lyp_6-31+g(d).gjf (generated)

003983561.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983561.mol 003983561.PUBCHEM 003983561.mol (via Jmol)
003983678.b3lyp_6-31g(d).inp

003983678.b3lyp_6-31g(d).qchem.inp (generated)

003983678.b3lyp_6-31g(d).gjf (generated)

003983678.b3lyp_6-31g(d).firefly.inp (generated)

003983678.b3lyp_6-31g(d).smash.inp (generated)

003983678.b3lyp_6-31g(d).nwchem.inp (generated) 003983678.b3lyp_6-31g(d).log.xz 003983678.td-b3lyp_6-31g+(d).inp 003983678.td-b3lyp_6-31g+(d).log.xz

003983678.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983678.td-b3lyp_6-31+g(d).gjf (generated)

003983678.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983678.mol 003983678.PUBCHEM 003983678.mol (via Jmol)
003983816.b3lyp_6-31g(d).inp

003983816.b3lyp_6-31g(d).qchem.inp (generated)

003983816.b3lyp_6-31g(d).gjf (generated)

003983816.b3lyp_6-31g(d).firefly.inp (generated)

003983816.b3lyp_6-31g(d).smash.inp (generated)

003983816.b3lyp_6-31g(d).nwchem.inp (generated) 003983816.b3lyp_6-31g(d).log.xz 003983816.td-b3lyp_6-31g+(d).inp 003983816.td-b3lyp_6-31g+(d).log.xz

003983816.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983816.td-b3lyp_6-31+g(d).gjf (generated)

003983816.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983816.mol 003983816.PUBCHEM 003983816.mol (via Jmol)
003983890.b3lyp_6-31g(d).inp

003983890.b3lyp_6-31g(d).qchem.inp (generated)

003983890.b3lyp_6-31g(d).gjf (generated)

003983890.b3lyp_6-31g(d).firefly.inp (generated)

003983890.b3lyp_6-31g(d).smash.inp (generated)

003983890.b3lyp_6-31g(d).nwchem.inp (generated) 003983890.b3lyp_6-31g(d).log.xz 003983890.td-b3lyp_6-31g+(d).inp 003983890.td-b3lyp_6-31g+(d).log.xz

003983890.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983890.td-b3lyp_6-31+g(d).gjf (generated)

003983890.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983890.mol 003983890.PUBCHEM 003983890.mol (via Jmol)
003983932.b3lyp_6-31g(d).inp

003983932.b3lyp_6-31g(d).qchem.inp (generated)

003983932.b3lyp_6-31g(d).gjf (generated)

003983932.b3lyp_6-31g(d).firefly.inp (generated)

003983932.b3lyp_6-31g(d).smash.inp (generated)

003983932.b3lyp_6-31g(d).nwchem.inp (generated) 003983932.b3lyp_6-31g(d).log.xz 003983932.td-b3lyp_6-31g+(d).inp 003983932.td-b3lyp_6-31g+(d).log.xz

003983932.td-b3lyp_6-31+g(d).qchem.inp (generated)

003983932.td-b3lyp_6-31+g(d).gjf (generated)

003983932.td-b3lyp_6-31+g(d).firefly.inp (generated)

003983932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003983932.mol 003983932.PUBCHEM 003983932.mol (via Jmol)
003984013.b3lyp_6-31g(d).inp

003984013.b3lyp_6-31g(d).qchem.inp (generated)

003984013.b3lyp_6-31g(d).gjf (generated)

003984013.b3lyp_6-31g(d).firefly.inp (generated)

003984013.b3lyp_6-31g(d).smash.inp (generated)

003984013.b3lyp_6-31g(d).nwchem.inp (generated) 003984013.b3lyp_6-31g(d).log.xz 003984013.td-b3lyp_6-31g+(d).inp 003984013.td-b3lyp_6-31g+(d).log.xz

003984013.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984013.td-b3lyp_6-31+g(d).gjf (generated)

003984013.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984013.mol 003984013.PUBCHEM 003984013.mol (via Jmol)
003984068.b3lyp_6-31g(d).inp

003984068.b3lyp_6-31g(d).qchem.inp (generated)

003984068.b3lyp_6-31g(d).gjf (generated)

003984068.b3lyp_6-31g(d).firefly.inp (generated)

003984068.b3lyp_6-31g(d).smash.inp (generated)

003984068.b3lyp_6-31g(d).nwchem.inp (generated) 003984068.b3lyp_6-31g(d).log.xz 003984068.td-b3lyp_6-31g+(d).inp 003984068.td-b3lyp_6-31g+(d).log.xz

003984068.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984068.td-b3lyp_6-31+g(d).gjf (generated)

003984068.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984068.mol 003984068.PUBCHEM 003984068.mol (via Jmol)
003984168.b3lyp_6-31g(d).inp

003984168.b3lyp_6-31g(d).qchem.inp (generated)

003984168.b3lyp_6-31g(d).gjf (generated)

003984168.b3lyp_6-31g(d).firefly.inp (generated)

003984168.b3lyp_6-31g(d).smash.inp (generated)

003984168.b3lyp_6-31g(d).nwchem.inp (generated) 003984168.b3lyp_6-31g(d).log.xz 003984168.td-b3lyp_6-31g+(d).inp 003984168.td-b3lyp_6-31g+(d).log.xz

003984168.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984168.td-b3lyp_6-31+g(d).gjf (generated)

003984168.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984168.mol 003984168.PUBCHEM 003984168.mol (via Jmol)
003984322.b3lyp_6-31g(d).inp

003984322.b3lyp_6-31g(d).qchem.inp (generated)

003984322.b3lyp_6-31g(d).gjf (generated)

003984322.b3lyp_6-31g(d).firefly.inp (generated)

003984322.b3lyp_6-31g(d).smash.inp (generated)

003984322.b3lyp_6-31g(d).nwchem.inp (generated) 003984322.b3lyp_6-31g(d).log.xz 003984322.td-b3lyp_6-31g+(d).inp 003984322.td-b3lyp_6-31g+(d).log.xz

003984322.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984322.td-b3lyp_6-31+g(d).gjf (generated)

003984322.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984322.mol 003984322.PUBCHEM 003984322.mol (via Jmol)
003984506.b3lyp_6-31g(d).inp

003984506.b3lyp_6-31g(d).qchem.inp (generated)

003984506.b3lyp_6-31g(d).gjf (generated)

003984506.b3lyp_6-31g(d).firefly.inp (generated)

003984506.b3lyp_6-31g(d).smash.inp (generated)

003984506.b3lyp_6-31g(d).nwchem.inp (generated) 003984506.b3lyp_6-31g(d).log.xz 003984506.td-b3lyp_6-31g+(d).inp 003984506.td-b3lyp_6-31g+(d).log.xz

003984506.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984506.td-b3lyp_6-31+g(d).gjf (generated)

003984506.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984506.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984506.mol 003984506.PUBCHEM 003984506.mol (via Jmol)
003984532.b3lyp_6-31g(d).inp

003984532.b3lyp_6-31g(d).qchem.inp (generated)

003984532.b3lyp_6-31g(d).gjf (generated)

003984532.b3lyp_6-31g(d).firefly.inp (generated)

003984532.b3lyp_6-31g(d).smash.inp (generated)

003984532.b3lyp_6-31g(d).nwchem.inp (generated) 003984532.b3lyp_6-31g(d).log.xz 003984532.td-b3lyp_6-31g+(d).inp 003984532.td-b3lyp_6-31g+(d).log.xz

003984532.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984532.td-b3lyp_6-31+g(d).gjf (generated)

003984532.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984532.mol 003984532.PUBCHEM 003984532.mol (via Jmol)
003984534.b3lyp_6-31g(d).inp

003984534.b3lyp_6-31g(d).qchem.inp (generated)

003984534.b3lyp_6-31g(d).gjf (generated)

003984534.b3lyp_6-31g(d).firefly.inp (generated)

003984534.b3lyp_6-31g(d).smash.inp (generated)

003984534.b3lyp_6-31g(d).nwchem.inp (generated) 003984534.b3lyp_6-31g(d).log.xz 003984534.td-b3lyp_6-31g+(d).inp 003984534.td-b3lyp_6-31g+(d).log.xz

003984534.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984534.td-b3lyp_6-31+g(d).gjf (generated)

003984534.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984534.mol 003984534.PUBCHEM 003984534.mol (via Jmol)
003984587.b3lyp_6-31g(d).inp

003984587.b3lyp_6-31g(d).qchem.inp (generated)

003984587.b3lyp_6-31g(d).gjf (generated)

003984587.b3lyp_6-31g(d).firefly.inp (generated)

003984587.b3lyp_6-31g(d).smash.inp (generated)

003984587.b3lyp_6-31g(d).nwchem.inp (generated) 003984587.b3lyp_6-31g(d).log.xz 003984587.td-b3lyp_6-31g+(d).inp 003984587.td-b3lyp_6-31g+(d).log.xz

003984587.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984587.td-b3lyp_6-31+g(d).gjf (generated)

003984587.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984587.mol 003984587.PUBCHEM 003984587.mol (via Jmol)
003984648.b3lyp_6-31g(d).inp

003984648.b3lyp_6-31g(d).qchem.inp (generated)

003984648.b3lyp_6-31g(d).gjf (generated)

003984648.b3lyp_6-31g(d).firefly.inp (generated)

003984648.b3lyp_6-31g(d).smash.inp (generated)

003984648.b3lyp_6-31g(d).nwchem.inp (generated) 003984648.b3lyp_6-31g(d).log.xz 003984648.td-b3lyp_6-31g+(d).inp 003984648.td-b3lyp_6-31g+(d).log.xz

003984648.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984648.td-b3lyp_6-31+g(d).gjf (generated)

003984648.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984648.mol 003984648.PUBCHEM 003984648.mol (via Jmol)
003984703.b3lyp_6-31g(d).inp

003984703.b3lyp_6-31g(d).qchem.inp (generated)

003984703.b3lyp_6-31g(d).gjf (generated)

003984703.b3lyp_6-31g(d).firefly.inp (generated)

003984703.b3lyp_6-31g(d).smash.inp (generated)

003984703.b3lyp_6-31g(d).nwchem.inp (generated) 003984703.b3lyp_6-31g(d).log.xz 003984703.td-b3lyp_6-31g+(d).inp 003984703.td-b3lyp_6-31g+(d).log.xz

003984703.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984703.td-b3lyp_6-31+g(d).gjf (generated)

003984703.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984703.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984703.mol 003984703.PUBCHEM 003984703.mol (via Jmol)
003984739.b3lyp_6-31g(d).inp

003984739.b3lyp_6-31g(d).qchem.inp (generated)

003984739.b3lyp_6-31g(d).gjf (generated)

003984739.b3lyp_6-31g(d).firefly.inp (generated)

003984739.b3lyp_6-31g(d).smash.inp (generated)

003984739.b3lyp_6-31g(d).nwchem.inp (generated) 003984739.b3lyp_6-31g(d).log.xz 003984739.td-b3lyp_6-31g+(d).inp 003984739.td-b3lyp_6-31g+(d).log.xz

003984739.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984739.td-b3lyp_6-31+g(d).gjf (generated)

003984739.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984739.mol 003984739.PUBCHEM 003984739.mol (via Jmol)
003984807.b3lyp_6-31g(d).inp

003984807.b3lyp_6-31g(d).qchem.inp (generated)

003984807.b3lyp_6-31g(d).gjf (generated)

003984807.b3lyp_6-31g(d).firefly.inp (generated)

003984807.b3lyp_6-31g(d).smash.inp (generated)

003984807.b3lyp_6-31g(d).nwchem.inp (generated) 003984807.b3lyp_6-31g(d).log.xz 003984807.mol 003984807.PUBCHEM 003984807.mol (via Jmol)
003984884.b3lyp_6-31g(d).inp

003984884.b3lyp_6-31g(d).qchem.inp (generated)

003984884.b3lyp_6-31g(d).gjf (generated)

003984884.b3lyp_6-31g(d).firefly.inp (generated)

003984884.b3lyp_6-31g(d).smash.inp (generated)

003984884.b3lyp_6-31g(d).nwchem.inp (generated) 003984884.b3lyp_6-31g(d).log.xz 003984884.td-b3lyp_6-31g+(d).inp 003984884.td-b3lyp_6-31g+(d).log.xz

003984884.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984884.td-b3lyp_6-31+g(d).gjf (generated)

003984884.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984884.mol 003984884.PUBCHEM 003984884.mol (via Jmol)
003984888.b3lyp_6-31g(d).inp

003984888.b3lyp_6-31g(d).qchem.inp (generated)

003984888.b3lyp_6-31g(d).gjf (generated)

003984888.b3lyp_6-31g(d).firefly.inp (generated)

003984888.b3lyp_6-31g(d).smash.inp (generated)

003984888.b3lyp_6-31g(d).nwchem.inp (generated) 003984888.b3lyp_6-31g(d).log.xz 003984888.td-b3lyp_6-31g+(d).inp 003984888.td-b3lyp_6-31g+(d).log.xz

003984888.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984888.td-b3lyp_6-31+g(d).gjf (generated)

003984888.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984888.mol 003984888.PUBCHEM 003984888.mol (via Jmol)
003984945.b3lyp_6-31g(d).inp

003984945.b3lyp_6-31g(d).qchem.inp (generated)

003984945.b3lyp_6-31g(d).gjf (generated)

003984945.b3lyp_6-31g(d).firefly.inp (generated)

003984945.b3lyp_6-31g(d).smash.inp (generated)

003984945.b3lyp_6-31g(d).nwchem.inp (generated) 003984945.b3lyp_6-31g(d).log.xz 003984945.td-b3lyp_6-31g+(d).inp 003984945.td-b3lyp_6-31g+(d).log.xz

003984945.td-b3lyp_6-31+g(d).qchem.inp (generated)

003984945.td-b3lyp_6-31+g(d).gjf (generated)

003984945.td-b3lyp_6-31+g(d).firefly.inp (generated)

003984945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003984945.mol 003984945.PUBCHEM 003984945.mol (via Jmol)
003985004.b3lyp_6-31g(d).inp

003985004.b3lyp_6-31g(d).qchem.inp (generated)

003985004.b3lyp_6-31g(d).gjf (generated)

003985004.b3lyp_6-31g(d).firefly.inp (generated)

003985004.b3lyp_6-31g(d).smash.inp (generated)

003985004.b3lyp_6-31g(d).nwchem.inp (generated) 003985004.b3lyp_6-31g(d).log.xz 003985004.td-b3lyp_6-31g+(d).inp 003985004.td-b3lyp_6-31g+(d).log.xz

003985004.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985004.td-b3lyp_6-31+g(d).gjf (generated)

003985004.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985004.mol 003985004.PUBCHEM 003985004.mol (via Jmol)
003985254.b3lyp_6-31g(d).inp

003985254.b3lyp_6-31g(d).qchem.inp (generated)

003985254.b3lyp_6-31g(d).gjf (generated)

003985254.b3lyp_6-31g(d).firefly.inp (generated)

003985254.b3lyp_6-31g(d).smash.inp (generated)

003985254.b3lyp_6-31g(d).nwchem.inp (generated) 003985254.b3lyp_6-31g(d).log.xz 003985254.td-b3lyp_6-31g+(d).inp 003985254.td-b3lyp_6-31g+(d).log.xz

003985254.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985254.td-b3lyp_6-31+g(d).gjf (generated)

003985254.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985254.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985254.mol 003985254.PUBCHEM 003985254.mol (via Jmol)
003985258.b3lyp_6-31g(d).inp

003985258.b3lyp_6-31g(d).qchem.inp (generated)

003985258.b3lyp_6-31g(d).gjf (generated)

003985258.b3lyp_6-31g(d).firefly.inp (generated)

003985258.b3lyp_6-31g(d).smash.inp (generated)

003985258.b3lyp_6-31g(d).nwchem.inp (generated) 003985258.b3lyp_6-31g(d).log.xz 003985258.td-b3lyp_6-31g+(d).inp 003985258.td-b3lyp_6-31g+(d).log.xz

003985258.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985258.td-b3lyp_6-31+g(d).gjf (generated)

003985258.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985258.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985258.mol 003985258.PUBCHEM 003985258.mol (via Jmol)
003985284.b3lyp_6-31g(d).inp

003985284.b3lyp_6-31g(d).qchem.inp (generated)

003985284.b3lyp_6-31g(d).gjf (generated)

003985284.b3lyp_6-31g(d).firefly.inp (generated)

003985284.b3lyp_6-31g(d).smash.inp (generated)

003985284.b3lyp_6-31g(d).nwchem.inp (generated) 003985284.b3lyp_6-31g(d).log.xz 003985284.td-b3lyp_6-31g+(d).inp 003985284.td-b3lyp_6-31g+(d).log.xz

003985284.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985284.td-b3lyp_6-31+g(d).gjf (generated)

003985284.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985284.mol 003985284.PUBCHEM 003985284.mol (via Jmol)
003985298.b3lyp_6-31g(d).inp

003985298.b3lyp_6-31g(d).qchem.inp (generated)

003985298.b3lyp_6-31g(d).gjf (generated)

003985298.b3lyp_6-31g(d).firefly.inp (generated)

003985298.b3lyp_6-31g(d).smash.inp (generated)

003985298.b3lyp_6-31g(d).nwchem.inp (generated) 003985298.b3lyp_6-31g(d).log.xz 003985298.mol 003985298.PUBCHEM 003985298.mol (via Jmol)
003985306.b3lyp_6-31g(d).inp

003985306.b3lyp_6-31g(d).qchem.inp (generated)

003985306.b3lyp_6-31g(d).gjf (generated)

003985306.b3lyp_6-31g(d).firefly.inp (generated)

003985306.b3lyp_6-31g(d).smash.inp (generated)

003985306.b3lyp_6-31g(d).nwchem.inp (generated) 003985306.b3lyp_6-31g(d).log.xz 003985306.td-b3lyp_6-31g+(d).inp 003985306.td-b3lyp_6-31g+(d).log.xz

003985306.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985306.td-b3lyp_6-31+g(d).gjf (generated)

003985306.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985306.mol 003985306.PUBCHEM 003985306.mol (via Jmol)
003985370.b3lyp_6-31g(d).inp

003985370.b3lyp_6-31g(d).qchem.inp (generated)

003985370.b3lyp_6-31g(d).gjf (generated)

003985370.b3lyp_6-31g(d).firefly.inp (generated)

003985370.b3lyp_6-31g(d).smash.inp (generated)

003985370.b3lyp_6-31g(d).nwchem.inp (generated) 003985370.b3lyp_6-31g(d).log.xz 003985370.td-b3lyp_6-31g+(d).inp 003985370.td-b3lyp_6-31g+(d).log.xz

003985370.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985370.td-b3lyp_6-31+g(d).gjf (generated)

003985370.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985370.mol 003985370.PUBCHEM 003985370.mol (via Jmol)
003985380.b3lyp_6-31g(d).inp

003985380.b3lyp_6-31g(d).qchem.inp (generated)

003985380.b3lyp_6-31g(d).gjf (generated)

003985380.b3lyp_6-31g(d).firefly.inp (generated)

003985380.b3lyp_6-31g(d).smash.inp (generated)

003985380.b3lyp_6-31g(d).nwchem.inp (generated) 003985380.b3lyp_6-31g(d).log.xz 003985380.td-b3lyp_6-31g+(d).inp 003985380.td-b3lyp_6-31g+(d).log.xz

003985380.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985380.td-b3lyp_6-31+g(d).gjf (generated)

003985380.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985380.mol 003985380.PUBCHEM 003985380.mol (via Jmol)
003985382.b3lyp_6-31g(d).inp

003985382.b3lyp_6-31g(d).qchem.inp (generated)

003985382.b3lyp_6-31g(d).gjf (generated)

003985382.b3lyp_6-31g(d).firefly.inp (generated)

003985382.b3lyp_6-31g(d).smash.inp (generated)

003985382.b3lyp_6-31g(d).nwchem.inp (generated) 003985382.b3lyp_6-31g(d).log.xz 003985382.td-b3lyp_6-31g+(d).inp 003985382.td-b3lyp_6-31g+(d).log.xz

003985382.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985382.td-b3lyp_6-31+g(d).gjf (generated)

003985382.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985382.mol 003985382.PUBCHEM 003985382.mol (via Jmol)
003985416.b3lyp_6-31g(d).inp

003985416.b3lyp_6-31g(d).qchem.inp (generated)

003985416.b3lyp_6-31g(d).gjf (generated)

003985416.b3lyp_6-31g(d).firefly.inp (generated)

003985416.b3lyp_6-31g(d).smash.inp (generated)

003985416.b3lyp_6-31g(d).nwchem.inp (generated) 003985416.b3lyp_6-31g(d).log.xz 003985416.td-b3lyp_6-31g+(d).inp 003985416.td-b3lyp_6-31g+(d).log.xz

003985416.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985416.td-b3lyp_6-31+g(d).gjf (generated)

003985416.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985416.mol 003985416.PUBCHEM 003985416.mol (via Jmol)
003985435.b3lyp_6-31g(d).inp

003985435.b3lyp_6-31g(d).qchem.inp (generated)

003985435.b3lyp_6-31g(d).gjf (generated)

003985435.b3lyp_6-31g(d).firefly.inp (generated)

003985435.b3lyp_6-31g(d).smash.inp (generated)

003985435.b3lyp_6-31g(d).nwchem.inp (generated) 003985435.b3lyp_6-31g(d).log.xz 003985435.td-b3lyp_6-31g+(d).inp 003985435.td-b3lyp_6-31g+(d).log.xz

003985435.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985435.td-b3lyp_6-31+g(d).gjf (generated)

003985435.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985435.mol 003985435.PUBCHEM 003985435.mol (via Jmol)
003985457.b3lyp_6-31g(d).inp

003985457.b3lyp_6-31g(d).qchem.inp (generated)

003985457.b3lyp_6-31g(d).gjf (generated)

003985457.b3lyp_6-31g(d).firefly.inp (generated)

003985457.b3lyp_6-31g(d).smash.inp (generated)

003985457.b3lyp_6-31g(d).nwchem.inp (generated) 003985457.b3lyp_6-31g(d).log.xz 003985457.td-b3lyp_6-31g+(d).inp 003985457.td-b3lyp_6-31g+(d).log.xz

003985457.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985457.td-b3lyp_6-31+g(d).gjf (generated)

003985457.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985457.mol 003985457.PUBCHEM 003985457.mol (via Jmol)
003985485.b3lyp_6-31g(d).inp

003985485.b3lyp_6-31g(d).qchem.inp (generated)

003985485.b3lyp_6-31g(d).gjf (generated)

003985485.b3lyp_6-31g(d).firefly.inp (generated)

003985485.b3lyp_6-31g(d).smash.inp (generated)

003985485.b3lyp_6-31g(d).nwchem.inp (generated) 003985485.b3lyp_6-31g(d).log.xz 003985485.td-b3lyp_6-31g+(d).inp 003985485.td-b3lyp_6-31g+(d).log.xz

003985485.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985485.td-b3lyp_6-31+g(d).gjf (generated)

003985485.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985485.mol 003985485.PUBCHEM 003985485.mol (via Jmol)
003985625.b3lyp_6-31g(d).inp

003985625.b3lyp_6-31g(d).qchem.inp (generated)

003985625.b3lyp_6-31g(d).gjf (generated)

003985625.b3lyp_6-31g(d).firefly.inp (generated)

003985625.b3lyp_6-31g(d).smash.inp (generated)

003985625.b3lyp_6-31g(d).nwchem.inp (generated) 003985625.b3lyp_6-31g(d).log.xz 003985625.td-b3lyp_6-31g+(d).inp 003985625.td-b3lyp_6-31g+(d).log.xz

003985625.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985625.td-b3lyp_6-31+g(d).gjf (generated)

003985625.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985625.mol 003985625.PUBCHEM 003985625.mol (via Jmol)
003985679.b3lyp_6-31g(d).inp

003985679.b3lyp_6-31g(d).qchem.inp (generated)

003985679.b3lyp_6-31g(d).gjf (generated)

003985679.b3lyp_6-31g(d).firefly.inp (generated)

003985679.b3lyp_6-31g(d).smash.inp (generated)

003985679.b3lyp_6-31g(d).nwchem.inp (generated) 003985679.b3lyp_6-31g(d).log.xz 003985679.td-b3lyp_6-31g+(d).inp 003985679.td-b3lyp_6-31g+(d).log.xz

003985679.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985679.td-b3lyp_6-31+g(d).gjf (generated)

003985679.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985679.mol 003985679.PUBCHEM 003985679.mol (via Jmol)
003985703.b3lyp_6-31g(d).inp

003985703.b3lyp_6-31g(d).qchem.inp (generated)

003985703.b3lyp_6-31g(d).gjf (generated)

003985703.b3lyp_6-31g(d).firefly.inp (generated)

003985703.b3lyp_6-31g(d).smash.inp (generated)

003985703.b3lyp_6-31g(d).nwchem.inp (generated) 003985703.b3lyp_6-31g(d).log.xz 003985703.mol 003985703.PUBCHEM 003985703.mol (via Jmol)
003985761.b3lyp_6-31g(d).inp

003985761.b3lyp_6-31g(d).qchem.inp (generated)

003985761.b3lyp_6-31g(d).gjf (generated)

003985761.b3lyp_6-31g(d).firefly.inp (generated)

003985761.b3lyp_6-31g(d).smash.inp (generated)

003985761.b3lyp_6-31g(d).nwchem.inp (generated) 003985761.b3lyp_6-31g(d).log.xz 003985761.td-b3lyp_6-31g+(d).inp 003985761.td-b3lyp_6-31g+(d).log.xz

003985761.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985761.td-b3lyp_6-31+g(d).gjf (generated)

003985761.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985761.mol 003985761.PUBCHEM 003985761.mol (via Jmol)
003985792.b3lyp_6-31g(d).inp

003985792.b3lyp_6-31g(d).qchem.inp (generated)

003985792.b3lyp_6-31g(d).gjf (generated)

003985792.b3lyp_6-31g(d).firefly.inp (generated)

003985792.b3lyp_6-31g(d).smash.inp (generated)

003985792.b3lyp_6-31g(d).nwchem.inp (generated) 003985792.b3lyp_6-31g(d).log.xz 003985792.td-b3lyp_6-31g+(d).inp 003985792.td-b3lyp_6-31g+(d).log.xz

003985792.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985792.td-b3lyp_6-31+g(d).gjf (generated)

003985792.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985792.mol 003985792.PUBCHEM 003985792.mol (via Jmol)
003985859.b3lyp_6-31g(d).inp

003985859.b3lyp_6-31g(d).qchem.inp (generated)

003985859.b3lyp_6-31g(d).gjf (generated)

003985859.b3lyp_6-31g(d).firefly.inp (generated)

003985859.b3lyp_6-31g(d).smash.inp (generated)

003985859.b3lyp_6-31g(d).nwchem.inp (generated) 003985859.b3lyp_6-31g(d).log.xz 003985859.td-b3lyp_6-31g+(d).inp 003985859.td-b3lyp_6-31g+(d).log.xz

003985859.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985859.td-b3lyp_6-31+g(d).gjf (generated)

003985859.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985859.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985859.mol 003985859.PUBCHEM 003985859.mol (via Jmol)
003985862.b3lyp_6-31g(d).inp

003985862.b3lyp_6-31g(d).qchem.inp (generated)

003985862.b3lyp_6-31g(d).gjf (generated)

003985862.b3lyp_6-31g(d).firefly.inp (generated)

003985862.b3lyp_6-31g(d).smash.inp (generated)

003985862.b3lyp_6-31g(d).nwchem.inp (generated) 003985862.b3lyp_6-31g(d).log.xz 003985862.td-b3lyp_6-31g+(d).inp 003985862.td-b3lyp_6-31g+(d).log.xz

003985862.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985862.td-b3lyp_6-31+g(d).gjf (generated)

003985862.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985862.mol 003985862.PUBCHEM 003985862.mol (via Jmol)
003985879.b3lyp_6-31g(d).inp

003985879.b3lyp_6-31g(d).qchem.inp (generated)

003985879.b3lyp_6-31g(d).gjf (generated)

003985879.b3lyp_6-31g(d).firefly.inp (generated)

003985879.b3lyp_6-31g(d).smash.inp (generated)

003985879.b3lyp_6-31g(d).nwchem.inp (generated) 003985879.b3lyp_6-31g(d).log.xz 003985879.td-b3lyp_6-31g+(d).inp 003985879.td-b3lyp_6-31g+(d).log.xz

003985879.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985879.td-b3lyp_6-31+g(d).gjf (generated)

003985879.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985879.mol 003985879.PUBCHEM 003985879.mol (via Jmol)
003985933.b3lyp_6-31g(d).inp

003985933.b3lyp_6-31g(d).qchem.inp (generated)

003985933.b3lyp_6-31g(d).gjf (generated)

003985933.b3lyp_6-31g(d).firefly.inp (generated)

003985933.b3lyp_6-31g(d).smash.inp (generated)

003985933.b3lyp_6-31g(d).nwchem.inp (generated) 003985933.b3lyp_6-31g(d).log.xz 003985933.mol 003985933.PUBCHEM 003985933.mol (via Jmol)
003985955.b3lyp_6-31g(d).inp

003985955.b3lyp_6-31g(d).qchem.inp (generated)

003985955.b3lyp_6-31g(d).gjf (generated)

003985955.b3lyp_6-31g(d).firefly.inp (generated)

003985955.b3lyp_6-31g(d).smash.inp (generated)

003985955.b3lyp_6-31g(d).nwchem.inp (generated) 003985955.b3lyp_6-31g(d).log.xz 003985955.td-b3lyp_6-31g+(d).inp 003985955.td-b3lyp_6-31g+(d).log.xz

003985955.td-b3lyp_6-31+g(d).qchem.inp (generated)

003985955.td-b3lyp_6-31+g(d).gjf (generated)

003985955.td-b3lyp_6-31+g(d).firefly.inp (generated)

003985955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003985955.mol 003985955.PUBCHEM 003985955.mol (via Jmol)
003986020.b3lyp_6-31g(d).inp

003986020.b3lyp_6-31g(d).qchem.inp (generated)

003986020.b3lyp_6-31g(d).gjf (generated)

003986020.b3lyp_6-31g(d).firefly.inp (generated)

003986020.b3lyp_6-31g(d).smash.inp (generated)

003986020.b3lyp_6-31g(d).nwchem.inp (generated) 003986020.b3lyp_6-31g(d).log.xz 003986020.td-b3lyp_6-31g+(d).inp 003986020.td-b3lyp_6-31g+(d).log.xz

003986020.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986020.td-b3lyp_6-31+g(d).gjf (generated)

003986020.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986020.mol 003986020.PUBCHEM 003986020.mol (via Jmol)
003986021.b3lyp_6-31g(d).inp

003986021.b3lyp_6-31g(d).qchem.inp (generated)

003986021.b3lyp_6-31g(d).gjf (generated)

003986021.b3lyp_6-31g(d).firefly.inp (generated)

003986021.b3lyp_6-31g(d).smash.inp (generated)

003986021.b3lyp_6-31g(d).nwchem.inp (generated) 003986021.b3lyp_6-31g(d).log.xz 003986021.td-b3lyp_6-31g+(d).inp 003986021.td-b3lyp_6-31g+(d).log.xz

003986021.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986021.td-b3lyp_6-31+g(d).gjf (generated)

003986021.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986021.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986021.mol 003986021.PUBCHEM 003986021.mol (via Jmol)
003986025.b3lyp_6-31g(d).inp

003986025.b3lyp_6-31g(d).qchem.inp (generated)

003986025.b3lyp_6-31g(d).gjf (generated)

003986025.b3lyp_6-31g(d).firefly.inp (generated)

003986025.b3lyp_6-31g(d).smash.inp (generated)

003986025.b3lyp_6-31g(d).nwchem.inp (generated) 003986025.b3lyp_6-31g(d).log.xz 003986025.td-b3lyp_6-31g+(d).inp 003986025.td-b3lyp_6-31g+(d).log.xz

003986025.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986025.td-b3lyp_6-31+g(d).gjf (generated)

003986025.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986025.mol 003986025.PUBCHEM 003986025.mol (via Jmol)
003986028.b3lyp_6-31g(d).inp

003986028.b3lyp_6-31g(d).qchem.inp (generated)

003986028.b3lyp_6-31g(d).gjf (generated)

003986028.b3lyp_6-31g(d).firefly.inp (generated)

003986028.b3lyp_6-31g(d).smash.inp (generated)

003986028.b3lyp_6-31g(d).nwchem.inp (generated) 003986028.b3lyp_6-31g(d).log.xz 003986028.td-b3lyp_6-31g+(d).inp 003986028.td-b3lyp_6-31g+(d).log.xz

003986028.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986028.td-b3lyp_6-31+g(d).gjf (generated)

003986028.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986028.mol 003986028.PUBCHEM 003986028.mol (via Jmol)
003986123.b3lyp_6-31g(d).inp

003986123.b3lyp_6-31g(d).qchem.inp (generated)

003986123.b3lyp_6-31g(d).gjf (generated)

003986123.b3lyp_6-31g(d).firefly.inp (generated)

003986123.b3lyp_6-31g(d).smash.inp (generated)

003986123.b3lyp_6-31g(d).nwchem.inp (generated) 003986123.b3lyp_6-31g(d).log.xz 003986123.td-b3lyp_6-31g+(d).inp 003986123.td-b3lyp_6-31g+(d).log.xz

003986123.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986123.td-b3lyp_6-31+g(d).gjf (generated)

003986123.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986123.mol 003986123.PUBCHEM 003986123.mol (via Jmol)
003986156.b3lyp_6-31g(d).inp

003986156.b3lyp_6-31g(d).qchem.inp (generated)

003986156.b3lyp_6-31g(d).gjf (generated)

003986156.b3lyp_6-31g(d).firefly.inp (generated)

003986156.b3lyp_6-31g(d).smash.inp (generated)

003986156.b3lyp_6-31g(d).nwchem.inp (generated) 003986156.b3lyp_6-31g(d).log.xz 003986156.td-b3lyp_6-31g+(d).inp 003986156.td-b3lyp_6-31g+(d).log.xz

003986156.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986156.td-b3lyp_6-31+g(d).gjf (generated)

003986156.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986156.mol 003986156.PUBCHEM 003986156.mol (via Jmol)
003986159.b3lyp_6-31g(d).inp

003986159.b3lyp_6-31g(d).qchem.inp (generated)

003986159.b3lyp_6-31g(d).gjf (generated)

003986159.b3lyp_6-31g(d).firefly.inp (generated)

003986159.b3lyp_6-31g(d).smash.inp (generated)

003986159.b3lyp_6-31g(d).nwchem.inp (generated) 003986159.b3lyp_6-31g(d).log.xz 003986159.mol 003986159.PUBCHEM 003986159.mol (via Jmol)
003986205.b3lyp_6-31g(d).inp

003986205.b3lyp_6-31g(d).qchem.inp (generated)

003986205.b3lyp_6-31g(d).gjf (generated)

003986205.b3lyp_6-31g(d).firefly.inp (generated)

003986205.b3lyp_6-31g(d).smash.inp (generated)

003986205.b3lyp_6-31g(d).nwchem.inp (generated) 003986205.b3lyp_6-31g(d).log.xz 003986205.td-b3lyp_6-31g+(d).inp 003986205.td-b3lyp_6-31g+(d).log.xz

003986205.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986205.td-b3lyp_6-31+g(d).gjf (generated)

003986205.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986205.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986205.mol 003986205.PUBCHEM 003986205.mol (via Jmol)
003986437.b3lyp_6-31g(d).inp

003986437.b3lyp_6-31g(d).qchem.inp (generated)

003986437.b3lyp_6-31g(d).gjf (generated)

003986437.b3lyp_6-31g(d).firefly.inp (generated)

003986437.b3lyp_6-31g(d).smash.inp (generated)

003986437.b3lyp_6-31g(d).nwchem.inp (generated) 003986437.b3lyp_6-31g(d).log.xz 003986437.td-b3lyp_6-31g+(d).inp 003986437.td-b3lyp_6-31g+(d).log.xz

003986437.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986437.td-b3lyp_6-31+g(d).gjf (generated)

003986437.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986437.mol 003986437.PUBCHEM 003986437.mol (via Jmol)
003986906.b3lyp_6-31g(d).inp

003986906.b3lyp_6-31g(d).qchem.inp (generated)

003986906.b3lyp_6-31g(d).gjf (generated)

003986906.b3lyp_6-31g(d).firefly.inp (generated)

003986906.b3lyp_6-31g(d).smash.inp (generated)

003986906.b3lyp_6-31g(d).nwchem.inp (generated) 003986906.b3lyp_6-31g(d).log.xz 003986906.td-b3lyp_6-31g+(d).inp 003986906.td-b3lyp_6-31g+(d).log.xz

003986906.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986906.td-b3lyp_6-31+g(d).gjf (generated)

003986906.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986906.mol 003986906.PUBCHEM 003986906.mol (via Jmol)
003986907.b3lyp_6-31g(d).inp

003986907.b3lyp_6-31g(d).qchem.inp (generated)

003986907.b3lyp_6-31g(d).gjf (generated)

003986907.b3lyp_6-31g(d).firefly.inp (generated)

003986907.b3lyp_6-31g(d).smash.inp (generated)

003986907.b3lyp_6-31g(d).nwchem.inp (generated) 003986907.b3lyp_6-31g(d).log.xz 003986907.td-b3lyp_6-31g+(d).inp 003986907.td-b3lyp_6-31g+(d).log.xz

003986907.td-b3lyp_6-31+g(d).qchem.inp (generated)

003986907.td-b3lyp_6-31+g(d).gjf (generated)

003986907.td-b3lyp_6-31+g(d).firefly.inp (generated)

003986907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003986907.mol 003986907.PUBCHEM 003986907.mol (via Jmol)
003986949.b3lyp_6-31g(d).inp

003986949.b3lyp_6-31g(d).qchem.inp (generated)

003986949.b3lyp_6-31g(d).gjf (generated)

003986949.b3lyp_6-31g(d).firefly.inp (generated)

003986949.b3lyp_6-31g(d).smash.inp (generated)

003986949.b3lyp_6-31g(d).nwchem.inp (generated) 003986949.b3lyp_6-31g(d).log.xz 003986949.mol 003986949.PUBCHEM 003986949.mol (via Jmol)
003987048.b3lyp_6-31g(d).inp

003987048.b3lyp_6-31g(d).qchem.inp (generated)

003987048.b3lyp_6-31g(d).gjf (generated)

003987048.b3lyp_6-31g(d).firefly.inp (generated)

003987048.b3lyp_6-31g(d).smash.inp (generated)

003987048.b3lyp_6-31g(d).nwchem.inp (generated) 003987048.b3lyp_6-31g(d).log.xz 003987048.td-b3lyp_6-31g+(d).inp 003987048.td-b3lyp_6-31g+(d).log.xz

003987048.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987048.td-b3lyp_6-31+g(d).gjf (generated)

003987048.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987048.mol 003987048.PUBCHEM 003987048.mol (via Jmol)
003987291.b3lyp_6-31g(d).inp

003987291.b3lyp_6-31g(d).qchem.inp (generated)

003987291.b3lyp_6-31g(d).gjf (generated)

003987291.b3lyp_6-31g(d).firefly.inp (generated)

003987291.b3lyp_6-31g(d).smash.inp (generated)

003987291.b3lyp_6-31g(d).nwchem.inp (generated) 003987291.b3lyp_6-31g(d).log.xz 003987291.td-b3lyp_6-31g+(d).inp 003987291.td-b3lyp_6-31g+(d).log.xz

003987291.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987291.td-b3lyp_6-31+g(d).gjf (generated)

003987291.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987291.mol 003987291.PUBCHEM 003987291.mol (via Jmol)
003987350.b3lyp_6-31g(d).inp

003987350.b3lyp_6-31g(d).qchem.inp (generated)

003987350.b3lyp_6-31g(d).gjf (generated)

003987350.b3lyp_6-31g(d).firefly.inp (generated)

003987350.b3lyp_6-31g(d).smash.inp (generated)

003987350.b3lyp_6-31g(d).nwchem.inp (generated) 003987350.b3lyp_6-31g(d).log.xz 003987350.td-b3lyp_6-31g+(d).inp 003987350.td-b3lyp_6-31g+(d).log.xz

003987350.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987350.td-b3lyp_6-31+g(d).gjf (generated)

003987350.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987350.mol 003987350.PUBCHEM 003987350.mol (via Jmol)
003987526.b3lyp_6-31g(d).inp

003987526.b3lyp_6-31g(d).qchem.inp (generated)

003987526.b3lyp_6-31g(d).gjf (generated)

003987526.b3lyp_6-31g(d).firefly.inp (generated)

003987526.b3lyp_6-31g(d).smash.inp (generated)

003987526.b3lyp_6-31g(d).nwchem.inp (generated) 003987526.b3lyp_6-31g(d).log.xz 003987526.td-b3lyp_6-31g+(d).inp 003987526.td-b3lyp_6-31g+(d).log.xz

003987526.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987526.td-b3lyp_6-31+g(d).gjf (generated)

003987526.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987526.mol 003987526.PUBCHEM 003987526.mol (via Jmol)
003987555.b3lyp_6-31g(d).inp

003987555.b3lyp_6-31g(d).qchem.inp (generated)

003987555.b3lyp_6-31g(d).gjf (generated)

003987555.b3lyp_6-31g(d).firefly.inp (generated)

003987555.b3lyp_6-31g(d).smash.inp (generated)

003987555.b3lyp_6-31g(d).nwchem.inp (generated) 003987555.b3lyp_6-31g(d).log.xz 003987555.td-b3lyp_6-31g+(d).inp 003987555.td-b3lyp_6-31g+(d).log.xz

003987555.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987555.td-b3lyp_6-31+g(d).gjf (generated)

003987555.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987555.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987555.mol 003987555.PUBCHEM 003987555.mol (via Jmol)
003987747.b3lyp_6-31g(d).inp

003987747.b3lyp_6-31g(d).qchem.inp (generated)

003987747.b3lyp_6-31g(d).gjf (generated)

003987747.b3lyp_6-31g(d).firefly.inp (generated)

003987747.b3lyp_6-31g(d).smash.inp (generated)

003987747.b3lyp_6-31g(d).nwchem.inp (generated) 003987747.b3lyp_6-31g(d).log.xz 003987747.td-b3lyp_6-31g+(d).inp 003987747.td-b3lyp_6-31g+(d).log.xz

003987747.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987747.td-b3lyp_6-31+g(d).gjf (generated)

003987747.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987747.mol 003987747.PUBCHEM 003987747.mol (via Jmol)
003987770.b3lyp_6-31g(d).inp

003987770.b3lyp_6-31g(d).qchem.inp (generated)

003987770.b3lyp_6-31g(d).gjf (generated)

003987770.b3lyp_6-31g(d).firefly.inp (generated)

003987770.b3lyp_6-31g(d).smash.inp (generated)

003987770.b3lyp_6-31g(d).nwchem.inp (generated) 003987770.b3lyp_6-31g(d).log.xz 003987770.td-b3lyp_6-31g+(d).inp 003987770.td-b3lyp_6-31g+(d).log.xz

003987770.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987770.td-b3lyp_6-31+g(d).gjf (generated)

003987770.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987770.mol 003987770.PUBCHEM 003987770.mol (via Jmol)
003987924.b3lyp_6-31g(d).inp

003987924.b3lyp_6-31g(d).qchem.inp (generated)

003987924.b3lyp_6-31g(d).gjf (generated)

003987924.b3lyp_6-31g(d).firefly.inp (generated)

003987924.b3lyp_6-31g(d).smash.inp (generated)

003987924.b3lyp_6-31g(d).nwchem.inp (generated) 003987924.b3lyp_6-31g(d).log.xz 003987924.td-b3lyp_6-31g+(d).inp 003987924.td-b3lyp_6-31g+(d).log.xz

003987924.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987924.td-b3lyp_6-31+g(d).gjf (generated)

003987924.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987924.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987924.mol 003987924.PUBCHEM 003987924.mol (via Jmol)
003987944.b3lyp_6-31g(d).inp

003987944.b3lyp_6-31g(d).qchem.inp (generated)

003987944.b3lyp_6-31g(d).gjf (generated)

003987944.b3lyp_6-31g(d).firefly.inp (generated)

003987944.b3lyp_6-31g(d).smash.inp (generated)

003987944.b3lyp_6-31g(d).nwchem.inp (generated) 003987944.b3lyp_6-31g(d).log.xz 003987944.mol 003987944.PUBCHEM 003987944.mol (via Jmol)
003987991.b3lyp_6-31g(d).inp

003987991.b3lyp_6-31g(d).qchem.inp (generated)

003987991.b3lyp_6-31g(d).gjf (generated)

003987991.b3lyp_6-31g(d).firefly.inp (generated)

003987991.b3lyp_6-31g(d).smash.inp (generated)

003987991.b3lyp_6-31g(d).nwchem.inp (generated) 003987991.b3lyp_6-31g(d).log.xz 003987991.td-b3lyp_6-31g+(d).inp 003987991.td-b3lyp_6-31g+(d).log.xz

003987991.td-b3lyp_6-31+g(d).qchem.inp (generated)

003987991.td-b3lyp_6-31+g(d).gjf (generated)

003987991.td-b3lyp_6-31+g(d).firefly.inp (generated)

003987991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003987991.mol 003987991.PUBCHEM 003987991.mol (via Jmol)
003988049.b3lyp_6-31g(d).inp

003988049.b3lyp_6-31g(d).qchem.inp (generated)

003988049.b3lyp_6-31g(d).gjf (generated)

003988049.b3lyp_6-31g(d).firefly.inp (generated)

003988049.b3lyp_6-31g(d).smash.inp (generated)

003988049.b3lyp_6-31g(d).nwchem.inp (generated) 003988049.b3lyp_6-31g(d).log.xz 003988049.mol 003988049.PUBCHEM 003988049.mol (via Jmol)
003988130.b3lyp_6-31g(d).inp

003988130.b3lyp_6-31g(d).qchem.inp (generated)

003988130.b3lyp_6-31g(d).gjf (generated)

003988130.b3lyp_6-31g(d).firefly.inp (generated)

003988130.b3lyp_6-31g(d).smash.inp (generated)

003988130.b3lyp_6-31g(d).nwchem.inp (generated) 003988130.b3lyp_6-31g(d).log.xz 003988130.mol 003988130.PUBCHEM 003988130.mol (via Jmol)
003988323.b3lyp_6-31g(d).inp

003988323.b3lyp_6-31g(d).qchem.inp (generated)

003988323.b3lyp_6-31g(d).gjf (generated)

003988323.b3lyp_6-31g(d).firefly.inp (generated)

003988323.b3lyp_6-31g(d).smash.inp (generated)

003988323.b3lyp_6-31g(d).nwchem.inp (generated) 003988323.b3lyp_6-31g(d).log.xz 003988323.td-b3lyp_6-31g+(d).inp 003988323.td-b3lyp_6-31g+(d).log.xz

003988323.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988323.td-b3lyp_6-31+g(d).gjf (generated)

003988323.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988323.mol 003988323.PUBCHEM 003988323.mol (via Jmol)
003988361.b3lyp_6-31g(d).inp

003988361.b3lyp_6-31g(d).qchem.inp (generated)

003988361.b3lyp_6-31g(d).gjf (generated)

003988361.b3lyp_6-31g(d).firefly.inp (generated)

003988361.b3lyp_6-31g(d).smash.inp (generated)

003988361.b3lyp_6-31g(d).nwchem.inp (generated) 003988361.b3lyp_6-31g(d).log.xz 003988361.td-b3lyp_6-31g+(d).inp 003988361.td-b3lyp_6-31g+(d).log.xz

003988361.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988361.td-b3lyp_6-31+g(d).gjf (generated)

003988361.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988361.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988361.mol 003988361.PUBCHEM 003988361.mol (via Jmol)
003988385.b3lyp_6-31g(d).inp

003988385.b3lyp_6-31g(d).qchem.inp (generated)

003988385.b3lyp_6-31g(d).gjf (generated)

003988385.b3lyp_6-31g(d).firefly.inp (generated)

003988385.b3lyp_6-31g(d).smash.inp (generated)

003988385.b3lyp_6-31g(d).nwchem.inp (generated) 003988385.b3lyp_6-31g(d).log.xz 003988385.td-b3lyp_6-31g+(d).inp 003988385.td-b3lyp_6-31g+(d).log.xz

003988385.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988385.td-b3lyp_6-31+g(d).gjf (generated)

003988385.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988385.mol 003988385.PUBCHEM 003988385.mol (via Jmol)
003988386.b3lyp_6-31g(d).inp

003988386.b3lyp_6-31g(d).qchem.inp (generated)

003988386.b3lyp_6-31g(d).gjf (generated)

003988386.b3lyp_6-31g(d).firefly.inp (generated)

003988386.b3lyp_6-31g(d).smash.inp (generated)

003988386.b3lyp_6-31g(d).nwchem.inp (generated) 003988386.b3lyp_6-31g(d).log.xz 003988386.td-b3lyp_6-31g+(d).inp 003988386.td-b3lyp_6-31g+(d).log.xz

003988386.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988386.td-b3lyp_6-31+g(d).gjf (generated)

003988386.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988386.mol 003988386.PUBCHEM 003988386.mol (via Jmol)
003988461.b3lyp_6-31g(d).inp

003988461.b3lyp_6-31g(d).qchem.inp (generated)

003988461.b3lyp_6-31g(d).gjf (generated)

003988461.b3lyp_6-31g(d).firefly.inp (generated)

003988461.b3lyp_6-31g(d).smash.inp (generated)

003988461.b3lyp_6-31g(d).nwchem.inp (generated) 003988461.b3lyp_6-31g(d).log.xz 003988461.td-b3lyp_6-31g+(d).inp 003988461.td-b3lyp_6-31g+(d).log.xz

003988461.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988461.td-b3lyp_6-31+g(d).gjf (generated)

003988461.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988461.mol 003988461.PUBCHEM 003988461.mol (via Jmol)
003988467.b3lyp_6-31g(d).inp

003988467.b3lyp_6-31g(d).qchem.inp (generated)

003988467.b3lyp_6-31g(d).gjf (generated)

003988467.b3lyp_6-31g(d).firefly.inp (generated)

003988467.b3lyp_6-31g(d).smash.inp (generated)

003988467.b3lyp_6-31g(d).nwchem.inp (generated) 003988467.b3lyp_6-31g(d).log.xz 003988467.mol 003988467.PUBCHEM 003988467.mol (via Jmol)
003988516.b3lyp_6-31g(d).inp

003988516.b3lyp_6-31g(d).qchem.inp (generated)

003988516.b3lyp_6-31g(d).gjf (generated)

003988516.b3lyp_6-31g(d).firefly.inp (generated)

003988516.b3lyp_6-31g(d).smash.inp (generated)

003988516.b3lyp_6-31g(d).nwchem.inp (generated) 003988516.b3lyp_6-31g(d).log.xz 003988516.td-b3lyp_6-31g+(d).inp 003988516.td-b3lyp_6-31g+(d).log.xz

003988516.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988516.td-b3lyp_6-31+g(d).gjf (generated)

003988516.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988516.mol 003988516.PUBCHEM 003988516.mol (via Jmol)
003988528.b3lyp_6-31g(d).inp

003988528.b3lyp_6-31g(d).qchem.inp (generated)

003988528.b3lyp_6-31g(d).gjf (generated)

003988528.b3lyp_6-31g(d).firefly.inp (generated)

003988528.b3lyp_6-31g(d).smash.inp (generated)

003988528.b3lyp_6-31g(d).nwchem.inp (generated) 003988528.b3lyp_6-31g(d).log.xz 003988528.td-b3lyp_6-31g+(d).inp 003988528.td-b3lyp_6-31g+(d).log.xz

003988528.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988528.td-b3lyp_6-31+g(d).gjf (generated)

003988528.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988528.mol 003988528.PUBCHEM 003988528.mol (via Jmol)
003988558.b3lyp_6-31g(d).inp

003988558.b3lyp_6-31g(d).qchem.inp (generated)

003988558.b3lyp_6-31g(d).gjf (generated)

003988558.b3lyp_6-31g(d).firefly.inp (generated)

003988558.b3lyp_6-31g(d).smash.inp (generated)

003988558.b3lyp_6-31g(d).nwchem.inp (generated) 003988558.b3lyp_6-31g(d).log.xz 003988558.td-b3lyp_6-31g+(d).inp 003988558.td-b3lyp_6-31g+(d).log.xz

003988558.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988558.td-b3lyp_6-31+g(d).gjf (generated)

003988558.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988558.mol 003988558.PUBCHEM 003988558.mol (via Jmol)
003988672.b3lyp_6-31g(d).inp

003988672.b3lyp_6-31g(d).qchem.inp (generated)

003988672.b3lyp_6-31g(d).gjf (generated)

003988672.b3lyp_6-31g(d).firefly.inp (generated)

003988672.b3lyp_6-31g(d).smash.inp (generated)

003988672.b3lyp_6-31g(d).nwchem.inp (generated) 003988672.b3lyp_6-31g(d).log.xz 003988672.td-b3lyp_6-31g+(d).inp 003988672.td-b3lyp_6-31g+(d).log.xz

003988672.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988672.td-b3lyp_6-31+g(d).gjf (generated)

003988672.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988672.mol 003988672.PUBCHEM 003988672.mol (via Jmol)
003988690.b3lyp_6-31g(d).inp

003988690.b3lyp_6-31g(d).qchem.inp (generated)

003988690.b3lyp_6-31g(d).gjf (generated)

003988690.b3lyp_6-31g(d).firefly.inp (generated)

003988690.b3lyp_6-31g(d).smash.inp (generated)

003988690.b3lyp_6-31g(d).nwchem.inp (generated) 003988690.b3lyp_6-31g(d).log.xz 003988690.mol 003988690.PUBCHEM 003988690.mol (via Jmol)
003988855.b3lyp_6-31g(d).inp

003988855.b3lyp_6-31g(d).qchem.inp (generated)

003988855.b3lyp_6-31g(d).gjf (generated)

003988855.b3lyp_6-31g(d).firefly.inp (generated)

003988855.b3lyp_6-31g(d).smash.inp (generated)

003988855.b3lyp_6-31g(d).nwchem.inp (generated) 003988855.b3lyp_6-31g(d).log.xz 003988855.td-b3lyp_6-31g+(d).inp 003988855.td-b3lyp_6-31g+(d).log.xz

003988855.td-b3lyp_6-31+g(d).qchem.inp (generated)

003988855.td-b3lyp_6-31+g(d).gjf (generated)

003988855.td-b3lyp_6-31+g(d).firefly.inp (generated)

003988855.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003988855.mol 003988855.PUBCHEM 003988855.mol (via Jmol)
003988950.b3lyp_6-31g(d).inp

003988950.b3lyp_6-31g(d).qchem.inp (generated)

003988950.b3lyp_6-31g(d).gjf (generated)

003988950.b3lyp_6-31g(d).firefly.inp (generated)

003988950.b3lyp_6-31g(d).smash.inp (generated)

003988950.b3lyp_6-31g(d).nwchem.inp (generated) 003988950.b3lyp_6-31g(d).log.xz 003988950.mol 003988950.PUBCHEM 003988950.mol (via Jmol)
003988972.b3lyp_6-31g(d).inp

003988972.b3lyp_6-31g(d).qchem.inp (generated)

003988972.b3lyp_6-31g(d).gjf (generated)

003988972.b3lyp_6-31g(d).firefly.inp (generated)

003988972.b3lyp_6-31g(d).smash.inp (generated)

003988972.b3lyp_6-31g(d).nwchem.inp (generated) 003988972.b3lyp_6-31g(d).log.xz 003988972.mol 003988972.PUBCHEM 003988972.mol (via Jmol)
003989306.b3lyp_6-31g(d).inp

003989306.b3lyp_6-31g(d).qchem.inp (generated)

003989306.b3lyp_6-31g(d).gjf (generated)

003989306.b3lyp_6-31g(d).firefly.inp (generated)

003989306.b3lyp_6-31g(d).smash.inp (generated)

003989306.b3lyp_6-31g(d).nwchem.inp (generated) 003989306.b3lyp_6-31g(d).log.xz 003989306.td-b3lyp_6-31g+(d).inp 003989306.td-b3lyp_6-31g+(d).log.xz

003989306.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989306.td-b3lyp_6-31+g(d).gjf (generated)

003989306.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989306.mol 003989306.PUBCHEM 003989306.mol (via Jmol)
003989377.b3lyp_6-31g(d).inp

003989377.b3lyp_6-31g(d).qchem.inp (generated)

003989377.b3lyp_6-31g(d).gjf (generated)

003989377.b3lyp_6-31g(d).firefly.inp (generated)

003989377.b3lyp_6-31g(d).smash.inp (generated)

003989377.b3lyp_6-31g(d).nwchem.inp (generated) 003989377.b3lyp_6-31g(d).log.xz 003989377.td-b3lyp_6-31g+(d).inp 003989377.td-b3lyp_6-31g+(d).log.xz

003989377.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989377.td-b3lyp_6-31+g(d).gjf (generated)

003989377.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989377.mol 003989377.PUBCHEM 003989377.mol (via Jmol)
003989382.b3lyp_6-31g(d).inp

003989382.b3lyp_6-31g(d).qchem.inp (generated)

003989382.b3lyp_6-31g(d).gjf (generated)

003989382.b3lyp_6-31g(d).firefly.inp (generated)

003989382.b3lyp_6-31g(d).smash.inp (generated)

003989382.b3lyp_6-31g(d).nwchem.inp (generated) 003989382.b3lyp_6-31g(d).log.xz 003989382.mol 003989382.PUBCHEM 003989382.mol (via Jmol)
003989419.b3lyp_6-31g(d).inp

003989419.b3lyp_6-31g(d).qchem.inp (generated)

003989419.b3lyp_6-31g(d).gjf (generated)

003989419.b3lyp_6-31g(d).firefly.inp (generated)

003989419.b3lyp_6-31g(d).smash.inp (generated)

003989419.b3lyp_6-31g(d).nwchem.inp (generated) 003989419.b3lyp_6-31g(d).log.xz 003989419.mol 003989419.PUBCHEM 003989419.mol (via Jmol)
003989433.b3lyp_6-31g(d).inp

003989433.b3lyp_6-31g(d).qchem.inp (generated)

003989433.b3lyp_6-31g(d).gjf (generated)

003989433.b3lyp_6-31g(d).firefly.inp (generated)

003989433.b3lyp_6-31g(d).smash.inp (generated)

003989433.b3lyp_6-31g(d).nwchem.inp (generated) 003989433.b3lyp_6-31g(d).log.xz 003989433.mol 003989433.PUBCHEM 003989433.mol (via Jmol)
003989496.b3lyp_6-31g(d).inp

003989496.b3lyp_6-31g(d).qchem.inp (generated)

003989496.b3lyp_6-31g(d).gjf (generated)

003989496.b3lyp_6-31g(d).firefly.inp (generated)

003989496.b3lyp_6-31g(d).smash.inp (generated)

003989496.b3lyp_6-31g(d).nwchem.inp (generated) 003989496.b3lyp_6-31g(d).log.xz 003989496.td-b3lyp_6-31g+(d).inp 003989496.td-b3lyp_6-31g+(d).log.xz

003989496.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989496.td-b3lyp_6-31+g(d).gjf (generated)

003989496.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989496.mol 003989496.PUBCHEM 003989496.mol (via Jmol)
003989519.b3lyp_6-31g(d).inp

003989519.b3lyp_6-31g(d).qchem.inp (generated)

003989519.b3lyp_6-31g(d).gjf (generated)

003989519.b3lyp_6-31g(d).firefly.inp (generated)

003989519.b3lyp_6-31g(d).smash.inp (generated)

003989519.b3lyp_6-31g(d).nwchem.inp (generated) 003989519.b3lyp_6-31g(d).log.xz 003989519.td-b3lyp_6-31g+(d).inp 003989519.td-b3lyp_6-31g+(d).log.xz

003989519.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989519.td-b3lyp_6-31+g(d).gjf (generated)

003989519.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989519.mol 003989519.PUBCHEM 003989519.mol (via Jmol)
003989521.b3lyp_6-31g(d).inp

003989521.b3lyp_6-31g(d).qchem.inp (generated)

003989521.b3lyp_6-31g(d).gjf (generated)

003989521.b3lyp_6-31g(d).firefly.inp (generated)

003989521.b3lyp_6-31g(d).smash.inp (generated)

003989521.b3lyp_6-31g(d).nwchem.inp (generated) 003989521.b3lyp_6-31g(d).log.xz 003989521.mol 003989521.PUBCHEM 003989521.mol (via Jmol)
003989522.b3lyp_6-31g(d).inp

003989522.b3lyp_6-31g(d).qchem.inp (generated)

003989522.b3lyp_6-31g(d).gjf (generated)

003989522.b3lyp_6-31g(d).firefly.inp (generated)

003989522.b3lyp_6-31g(d).smash.inp (generated)

003989522.b3lyp_6-31g(d).nwchem.inp (generated) 003989522.b3lyp_6-31g(d).log.xz 003989522.td-b3lyp_6-31g+(d).inp 003989522.td-b3lyp_6-31g+(d).log.xz

003989522.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989522.td-b3lyp_6-31+g(d).gjf (generated)

003989522.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989522.mol 003989522.PUBCHEM 003989522.mol (via Jmol)
003989625.b3lyp_6-31g(d).inp

003989625.b3lyp_6-31g(d).qchem.inp (generated)

003989625.b3lyp_6-31g(d).gjf (generated)

003989625.b3lyp_6-31g(d).firefly.inp (generated)

003989625.b3lyp_6-31g(d).smash.inp (generated)

003989625.b3lyp_6-31g(d).nwchem.inp (generated) 003989625.b3lyp_6-31g(d).log.xz 003989625.mol 003989625.PUBCHEM 003989625.mol (via Jmol)
003989643.b3lyp_6-31g(d).inp

003989643.b3lyp_6-31g(d).qchem.inp (generated)

003989643.b3lyp_6-31g(d).gjf (generated)

003989643.b3lyp_6-31g(d).firefly.inp (generated)

003989643.b3lyp_6-31g(d).smash.inp (generated)

003989643.b3lyp_6-31g(d).nwchem.inp (generated) 003989643.b3lyp_6-31g(d).log.xz 003989643.td-b3lyp_6-31g+(d).inp 003989643.td-b3lyp_6-31g+(d).log.xz

003989643.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989643.td-b3lyp_6-31+g(d).gjf (generated)

003989643.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989643.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989643.mol 003989643.PUBCHEM 003989643.mol (via Jmol)
003989850.b3lyp_6-31g(d).inp

003989850.b3lyp_6-31g(d).qchem.inp (generated)

003989850.b3lyp_6-31g(d).gjf (generated)

003989850.b3lyp_6-31g(d).firefly.inp (generated)

003989850.b3lyp_6-31g(d).smash.inp (generated)

003989850.b3lyp_6-31g(d).nwchem.inp (generated) 003989850.b3lyp_6-31g(d).log.xz 003989850.mol 003989850.PUBCHEM 003989850.mol (via Jmol)
003989854.b3lyp_6-31g(d).inp

003989854.b3lyp_6-31g(d).qchem.inp (generated)

003989854.b3lyp_6-31g(d).gjf (generated)

003989854.b3lyp_6-31g(d).firefly.inp (generated)

003989854.b3lyp_6-31g(d).smash.inp (generated)

003989854.b3lyp_6-31g(d).nwchem.inp (generated) 003989854.b3lyp_6-31g(d).log.xz 003989854.td-b3lyp_6-31g+(d).inp 003989854.td-b3lyp_6-31g+(d).log.xz

003989854.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989854.td-b3lyp_6-31+g(d).gjf (generated)

003989854.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989854.mol 003989854.PUBCHEM 003989854.mol (via Jmol)
003989862.b3lyp_6-31g(d).inp

003989862.b3lyp_6-31g(d).qchem.inp (generated)

003989862.b3lyp_6-31g(d).gjf (generated)

003989862.b3lyp_6-31g(d).firefly.inp (generated)

003989862.b3lyp_6-31g(d).smash.inp (generated)

003989862.b3lyp_6-31g(d).nwchem.inp (generated) 003989862.b3lyp_6-31g(d).log.xz 003989862.td-b3lyp_6-31g+(d).inp 003989862.td-b3lyp_6-31g+(d).log.xz

003989862.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989862.td-b3lyp_6-31+g(d).gjf (generated)

003989862.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989862.mol 003989862.PUBCHEM 003989862.mol (via Jmol)
003989863.b3lyp_6-31g(d).inp

003989863.b3lyp_6-31g(d).qchem.inp (generated)

003989863.b3lyp_6-31g(d).gjf (generated)

003989863.b3lyp_6-31g(d).firefly.inp (generated)

003989863.b3lyp_6-31g(d).smash.inp (generated)

003989863.b3lyp_6-31g(d).nwchem.inp (generated) 003989863.b3lyp_6-31g(d).log.xz 003989863.td-b3lyp_6-31g+(d).inp 003989863.td-b3lyp_6-31g+(d).log.xz

003989863.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989863.td-b3lyp_6-31+g(d).gjf (generated)

003989863.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989863.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989863.mol 003989863.PUBCHEM 003989863.mol (via Jmol)
003989877.b3lyp_6-31g(d).inp

003989877.b3lyp_6-31g(d).qchem.inp (generated)

003989877.b3lyp_6-31g(d).gjf (generated)

003989877.b3lyp_6-31g(d).firefly.inp (generated)

003989877.b3lyp_6-31g(d).smash.inp (generated)

003989877.b3lyp_6-31g(d).nwchem.inp (generated) 003989877.b3lyp_6-31g(d).log.xz 003989877.td-b3lyp_6-31g+(d).inp 003989877.td-b3lyp_6-31g+(d).log.xz

003989877.td-b3lyp_6-31+g(d).qchem.inp (generated)

003989877.td-b3lyp_6-31+g(d).gjf (generated)

003989877.td-b3lyp_6-31+g(d).firefly.inp (generated)

003989877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003989877.mol 003989877.PUBCHEM 003989877.mol (via Jmol)
003990120.b3lyp_6-31g(d).inp

003990120.b3lyp_6-31g(d).qchem.inp (generated)

003990120.b3lyp_6-31g(d).gjf (generated)

003990120.b3lyp_6-31g(d).firefly.inp (generated)

003990120.b3lyp_6-31g(d).smash.inp (generated)

003990120.b3lyp_6-31g(d).nwchem.inp (generated) 003990120.b3lyp_6-31g(d).log.xz 003990120.td-b3lyp_6-31g+(d).inp 003990120.td-b3lyp_6-31g+(d).log.xz

003990120.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990120.td-b3lyp_6-31+g(d).gjf (generated)

003990120.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990120.mol 003990120.PUBCHEM 003990120.mol (via Jmol)
003990121.b3lyp_6-31g(d).inp

003990121.b3lyp_6-31g(d).qchem.inp (generated)

003990121.b3lyp_6-31g(d).gjf (generated)

003990121.b3lyp_6-31g(d).firefly.inp (generated)

003990121.b3lyp_6-31g(d).smash.inp (generated)

003990121.b3lyp_6-31g(d).nwchem.inp (generated) 003990121.b3lyp_6-31g(d).log.xz 003990121.mol 003990121.PUBCHEM 003990121.mol (via Jmol)
003990168.b3lyp_6-31g(d).inp

003990168.b3lyp_6-31g(d).qchem.inp (generated)

003990168.b3lyp_6-31g(d).gjf (generated)

003990168.b3lyp_6-31g(d).firefly.inp (generated)

003990168.b3lyp_6-31g(d).smash.inp (generated)

003990168.b3lyp_6-31g(d).nwchem.inp (generated) 003990168.b3lyp_6-31g(d).log.xz 003990168.mol 003990168.PUBCHEM 003990168.mol (via Jmol)
003990169.b3lyp_6-31g(d).inp

003990169.b3lyp_6-31g(d).qchem.inp (generated)

003990169.b3lyp_6-31g(d).gjf (generated)

003990169.b3lyp_6-31g(d).firefly.inp (generated)

003990169.b3lyp_6-31g(d).smash.inp (generated)

003990169.b3lyp_6-31g(d).nwchem.inp (generated) 003990169.b3lyp_6-31g(d).log.xz 003990169.td-b3lyp_6-31g+(d).inp 003990169.td-b3lyp_6-31g+(d).log.xz

003990169.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990169.td-b3lyp_6-31+g(d).gjf (generated)

003990169.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990169.mol 003990169.PUBCHEM 003990169.mol (via Jmol)
003990173.b3lyp_6-31g(d).inp

003990173.b3lyp_6-31g(d).qchem.inp (generated)

003990173.b3lyp_6-31g(d).gjf (generated)

003990173.b3lyp_6-31g(d).firefly.inp (generated)

003990173.b3lyp_6-31g(d).smash.inp (generated)

003990173.b3lyp_6-31g(d).nwchem.inp (generated) 003990173.b3lyp_6-31g(d).log.xz 003990173.mol 003990173.PUBCHEM 003990173.mol (via Jmol)
003990366.b3lyp_6-31g(d).inp

003990366.b3lyp_6-31g(d).qchem.inp (generated)

003990366.b3lyp_6-31g(d).gjf (generated)

003990366.b3lyp_6-31g(d).firefly.inp (generated)

003990366.b3lyp_6-31g(d).smash.inp (generated)

003990366.b3lyp_6-31g(d).nwchem.inp (generated) 003990366.b3lyp_6-31g(d).log.xz 003990366.mol 003990366.PUBCHEM 003990366.mol (via Jmol)
003990385.b3lyp_6-31g(d).inp

003990385.b3lyp_6-31g(d).qchem.inp (generated)

003990385.b3lyp_6-31g(d).gjf (generated)

003990385.b3lyp_6-31g(d).firefly.inp (generated)

003990385.b3lyp_6-31g(d).smash.inp (generated)

003990385.b3lyp_6-31g(d).nwchem.inp (generated) 003990385.b3lyp_6-31g(d).log.xz 003990385.mol 003990385.PUBCHEM 003990385.mol (via Jmol)
003990579.b3lyp_6-31g(d).inp

003990579.b3lyp_6-31g(d).qchem.inp (generated)

003990579.b3lyp_6-31g(d).gjf (generated)

003990579.b3lyp_6-31g(d).firefly.inp (generated)

003990579.b3lyp_6-31g(d).smash.inp (generated)

003990579.b3lyp_6-31g(d).nwchem.inp (generated) 003990579.b3lyp_6-31g(d).log.xz 003990579.td-b3lyp_6-31g+(d).inp 003990579.td-b3lyp_6-31g+(d).log.xz

003990579.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990579.td-b3lyp_6-31+g(d).gjf (generated)

003990579.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990579.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990579.mol 003990579.PUBCHEM 003990579.mol (via Jmol)
003990584.b3lyp_6-31g(d).inp

003990584.b3lyp_6-31g(d).qchem.inp (generated)

003990584.b3lyp_6-31g(d).gjf (generated)

003990584.b3lyp_6-31g(d).firefly.inp (generated)

003990584.b3lyp_6-31g(d).smash.inp (generated)

003990584.b3lyp_6-31g(d).nwchem.inp (generated) 003990584.b3lyp_6-31g(d).log.xz 003990584.td-b3lyp_6-31g+(d).inp 003990584.td-b3lyp_6-31g+(d).log.xz

003990584.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990584.td-b3lyp_6-31+g(d).gjf (generated)

003990584.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990584.mol 003990584.PUBCHEM 003990584.mol (via Jmol)
003990585.b3lyp_6-31g(d).inp

003990585.b3lyp_6-31g(d).qchem.inp (generated)

003990585.b3lyp_6-31g(d).gjf (generated)

003990585.b3lyp_6-31g(d).firefly.inp (generated)

003990585.b3lyp_6-31g(d).smash.inp (generated)

003990585.b3lyp_6-31g(d).nwchem.inp (generated) 003990585.b3lyp_6-31g(d).log.xz 003990585.td-b3lyp_6-31g+(d).inp 003990585.td-b3lyp_6-31g+(d).log.xz

003990585.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990585.td-b3lyp_6-31+g(d).gjf (generated)

003990585.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990585.mol 003990585.PUBCHEM 003990585.mol (via Jmol)
003990672.b3lyp_6-31g(d).inp

003990672.b3lyp_6-31g(d).qchem.inp (generated)

003990672.b3lyp_6-31g(d).gjf (generated)

003990672.b3lyp_6-31g(d).firefly.inp (generated)

003990672.b3lyp_6-31g(d).smash.inp (generated)

003990672.b3lyp_6-31g(d).nwchem.inp (generated) 003990672.b3lyp_6-31g(d).log.xz 003990672.td-b3lyp_6-31g+(d).inp 003990672.td-b3lyp_6-31g+(d).log.xz

003990672.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990672.td-b3lyp_6-31+g(d).gjf (generated)

003990672.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990672.mol 003990672.PUBCHEM 003990672.mol (via Jmol)
003990688.b3lyp_6-31g(d).inp

003990688.b3lyp_6-31g(d).qchem.inp (generated)

003990688.b3lyp_6-31g(d).gjf (generated)

003990688.b3lyp_6-31g(d).firefly.inp (generated)

003990688.b3lyp_6-31g(d).smash.inp (generated)

003990688.b3lyp_6-31g(d).nwchem.inp (generated) 003990688.b3lyp_6-31g(d).log.xz 003990688.td-b3lyp_6-31g+(d).inp 003990688.td-b3lyp_6-31g+(d).log.xz

003990688.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990688.td-b3lyp_6-31+g(d).gjf (generated)

003990688.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990688.mol 003990688.PUBCHEM 003990688.mol (via Jmol)
003990692.b3lyp_6-31g(d).inp

003990692.b3lyp_6-31g(d).qchem.inp (generated)

003990692.b3lyp_6-31g(d).gjf (generated)

003990692.b3lyp_6-31g(d).firefly.inp (generated)

003990692.b3lyp_6-31g(d).smash.inp (generated)

003990692.b3lyp_6-31g(d).nwchem.inp (generated) 003990692.b3lyp_6-31g(d).log.xz 003990692.td-b3lyp_6-31g+(d).inp 003990692.td-b3lyp_6-31g+(d).log.xz

003990692.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990692.td-b3lyp_6-31+g(d).gjf (generated)

003990692.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990692.mol 003990692.PUBCHEM 003990692.mol (via Jmol)
003990702.b3lyp_6-31g(d).inp

003990702.b3lyp_6-31g(d).qchem.inp (generated)

003990702.b3lyp_6-31g(d).gjf (generated)

003990702.b3lyp_6-31g(d).firefly.inp (generated)

003990702.b3lyp_6-31g(d).smash.inp (generated)

003990702.b3lyp_6-31g(d).nwchem.inp (generated) 003990702.b3lyp_6-31g(d).log.xz 003990702.mol 003990702.PUBCHEM 003990702.mol (via Jmol)
003990743.b3lyp_6-31g(d).inp

003990743.b3lyp_6-31g(d).qchem.inp (generated)

003990743.b3lyp_6-31g(d).gjf (generated)

003990743.b3lyp_6-31g(d).firefly.inp (generated)

003990743.b3lyp_6-31g(d).smash.inp (generated)

003990743.b3lyp_6-31g(d).nwchem.inp (generated) 003990743.b3lyp_6-31g(d).log.xz 003990743.mol 003990743.PUBCHEM 003990743.mol (via Jmol)
003990745.b3lyp_6-31g(d).inp

003990745.b3lyp_6-31g(d).qchem.inp (generated)

003990745.b3lyp_6-31g(d).gjf (generated)

003990745.b3lyp_6-31g(d).firefly.inp (generated)

003990745.b3lyp_6-31g(d).smash.inp (generated)

003990745.b3lyp_6-31g(d).nwchem.inp (generated) 003990745.b3lyp_6-31g(d).log.xz 003990745.td-b3lyp_6-31g+(d).inp 003990745.td-b3lyp_6-31g+(d).log.xz

003990745.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990745.td-b3lyp_6-31+g(d).gjf (generated)

003990745.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990745.mol 003990745.PUBCHEM 003990745.mol (via Jmol)
003990749.b3lyp_6-31g(d).inp

003990749.b3lyp_6-31g(d).qchem.inp (generated)

003990749.b3lyp_6-31g(d).gjf (generated)

003990749.b3lyp_6-31g(d).firefly.inp (generated)

003990749.b3lyp_6-31g(d).smash.inp (generated)

003990749.b3lyp_6-31g(d).nwchem.inp (generated) 003990749.b3lyp_6-31g(d).log.xz 003990749.mol 003990749.PUBCHEM 003990749.mol (via Jmol)
003990800.b3lyp_6-31g(d).inp

003990800.b3lyp_6-31g(d).qchem.inp (generated)

003990800.b3lyp_6-31g(d).gjf (generated)

003990800.b3lyp_6-31g(d).firefly.inp (generated)

003990800.b3lyp_6-31g(d).smash.inp (generated)

003990800.b3lyp_6-31g(d).nwchem.inp (generated) 003990800.b3lyp_6-31g(d).log.xz 003990800.td-b3lyp_6-31g+(d).inp 003990800.td-b3lyp_6-31g+(d).log.xz

003990800.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990800.td-b3lyp_6-31+g(d).gjf (generated)

003990800.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990800.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990800.mol 003990800.PUBCHEM 003990800.mol (via Jmol)
003990946.b3lyp_6-31g(d).inp

003990946.b3lyp_6-31g(d).qchem.inp (generated)

003990946.b3lyp_6-31g(d).gjf (generated)

003990946.b3lyp_6-31g(d).firefly.inp (generated)

003990946.b3lyp_6-31g(d).smash.inp (generated)

003990946.b3lyp_6-31g(d).nwchem.inp (generated) 003990946.b3lyp_6-31g(d).log.xz 003990946.td-b3lyp_6-31g+(d).inp 003990946.td-b3lyp_6-31g+(d).log.xz

003990946.td-b3lyp_6-31+g(d).qchem.inp (generated)

003990946.td-b3lyp_6-31+g(d).gjf (generated)

003990946.td-b3lyp_6-31+g(d).firefly.inp (generated)

003990946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003990946.mol 003990946.PUBCHEM 003990946.mol (via Jmol)
003991024.b3lyp_6-31g(d).inp

003991024.b3lyp_6-31g(d).qchem.inp (generated)

003991024.b3lyp_6-31g(d).gjf (generated)

003991024.b3lyp_6-31g(d).firefly.inp (generated)

003991024.b3lyp_6-31g(d).smash.inp (generated)

003991024.b3lyp_6-31g(d).nwchem.inp (generated) 003991024.b3lyp_6-31g(d).log.xz 003991024.td-b3lyp_6-31g+(d).inp 003991024.td-b3lyp_6-31g+(d).log.xz

003991024.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991024.td-b3lyp_6-31+g(d).gjf (generated)

003991024.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991024.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991024.mol 003991024.PUBCHEM 003991024.mol (via Jmol)
003991050.b3lyp_6-31g(d).inp

003991050.b3lyp_6-31g(d).qchem.inp (generated)

003991050.b3lyp_6-31g(d).gjf (generated)

003991050.b3lyp_6-31g(d).firefly.inp (generated)

003991050.b3lyp_6-31g(d).smash.inp (generated)

003991050.b3lyp_6-31g(d).nwchem.inp (generated) 003991050.b3lyp_6-31g(d).log.xz 003991050.td-b3lyp_6-31g+(d).inp 003991050.td-b3lyp_6-31g+(d).log.xz

003991050.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991050.td-b3lyp_6-31+g(d).gjf (generated)

003991050.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991050.mol 003991050.PUBCHEM 003991050.mol (via Jmol)
003991079.b3lyp_6-31g(d).inp

003991079.b3lyp_6-31g(d).qchem.inp (generated)

003991079.b3lyp_6-31g(d).gjf (generated)

003991079.b3lyp_6-31g(d).firefly.inp (generated)

003991079.b3lyp_6-31g(d).smash.inp (generated)

003991079.b3lyp_6-31g(d).nwchem.inp (generated) 003991079.b3lyp_6-31g(d).log.xz 003991079.td-b3lyp_6-31g+(d).inp 003991079.td-b3lyp_6-31g+(d).log.xz

003991079.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991079.td-b3lyp_6-31+g(d).gjf (generated)

003991079.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991079.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991079.mol 003991079.PUBCHEM 003991079.mol (via Jmol)
003991161.b3lyp_6-31g(d).inp

003991161.b3lyp_6-31g(d).qchem.inp (generated)

003991161.b3lyp_6-31g(d).gjf (generated)

003991161.b3lyp_6-31g(d).firefly.inp (generated)

003991161.b3lyp_6-31g(d).smash.inp (generated)

003991161.b3lyp_6-31g(d).nwchem.inp (generated) 003991161.b3lyp_6-31g(d).log.xz 003991161.td-b3lyp_6-31g+(d).inp 003991161.td-b3lyp_6-31g+(d).log.xz

003991161.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991161.td-b3lyp_6-31+g(d).gjf (generated)

003991161.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991161.mol 003991161.PUBCHEM 003991161.mol (via Jmol)
003991165.b3lyp_6-31g(d).inp

003991165.b3lyp_6-31g(d).qchem.inp (generated)

003991165.b3lyp_6-31g(d).gjf (generated)

003991165.b3lyp_6-31g(d).firefly.inp (generated)

003991165.b3lyp_6-31g(d).smash.inp (generated)

003991165.b3lyp_6-31g(d).nwchem.inp (generated) 003991165.b3lyp_6-31g(d).log.xz 003991165.td-b3lyp_6-31g+(d).inp 003991165.td-b3lyp_6-31g+(d).log.xz

003991165.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991165.td-b3lyp_6-31+g(d).gjf (generated)

003991165.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991165.mol 003991165.PUBCHEM 003991165.mol (via Jmol)
003991261.b3lyp_6-31g(d).inp

003991261.b3lyp_6-31g(d).qchem.inp (generated)

003991261.b3lyp_6-31g(d).gjf (generated)

003991261.b3lyp_6-31g(d).firefly.inp (generated)

003991261.b3lyp_6-31g(d).smash.inp (generated)

003991261.b3lyp_6-31g(d).nwchem.inp (generated) 003991261.b3lyp_6-31g(d).log.xz 003991261.td-b3lyp_6-31g+(d).inp 003991261.td-b3lyp_6-31g+(d).log.xz

003991261.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991261.td-b3lyp_6-31+g(d).gjf (generated)

003991261.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991261.mol 003991261.PUBCHEM 003991261.mol (via Jmol)
003991279.b3lyp_6-31g(d).inp

003991279.b3lyp_6-31g(d).qchem.inp (generated)

003991279.b3lyp_6-31g(d).gjf (generated)

003991279.b3lyp_6-31g(d).firefly.inp (generated)

003991279.b3lyp_6-31g(d).smash.inp (generated)

003991279.b3lyp_6-31g(d).nwchem.inp (generated) 003991279.b3lyp_6-31g(d).log.xz 003991279.td-b3lyp_6-31g+(d).inp 003991279.td-b3lyp_6-31g+(d).log.xz

003991279.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991279.td-b3lyp_6-31+g(d).gjf (generated)

003991279.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991279.mol 003991279.PUBCHEM 003991279.mol (via Jmol)
003991363.b3lyp_6-31g(d).inp

003991363.b3lyp_6-31g(d).qchem.inp (generated)

003991363.b3lyp_6-31g(d).gjf (generated)

003991363.b3lyp_6-31g(d).firefly.inp (generated)

003991363.b3lyp_6-31g(d).smash.inp (generated)

003991363.b3lyp_6-31g(d).nwchem.inp (generated) 003991363.b3lyp_6-31g(d).log.xz 003991363.mol 003991363.PUBCHEM 003991363.mol (via Jmol)
003991502.b3lyp_6-31g(d).inp

003991502.b3lyp_6-31g(d).qchem.inp (generated)

003991502.b3lyp_6-31g(d).gjf (generated)

003991502.b3lyp_6-31g(d).firefly.inp (generated)

003991502.b3lyp_6-31g(d).smash.inp (generated)

003991502.b3lyp_6-31g(d).nwchem.inp (generated) 003991502.b3lyp_6-31g(d).log.xz 003991502.mol 003991502.PUBCHEM 003991502.mol (via Jmol)
003991750.b3lyp_6-31g(d).inp

003991750.b3lyp_6-31g(d).qchem.inp (generated)

003991750.b3lyp_6-31g(d).gjf (generated)

003991750.b3lyp_6-31g(d).firefly.inp (generated)

003991750.b3lyp_6-31g(d).smash.inp (generated)

003991750.b3lyp_6-31g(d).nwchem.inp (generated) 003991750.b3lyp_6-31g(d).log.xz 003991750.mol 003991750.PUBCHEM 003991750.mol (via Jmol)
003991792.b3lyp_6-31g(d).inp

003991792.b3lyp_6-31g(d).qchem.inp (generated)

003991792.b3lyp_6-31g(d).gjf (generated)

003991792.b3lyp_6-31g(d).firefly.inp (generated)

003991792.b3lyp_6-31g(d).smash.inp (generated)

003991792.b3lyp_6-31g(d).nwchem.inp (generated) 003991792.b3lyp_6-31g(d).log.xz 003991792.td-b3lyp_6-31g+(d).inp 003991792.td-b3lyp_6-31g+(d).log.xz

003991792.td-b3lyp_6-31+g(d).qchem.inp (generated)

003991792.td-b3lyp_6-31+g(d).gjf (generated)

003991792.td-b3lyp_6-31+g(d).firefly.inp (generated)

003991792.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003991792.mol 003991792.PUBCHEM 003991792.mol (via Jmol)
003992120.b3lyp_6-31g(d).inp

003992120.b3lyp_6-31g(d).qchem.inp (generated)

003992120.b3lyp_6-31g(d).gjf (generated)

003992120.b3lyp_6-31g(d).firefly.inp (generated)

003992120.b3lyp_6-31g(d).smash.inp (generated)

003992120.b3lyp_6-31g(d).nwchem.inp (generated) 003992120.b3lyp_6-31g(d).log.xz 003992120.td-b3lyp_6-31g+(d).inp 003992120.td-b3lyp_6-31g+(d).log.xz

003992120.td-b3lyp_6-31+g(d).qchem.inp (generated)

003992120.td-b3lyp_6-31+g(d).gjf (generated)

003992120.td-b3lyp_6-31+g(d).firefly.inp (generated)

003992120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003992120.mol 003992120.PUBCHEM 003992120.mol (via Jmol)
003992546.b3lyp_6-31g(d).inp

003992546.b3lyp_6-31g(d).qchem.inp (generated)

003992546.b3lyp_6-31g(d).gjf (generated)

003992546.b3lyp_6-31g(d).firefly.inp (generated)

003992546.b3lyp_6-31g(d).smash.inp (generated)

003992546.b3lyp_6-31g(d).nwchem.inp (generated) 003992546.b3lyp_6-31g(d).log.xz 003992546.td-b3lyp_6-31g+(d).inp 003992546.td-b3lyp_6-31g+(d).log.xz

003992546.td-b3lyp_6-31+g(d).qchem.inp (generated)

003992546.td-b3lyp_6-31+g(d).gjf (generated)

003992546.td-b3lyp_6-31+g(d).firefly.inp (generated)

003992546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003992546.mol 003992546.PUBCHEM 003992546.mol (via Jmol)
003992586.b3lyp_6-31g(d).inp

003992586.b3lyp_6-31g(d).qchem.inp (generated)

003992586.b3lyp_6-31g(d).gjf (generated)

003992586.b3lyp_6-31g(d).firefly.inp (generated)

003992586.b3lyp_6-31g(d).smash.inp (generated)

003992586.b3lyp_6-31g(d).nwchem.inp (generated) 003992586.b3lyp_6-31g(d).log.xz 003992586.td-b3lyp_6-31g+(d).inp 003992586.td-b3lyp_6-31g+(d).log.xz

003992586.td-b3lyp_6-31+g(d).qchem.inp (generated)

003992586.td-b3lyp_6-31+g(d).gjf (generated)

003992586.td-b3lyp_6-31+g(d).firefly.inp (generated)

003992586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003992586.mol 003992586.PUBCHEM 003992586.mol (via Jmol)
003992659.b3lyp_6-31g(d).inp

003992659.b3lyp_6-31g(d).qchem.inp (generated)

003992659.b3lyp_6-31g(d).gjf (generated)

003992659.b3lyp_6-31g(d).firefly.inp (generated)

003992659.b3lyp_6-31g(d).smash.inp (generated)

003992659.b3lyp_6-31g(d).nwchem.inp (generated) 003992659.b3lyp_6-31g(d).log.xz 003992659.td-b3lyp_6-31g+(d).inp 003992659.td-b3lyp_6-31g+(d).log.xz

003992659.td-b3lyp_6-31+g(d).qchem.inp (generated)

003992659.td-b3lyp_6-31+g(d).gjf (generated)

003992659.td-b3lyp_6-31+g(d).firefly.inp (generated)

003992659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003992659.mol 003992659.PUBCHEM 003992659.mol (via Jmol)
003992724.b3lyp_6-31g(d).inp

003992724.b3lyp_6-31g(d).qchem.inp (generated)

003992724.b3lyp_6-31g(d).gjf (generated)

003992724.b3lyp_6-31g(d).firefly.inp (generated)

003992724.b3lyp_6-31g(d).smash.inp (generated)

003992724.b3lyp_6-31g(d).nwchem.inp (generated) 003992724.b3lyp_6-31g(d).log.xz 003992724.td-b3lyp_6-31g+(d).inp 003992724.td-b3lyp_6-31g+(d).log.xz

003992724.td-b3lyp_6-31+g(d).qchem.inp (generated)

003992724.td-b3lyp_6-31+g(d).gjf (generated)

003992724.td-b3lyp_6-31+g(d).firefly.inp (generated)

003992724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003992724.mol 003992724.PUBCHEM 003992724.mol (via Jmol)
003992948.b3lyp_6-31g(d).inp

003992948.b3lyp_6-31g(d).qchem.inp (generated)

003992948.b3lyp_6-31g(d).gjf (generated)

003992948.b3lyp_6-31g(d).firefly.inp (generated)

003992948.b3lyp_6-31g(d).smash.inp (generated)

003992948.b3lyp_6-31g(d).nwchem.inp (generated) 003992948.b3lyp_6-31g(d).log.xz 003992948.td-b3lyp_6-31g+(d).inp 003992948.td-b3lyp_6-31g+(d).log.xz

003992948.td-b3lyp_6-31+g(d).qchem.inp (generated)

003992948.td-b3lyp_6-31+g(d).gjf (generated)

003992948.td-b3lyp_6-31+g(d).firefly.inp (generated)

003992948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003992948.mol 003992948.PUBCHEM 003992948.mol (via Jmol)
003993023.b3lyp_6-31g(d).inp

003993023.b3lyp_6-31g(d).qchem.inp (generated)

003993023.b3lyp_6-31g(d).gjf (generated)

003993023.b3lyp_6-31g(d).firefly.inp (generated)

003993023.b3lyp_6-31g(d).smash.inp (generated)

003993023.b3lyp_6-31g(d).nwchem.inp (generated) 003993023.b3lyp_6-31g(d).log.xz 003993023.td-b3lyp_6-31g+(d).inp 003993023.td-b3lyp_6-31g+(d).log.xz

003993023.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993023.td-b3lyp_6-31+g(d).gjf (generated)

003993023.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993023.mol 003993023.PUBCHEM 003993023.mol (via Jmol)
003993025.b3lyp_6-31g(d).inp

003993025.b3lyp_6-31g(d).qchem.inp (generated)

003993025.b3lyp_6-31g(d).gjf (generated)

003993025.b3lyp_6-31g(d).firefly.inp (generated)

003993025.b3lyp_6-31g(d).smash.inp (generated)

003993025.b3lyp_6-31g(d).nwchem.inp (generated) 003993025.b3lyp_6-31g(d).log.xz 003993025.mol 003993025.PUBCHEM 003993025.mol (via Jmol)
003993125.b3lyp_6-31g(d).inp

003993125.b3lyp_6-31g(d).qchem.inp (generated)

003993125.b3lyp_6-31g(d).gjf (generated)

003993125.b3lyp_6-31g(d).firefly.inp (generated)

003993125.b3lyp_6-31g(d).smash.inp (generated)

003993125.b3lyp_6-31g(d).nwchem.inp (generated) 003993125.b3lyp_6-31g(d).log.xz 003993125.td-b3lyp_6-31g+(d).inp 003993125.td-b3lyp_6-31g+(d).log.xz

003993125.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993125.td-b3lyp_6-31+g(d).gjf (generated)

003993125.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993125.mol 003993125.PUBCHEM 003993125.mol (via Jmol)
003993126.b3lyp_6-31g(d).inp

003993126.b3lyp_6-31g(d).qchem.inp (generated)

003993126.b3lyp_6-31g(d).gjf (generated)

003993126.b3lyp_6-31g(d).firefly.inp (generated)

003993126.b3lyp_6-31g(d).smash.inp (generated)

003993126.b3lyp_6-31g(d).nwchem.inp (generated) 003993126.b3lyp_6-31g(d).log.xz 003993126.mol 003993126.PUBCHEM 003993126.mol (via Jmol)
003993127.b3lyp_6-31g(d).inp

003993127.b3lyp_6-31g(d).qchem.inp (generated)

003993127.b3lyp_6-31g(d).gjf (generated)

003993127.b3lyp_6-31g(d).firefly.inp (generated)

003993127.b3lyp_6-31g(d).smash.inp (generated)

003993127.b3lyp_6-31g(d).nwchem.inp (generated) 003993127.b3lyp_6-31g(d).log.xz 003993127.td-b3lyp_6-31g+(d).inp 003993127.td-b3lyp_6-31g+(d).log.xz

003993127.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993127.td-b3lyp_6-31+g(d).gjf (generated)

003993127.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993127.mol 003993127.PUBCHEM 003993127.mol (via Jmol)
003993189.b3lyp_6-31g(d).inp

003993189.b3lyp_6-31g(d).qchem.inp (generated)

003993189.b3lyp_6-31g(d).gjf (generated)

003993189.b3lyp_6-31g(d).firefly.inp (generated)

003993189.b3lyp_6-31g(d).smash.inp (generated)

003993189.b3lyp_6-31g(d).nwchem.inp (generated) 003993189.b3lyp_6-31g(d).log.xz 003993189.td-b3lyp_6-31g+(d).inp 003993189.td-b3lyp_6-31g+(d).log.xz

003993189.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993189.td-b3lyp_6-31+g(d).gjf (generated)

003993189.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993189.mol 003993189.PUBCHEM 003993189.mol (via Jmol)
003993221.b3lyp_6-31g(d).inp

003993221.b3lyp_6-31g(d).qchem.inp (generated)

003993221.b3lyp_6-31g(d).gjf (generated)

003993221.b3lyp_6-31g(d).firefly.inp (generated)

003993221.b3lyp_6-31g(d).smash.inp (generated)

003993221.b3lyp_6-31g(d).nwchem.inp (generated) 003993221.b3lyp_6-31g(d).log.xz 003993221.td-b3lyp_6-31g+(d).inp 003993221.td-b3lyp_6-31g+(d).log.xz

003993221.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993221.td-b3lyp_6-31+g(d).gjf (generated)

003993221.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993221.mol 003993221.PUBCHEM 003993221.mol (via Jmol)
003993314.b3lyp_6-31g(d).inp

003993314.b3lyp_6-31g(d).qchem.inp (generated)

003993314.b3lyp_6-31g(d).gjf (generated)

003993314.b3lyp_6-31g(d).firefly.inp (generated)

003993314.b3lyp_6-31g(d).smash.inp (generated)

003993314.b3lyp_6-31g(d).nwchem.inp (generated) 003993314.b3lyp_6-31g(d).log.xz 003993314.td-b3lyp_6-31g+(d).inp 003993314.td-b3lyp_6-31g+(d).log.xz

003993314.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993314.td-b3lyp_6-31+g(d).gjf (generated)

003993314.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993314.mol 003993314.PUBCHEM 003993314.mol (via Jmol)
003993341.b3lyp_6-31g(d).inp

003993341.b3lyp_6-31g(d).qchem.inp (generated)

003993341.b3lyp_6-31g(d).gjf (generated)

003993341.b3lyp_6-31g(d).firefly.inp (generated)

003993341.b3lyp_6-31g(d).smash.inp (generated)

003993341.b3lyp_6-31g(d).nwchem.inp (generated) 003993341.b3lyp_6-31g(d).log.xz 003993341.td-b3lyp_6-31g+(d).inp 003993341.td-b3lyp_6-31g+(d).log.xz

003993341.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993341.td-b3lyp_6-31+g(d).gjf (generated)

003993341.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993341.mol 003993341.PUBCHEM 003993341.mol (via Jmol)
003993383.b3lyp_6-31g(d).inp

003993383.b3lyp_6-31g(d).qchem.inp (generated)

003993383.b3lyp_6-31g(d).gjf (generated)

003993383.b3lyp_6-31g(d).firefly.inp (generated)

003993383.b3lyp_6-31g(d).smash.inp (generated)

003993383.b3lyp_6-31g(d).nwchem.inp (generated) 003993383.b3lyp_6-31g(d).log.xz 003993383.mol 003993383.PUBCHEM 003993383.mol (via Jmol)
003993393.b3lyp_6-31g(d).inp

003993393.b3lyp_6-31g(d).qchem.inp (generated)

003993393.b3lyp_6-31g(d).gjf (generated)

003993393.b3lyp_6-31g(d).firefly.inp (generated)

003993393.b3lyp_6-31g(d).smash.inp (generated)

003993393.b3lyp_6-31g(d).nwchem.inp (generated) 003993393.b3lyp_6-31g(d).log.xz 003993393.td-b3lyp_6-31g+(d).inp 003993393.td-b3lyp_6-31g+(d).log.xz

003993393.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993393.td-b3lyp_6-31+g(d).gjf (generated)

003993393.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993393.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993393.mol 003993393.PUBCHEM 003993393.mol (via Jmol)
003993435.b3lyp_6-31g(d).inp

003993435.b3lyp_6-31g(d).qchem.inp (generated)

003993435.b3lyp_6-31g(d).gjf (generated)

003993435.b3lyp_6-31g(d).firefly.inp (generated)

003993435.b3lyp_6-31g(d).smash.inp (generated)

003993435.b3lyp_6-31g(d).nwchem.inp (generated) 003993435.b3lyp_6-31g(d).log.xz 003993435.td-b3lyp_6-31g+(d).inp 003993435.td-b3lyp_6-31g+(d).log.xz

003993435.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993435.td-b3lyp_6-31+g(d).gjf (generated)

003993435.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993435.mol 003993435.PUBCHEM 003993435.mol (via Jmol)
003993594.b3lyp_6-31g(d).inp

003993594.b3lyp_6-31g(d).qchem.inp (generated)

003993594.b3lyp_6-31g(d).gjf (generated)

003993594.b3lyp_6-31g(d).firefly.inp (generated)

003993594.b3lyp_6-31g(d).smash.inp (generated)

003993594.b3lyp_6-31g(d).nwchem.inp (generated) 003993594.b3lyp_6-31g(d).log.xz 003993594.td-b3lyp_6-31g+(d).inp 003993594.td-b3lyp_6-31g+(d).log.xz

003993594.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993594.td-b3lyp_6-31+g(d).gjf (generated)

003993594.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993594.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993594.mol 003993594.PUBCHEM 003993594.mol (via Jmol)
003993781.b3lyp_6-31g(d).inp

003993781.b3lyp_6-31g(d).qchem.inp (generated)

003993781.b3lyp_6-31g(d).gjf (generated)

003993781.b3lyp_6-31g(d).firefly.inp (generated)

003993781.b3lyp_6-31g(d).smash.inp (generated)

003993781.b3lyp_6-31g(d).nwchem.inp (generated) 003993781.b3lyp_6-31g(d).log.xz 003993781.td-b3lyp_6-31g+(d).inp 003993781.td-b3lyp_6-31g+(d).log.xz

003993781.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993781.td-b3lyp_6-31+g(d).gjf (generated)

003993781.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993781.mol 003993781.PUBCHEM 003993781.mol (via Jmol)
003993850.b3lyp_6-31g(d).inp

003993850.b3lyp_6-31g(d).qchem.inp (generated)

003993850.b3lyp_6-31g(d).gjf (generated)

003993850.b3lyp_6-31g(d).firefly.inp (generated)

003993850.b3lyp_6-31g(d).smash.inp (generated)

003993850.b3lyp_6-31g(d).nwchem.inp (generated) 003993850.b3lyp_6-31g(d).log.xz 003993850.td-b3lyp_6-31g+(d).inp 003993850.td-b3lyp_6-31g+(d).log.xz

003993850.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993850.td-b3lyp_6-31+g(d).gjf (generated)

003993850.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993850.mol 003993850.PUBCHEM 003993850.mol (via Jmol)
003993936.b3lyp_6-31g(d).inp

003993936.b3lyp_6-31g(d).qchem.inp (generated)

003993936.b3lyp_6-31g(d).gjf (generated)

003993936.b3lyp_6-31g(d).firefly.inp (generated)

003993936.b3lyp_6-31g(d).smash.inp (generated)

003993936.b3lyp_6-31g(d).nwchem.inp (generated) 003993936.b3lyp_6-31g(d).log.xz 003993936.mol 003993936.PUBCHEM 003993936.mol (via Jmol)
003993961.b3lyp_6-31g(d).inp

003993961.b3lyp_6-31g(d).qchem.inp (generated)

003993961.b3lyp_6-31g(d).gjf (generated)

003993961.b3lyp_6-31g(d).firefly.inp (generated)

003993961.b3lyp_6-31g(d).smash.inp (generated)

003993961.b3lyp_6-31g(d).nwchem.inp (generated) 003993961.b3lyp_6-31g(d).log.xz 003993961.td-b3lyp_6-31g+(d).inp 003993961.td-b3lyp_6-31g+(d).log.xz

003993961.td-b3lyp_6-31+g(d).qchem.inp (generated)

003993961.td-b3lyp_6-31+g(d).gjf (generated)

003993961.td-b3lyp_6-31+g(d).firefly.inp (generated)

003993961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003993961.mol 003993961.PUBCHEM 003993961.mol (via Jmol)
003994026.b3lyp_6-31g(d).inp

003994026.b3lyp_6-31g(d).qchem.inp (generated)

003994026.b3lyp_6-31g(d).gjf (generated)

003994026.b3lyp_6-31g(d).firefly.inp (generated)

003994026.b3lyp_6-31g(d).smash.inp (generated)

003994026.b3lyp_6-31g(d).nwchem.inp (generated) 003994026.b3lyp_6-31g(d).log.xz 003994026.td-b3lyp_6-31g+(d).inp 003994026.td-b3lyp_6-31g+(d).log.xz

003994026.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994026.td-b3lyp_6-31+g(d).gjf (generated)

003994026.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994026.mol 003994026.PUBCHEM 003994026.mol (via Jmol)
003994037.b3lyp_6-31g(d).inp

003994037.b3lyp_6-31g(d).qchem.inp (generated)

003994037.b3lyp_6-31g(d).gjf (generated)

003994037.b3lyp_6-31g(d).firefly.inp (generated)

003994037.b3lyp_6-31g(d).smash.inp (generated)

003994037.b3lyp_6-31g(d).nwchem.inp (generated) 003994037.b3lyp_6-31g(d).log.xz 003994037.td-b3lyp_6-31g+(d).inp 003994037.td-b3lyp_6-31g+(d).log.xz

003994037.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994037.td-b3lyp_6-31+g(d).gjf (generated)

003994037.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994037.mol 003994037.PUBCHEM 003994037.mol (via Jmol)
003994123.b3lyp_6-31g(d).inp

003994123.b3lyp_6-31g(d).qchem.inp (generated)

003994123.b3lyp_6-31g(d).gjf (generated)

003994123.b3lyp_6-31g(d).firefly.inp (generated)

003994123.b3lyp_6-31g(d).smash.inp (generated)

003994123.b3lyp_6-31g(d).nwchem.inp (generated) 003994123.b3lyp_6-31g(d).log.xz 003994123.td-b3lyp_6-31g+(d).inp 003994123.td-b3lyp_6-31g+(d).log.xz

003994123.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994123.td-b3lyp_6-31+g(d).gjf (generated)

003994123.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994123.mol 003994123.PUBCHEM 003994123.mol (via Jmol)
003994183.b3lyp_6-31g(d).inp

003994183.b3lyp_6-31g(d).qchem.inp (generated)

003994183.b3lyp_6-31g(d).gjf (generated)

003994183.b3lyp_6-31g(d).firefly.inp (generated)

003994183.b3lyp_6-31g(d).smash.inp (generated)

003994183.b3lyp_6-31g(d).nwchem.inp (generated) 003994183.b3lyp_6-31g(d).log.xz 003994183.td-b3lyp_6-31g+(d).inp 003994183.td-b3lyp_6-31g+(d).log.xz

003994183.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994183.td-b3lyp_6-31+g(d).gjf (generated)

003994183.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994183.mol 003994183.PUBCHEM 003994183.mol (via Jmol)
003994281.b3lyp_6-31g(d).inp

003994281.b3lyp_6-31g(d).qchem.inp (generated)

003994281.b3lyp_6-31g(d).gjf (generated)

003994281.b3lyp_6-31g(d).firefly.inp (generated)

003994281.b3lyp_6-31g(d).smash.inp (generated)

003994281.b3lyp_6-31g(d).nwchem.inp (generated) 003994281.b3lyp_6-31g(d).log.xz 003994281.td-b3lyp_6-31g+(d).inp 003994281.td-b3lyp_6-31g+(d).log.xz

003994281.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994281.td-b3lyp_6-31+g(d).gjf (generated)

003994281.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994281.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994281.mol 003994281.PUBCHEM 003994281.mol (via Jmol)
003994297.b3lyp_6-31g(d).inp

003994297.b3lyp_6-31g(d).qchem.inp (generated)

003994297.b3lyp_6-31g(d).gjf (generated)

003994297.b3lyp_6-31g(d).firefly.inp (generated)

003994297.b3lyp_6-31g(d).smash.inp (generated)

003994297.b3lyp_6-31g(d).nwchem.inp (generated) 003994297.b3lyp_6-31g(d).log.xz 003994297.td-b3lyp_6-31g+(d).inp 003994297.td-b3lyp_6-31g+(d).log.xz

003994297.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994297.td-b3lyp_6-31+g(d).gjf (generated)

003994297.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994297.mol 003994297.PUBCHEM 003994297.mol (via Jmol)
003994337.b3lyp_6-31g(d).inp

003994337.b3lyp_6-31g(d).qchem.inp (generated)

003994337.b3lyp_6-31g(d).gjf (generated)

003994337.b3lyp_6-31g(d).firefly.inp (generated)

003994337.b3lyp_6-31g(d).smash.inp (generated)

003994337.b3lyp_6-31g(d).nwchem.inp (generated) 003994337.b3lyp_6-31g(d).log.xz 003994337.mol 003994337.PUBCHEM 003994337.mol (via Jmol)
003994380.b3lyp_6-31g(d).inp

003994380.b3lyp_6-31g(d).qchem.inp (generated)

003994380.b3lyp_6-31g(d).gjf (generated)

003994380.b3lyp_6-31g(d).firefly.inp (generated)

003994380.b3lyp_6-31g(d).smash.inp (generated)

003994380.b3lyp_6-31g(d).nwchem.inp (generated) 003994380.b3lyp_6-31g(d).log.xz 003994380.td-b3lyp_6-31g+(d).inp 003994380.td-b3lyp_6-31g+(d).log.xz

003994380.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994380.td-b3lyp_6-31+g(d).gjf (generated)

003994380.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994380.mol 003994380.PUBCHEM 003994380.mol (via Jmol)
003994418.b3lyp_6-31g(d).inp

003994418.b3lyp_6-31g(d).qchem.inp (generated)

003994418.b3lyp_6-31g(d).gjf (generated)

003994418.b3lyp_6-31g(d).firefly.inp (generated)

003994418.b3lyp_6-31g(d).smash.inp (generated)

003994418.b3lyp_6-31g(d).nwchem.inp (generated) 003994418.b3lyp_6-31g(d).log.xz 003994418.td-b3lyp_6-31g+(d).inp 003994418.td-b3lyp_6-31g+(d).log.xz

003994418.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994418.td-b3lyp_6-31+g(d).gjf (generated)

003994418.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994418.mol 003994418.PUBCHEM 003994418.mol (via Jmol)
003994531.b3lyp_6-31g(d).inp

003994531.b3lyp_6-31g(d).qchem.inp (generated)

003994531.b3lyp_6-31g(d).gjf (generated)

003994531.b3lyp_6-31g(d).firefly.inp (generated)

003994531.b3lyp_6-31g(d).smash.inp (generated)

003994531.b3lyp_6-31g(d).nwchem.inp (generated) 003994531.b3lyp_6-31g(d).log.xz 003994531.td-b3lyp_6-31g+(d).inp 003994531.td-b3lyp_6-31g+(d).log.xz

003994531.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994531.td-b3lyp_6-31+g(d).gjf (generated)

003994531.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994531.mol 003994531.PUBCHEM 003994531.mol (via Jmol)
003994808.b3lyp_6-31g(d).inp

003994808.b3lyp_6-31g(d).qchem.inp (generated)

003994808.b3lyp_6-31g(d).gjf (generated)

003994808.b3lyp_6-31g(d).firefly.inp (generated)

003994808.b3lyp_6-31g(d).smash.inp (generated)

003994808.b3lyp_6-31g(d).nwchem.inp (generated) 003994808.b3lyp_6-31g(d).log.xz 003994808.td-b3lyp_6-31g+(d).inp 003994808.td-b3lyp_6-31g+(d).log.xz

003994808.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994808.td-b3lyp_6-31+g(d).gjf (generated)

003994808.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994808.mol 003994808.PUBCHEM 003994808.mol (via Jmol)
003994892.b3lyp_6-31g(d).inp

003994892.b3lyp_6-31g(d).qchem.inp (generated)

003994892.b3lyp_6-31g(d).gjf (generated)

003994892.b3lyp_6-31g(d).firefly.inp (generated)

003994892.b3lyp_6-31g(d).smash.inp (generated)

003994892.b3lyp_6-31g(d).nwchem.inp (generated) 003994892.b3lyp_6-31g(d).log.xz 003994892.td-b3lyp_6-31g+(d).inp 003994892.td-b3lyp_6-31g+(d).log.xz

003994892.td-b3lyp_6-31+g(d).qchem.inp (generated)

003994892.td-b3lyp_6-31+g(d).gjf (generated)

003994892.td-b3lyp_6-31+g(d).firefly.inp (generated)

003994892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003994892.mol 003994892.PUBCHEM 003994892.mol (via Jmol)
003995100.b3lyp_6-31g(d).inp

003995100.b3lyp_6-31g(d).qchem.inp (generated)

003995100.b3lyp_6-31g(d).gjf (generated)

003995100.b3lyp_6-31g(d).firefly.inp (generated)

003995100.b3lyp_6-31g(d).smash.inp (generated)

003995100.b3lyp_6-31g(d).nwchem.inp (generated) 003995100.b3lyp_6-31g(d).log.xz 003995100.td-b3lyp_6-31g+(d).inp 003995100.td-b3lyp_6-31g+(d).log.xz

003995100.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995100.td-b3lyp_6-31+g(d).gjf (generated)

003995100.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995100.mol 003995100.PUBCHEM 003995100.mol (via Jmol)
003995143.b3lyp_6-31g(d).inp

003995143.b3lyp_6-31g(d).qchem.inp (generated)

003995143.b3lyp_6-31g(d).gjf (generated)

003995143.b3lyp_6-31g(d).firefly.inp (generated)

003995143.b3lyp_6-31g(d).smash.inp (generated)

003995143.b3lyp_6-31g(d).nwchem.inp (generated) 003995143.b3lyp_6-31g(d).log.xz 003995143.td-b3lyp_6-31g+(d).inp 003995143.td-b3lyp_6-31g+(d).log.xz

003995143.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995143.td-b3lyp_6-31+g(d).gjf (generated)

003995143.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995143.mol 003995143.PUBCHEM 003995143.mol (via Jmol)
003995324.b3lyp_6-31g(d).inp

003995324.b3lyp_6-31g(d).qchem.inp (generated)

003995324.b3lyp_6-31g(d).gjf (generated)

003995324.b3lyp_6-31g(d).firefly.inp (generated)

003995324.b3lyp_6-31g(d).smash.inp (generated)

003995324.b3lyp_6-31g(d).nwchem.inp (generated) 003995324.b3lyp_6-31g(d).log.xz 003995324.td-b3lyp_6-31g+(d).inp 003995324.td-b3lyp_6-31g+(d).log.xz

003995324.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995324.td-b3lyp_6-31+g(d).gjf (generated)

003995324.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995324.mol 003995324.PUBCHEM 003995324.mol (via Jmol)
003995326.b3lyp_6-31g(d).inp

003995326.b3lyp_6-31g(d).qchem.inp (generated)

003995326.b3lyp_6-31g(d).gjf (generated)

003995326.b3lyp_6-31g(d).firefly.inp (generated)

003995326.b3lyp_6-31g(d).smash.inp (generated)

003995326.b3lyp_6-31g(d).nwchem.inp (generated) 003995326.b3lyp_6-31g(d).log.xz 003995326.td-b3lyp_6-31g+(d).inp 003995326.td-b3lyp_6-31g+(d).log.xz

003995326.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995326.td-b3lyp_6-31+g(d).gjf (generated)

003995326.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995326.mol 003995326.PUBCHEM 003995326.mol (via Jmol)
003995427.b3lyp_6-31g(d).inp

003995427.b3lyp_6-31g(d).qchem.inp (generated)

003995427.b3lyp_6-31g(d).gjf (generated)

003995427.b3lyp_6-31g(d).firefly.inp (generated)

003995427.b3lyp_6-31g(d).smash.inp (generated)

003995427.b3lyp_6-31g(d).nwchem.inp (generated) 003995427.b3lyp_6-31g(d).log.xz 003995427.td-b3lyp_6-31g+(d).inp 003995427.td-b3lyp_6-31g+(d).log.xz

003995427.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995427.td-b3lyp_6-31+g(d).gjf (generated)

003995427.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995427.mol 003995427.PUBCHEM 003995427.mol (via Jmol)
003995430.b3lyp_6-31g(d).inp

003995430.b3lyp_6-31g(d).qchem.inp (generated)

003995430.b3lyp_6-31g(d).gjf (generated)

003995430.b3lyp_6-31g(d).firefly.inp (generated)

003995430.b3lyp_6-31g(d).smash.inp (generated)

003995430.b3lyp_6-31g(d).nwchem.inp (generated) 003995430.b3lyp_6-31g(d).log.xz 003995430.td-b3lyp_6-31g+(d).inp 003995430.td-b3lyp_6-31g+(d).log.xz

003995430.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995430.td-b3lyp_6-31+g(d).gjf (generated)

003995430.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995430.mol 003995430.PUBCHEM 003995430.mol (via Jmol)
003995440.b3lyp_6-31g(d).inp

003995440.b3lyp_6-31g(d).qchem.inp (generated)

003995440.b3lyp_6-31g(d).gjf (generated)

003995440.b3lyp_6-31g(d).firefly.inp (generated)

003995440.b3lyp_6-31g(d).smash.inp (generated)

003995440.b3lyp_6-31g(d).nwchem.inp (generated) 003995440.b3lyp_6-31g(d).log.xz 003995440.td-b3lyp_6-31g+(d).inp 003995440.td-b3lyp_6-31g+(d).log.xz

003995440.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995440.td-b3lyp_6-31+g(d).gjf (generated)

003995440.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995440.mol 003995440.PUBCHEM 003995440.mol (via Jmol)
003995453.b3lyp_6-31g(d).inp

003995453.b3lyp_6-31g(d).qchem.inp (generated)

003995453.b3lyp_6-31g(d).gjf (generated)

003995453.b3lyp_6-31g(d).firefly.inp (generated)

003995453.b3lyp_6-31g(d).smash.inp (generated)

003995453.b3lyp_6-31g(d).nwchem.inp (generated) 003995453.b3lyp_6-31g(d).log.xz 003995453.mol 003995453.PUBCHEM 003995453.mol (via Jmol)
003995459.b3lyp_6-31g(d).inp

003995459.b3lyp_6-31g(d).qchem.inp (generated)

003995459.b3lyp_6-31g(d).gjf (generated)

003995459.b3lyp_6-31g(d).firefly.inp (generated)

003995459.b3lyp_6-31g(d).smash.inp (generated)

003995459.b3lyp_6-31g(d).nwchem.inp (generated) 003995459.b3lyp_6-31g(d).log.xz 003995459.td-b3lyp_6-31g+(d).inp 003995459.td-b3lyp_6-31g+(d).log.xz

003995459.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995459.td-b3lyp_6-31+g(d).gjf (generated)

003995459.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995459.mol 003995459.PUBCHEM 003995459.mol (via Jmol)
003995471.b3lyp_6-31g(d).inp

003995471.b3lyp_6-31g(d).qchem.inp (generated)

003995471.b3lyp_6-31g(d).gjf (generated)

003995471.b3lyp_6-31g(d).firefly.inp (generated)

003995471.b3lyp_6-31g(d).smash.inp (generated)

003995471.b3lyp_6-31g(d).nwchem.inp (generated) 003995471.b3lyp_6-31g(d).log.xz 003995471.td-b3lyp_6-31g+(d).inp 003995471.td-b3lyp_6-31g+(d).log.xz

003995471.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995471.td-b3lyp_6-31+g(d).gjf (generated)

003995471.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995471.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995471.mol 003995471.PUBCHEM 003995471.mol (via Jmol)
003995600.b3lyp_6-31g(d).inp

003995600.b3lyp_6-31g(d).qchem.inp (generated)

003995600.b3lyp_6-31g(d).gjf (generated)

003995600.b3lyp_6-31g(d).firefly.inp (generated)

003995600.b3lyp_6-31g(d).smash.inp (generated)

003995600.b3lyp_6-31g(d).nwchem.inp (generated) 003995600.b3lyp_6-31g(d).log.xz 003995600.mol 003995600.PUBCHEM 003995600.mol (via Jmol)
003995706.b3lyp_6-31g(d).inp

003995706.b3lyp_6-31g(d).qchem.inp (generated)

003995706.b3lyp_6-31g(d).gjf (generated)

003995706.b3lyp_6-31g(d).firefly.inp (generated)

003995706.b3lyp_6-31g(d).smash.inp (generated)

003995706.b3lyp_6-31g(d).nwchem.inp (generated) 003995706.b3lyp_6-31g(d).log.xz 003995706.td-b3lyp_6-31g+(d).inp 003995706.td-b3lyp_6-31g+(d).log.xz

003995706.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995706.td-b3lyp_6-31+g(d).gjf (generated)

003995706.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995706.mol 003995706.PUBCHEM 003995706.mol (via Jmol)
003995891.b3lyp_6-31g(d).inp

003995891.b3lyp_6-31g(d).qchem.inp (generated)

003995891.b3lyp_6-31g(d).gjf (generated)

003995891.b3lyp_6-31g(d).firefly.inp (generated)

003995891.b3lyp_6-31g(d).smash.inp (generated)

003995891.b3lyp_6-31g(d).nwchem.inp (generated) 003995891.b3lyp_6-31g(d).log.xz 003995891.mol 003995891.PUBCHEM 003995891.mol (via Jmol)
003995899.b3lyp_6-31g(d).inp

003995899.b3lyp_6-31g(d).qchem.inp (generated)

003995899.b3lyp_6-31g(d).gjf (generated)

003995899.b3lyp_6-31g(d).firefly.inp (generated)

003995899.b3lyp_6-31g(d).smash.inp (generated)

003995899.b3lyp_6-31g(d).nwchem.inp (generated) 003995899.b3lyp_6-31g(d).log.xz 003995899.td-b3lyp_6-31g+(d).inp 003995899.td-b3lyp_6-31g+(d).log.xz

003995899.td-b3lyp_6-31+g(d).qchem.inp (generated)

003995899.td-b3lyp_6-31+g(d).gjf (generated)

003995899.td-b3lyp_6-31+g(d).firefly.inp (generated)

003995899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003995899.mol 003995899.PUBCHEM 003995899.mol (via Jmol)
003996007.b3lyp_6-31g(d).inp

003996007.b3lyp_6-31g(d).qchem.inp (generated)

003996007.b3lyp_6-31g(d).gjf (generated)

003996007.b3lyp_6-31g(d).firefly.inp (generated)

003996007.b3lyp_6-31g(d).smash.inp (generated)

003996007.b3lyp_6-31g(d).nwchem.inp (generated) 003996007.b3lyp_6-31g(d).log.xz 003996007.td-b3lyp_6-31g+(d).inp 003996007.td-b3lyp_6-31g+(d).log.xz

003996007.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996007.td-b3lyp_6-31+g(d).gjf (generated)

003996007.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996007.mol 003996007.PUBCHEM 003996007.mol (via Jmol)
003996042.b3lyp_6-31g(d).inp

003996042.b3lyp_6-31g(d).qchem.inp (generated)

003996042.b3lyp_6-31g(d).gjf (generated)

003996042.b3lyp_6-31g(d).firefly.inp (generated)

003996042.b3lyp_6-31g(d).smash.inp (generated)

003996042.b3lyp_6-31g(d).nwchem.inp (generated) 003996042.b3lyp_6-31g(d).log.xz 003996042.td-b3lyp_6-31g+(d).inp 003996042.td-b3lyp_6-31g+(d).log.xz

003996042.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996042.td-b3lyp_6-31+g(d).gjf (generated)

003996042.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996042.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996042.mol 003996042.PUBCHEM 003996042.mol (via Jmol)
003996117.b3lyp_6-31g(d).inp

003996117.b3lyp_6-31g(d).qchem.inp (generated)

003996117.b3lyp_6-31g(d).gjf (generated)

003996117.b3lyp_6-31g(d).firefly.inp (generated)

003996117.b3lyp_6-31g(d).smash.inp (generated)

003996117.b3lyp_6-31g(d).nwchem.inp (generated) 003996117.b3lyp_6-31g(d).log.xz 003996117.td-b3lyp_6-31g+(d).inp 003996117.td-b3lyp_6-31g+(d).log.xz

003996117.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996117.td-b3lyp_6-31+g(d).gjf (generated)

003996117.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996117.mol 003996117.PUBCHEM 003996117.mol (via Jmol)
003996118.b3lyp_6-31g(d).inp

003996118.b3lyp_6-31g(d).qchem.inp (generated)

003996118.b3lyp_6-31g(d).gjf (generated)

003996118.b3lyp_6-31g(d).firefly.inp (generated)

003996118.b3lyp_6-31g(d).smash.inp (generated)

003996118.b3lyp_6-31g(d).nwchem.inp (generated) 003996118.b3lyp_6-31g(d).log.xz 003996118.td-b3lyp_6-31g+(d).inp 003996118.td-b3lyp_6-31g+(d).log.xz

003996118.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996118.td-b3lyp_6-31+g(d).gjf (generated)

003996118.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996118.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996118.mol 003996118.PUBCHEM 003996118.mol (via Jmol)
003996119.b3lyp_6-31g(d).inp

003996119.b3lyp_6-31g(d).qchem.inp (generated)

003996119.b3lyp_6-31g(d).gjf (generated)

003996119.b3lyp_6-31g(d).firefly.inp (generated)

003996119.b3lyp_6-31g(d).smash.inp (generated)

003996119.b3lyp_6-31g(d).nwchem.inp (generated) 003996119.b3lyp_6-31g(d).log.xz 003996119.mol 003996119.PUBCHEM 003996119.mol (via Jmol)
003996242.b3lyp_6-31g(d).inp

003996242.b3lyp_6-31g(d).qchem.inp (generated)

003996242.b3lyp_6-31g(d).gjf (generated)

003996242.b3lyp_6-31g(d).firefly.inp (generated)

003996242.b3lyp_6-31g(d).smash.inp (generated)

003996242.b3lyp_6-31g(d).nwchem.inp (generated) 003996242.b3lyp_6-31g(d).log.xz 003996242.td-b3lyp_6-31g+(d).inp 003996242.td-b3lyp_6-31g+(d).log.xz

003996242.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996242.td-b3lyp_6-31+g(d).gjf (generated)

003996242.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996242.mol 003996242.PUBCHEM 003996242.mol (via Jmol)
003996355.b3lyp_6-31g(d).inp

003996355.b3lyp_6-31g(d).qchem.inp (generated)

003996355.b3lyp_6-31g(d).gjf (generated)

003996355.b3lyp_6-31g(d).firefly.inp (generated)

003996355.b3lyp_6-31g(d).smash.inp (generated)

003996355.b3lyp_6-31g(d).nwchem.inp (generated) 003996355.b3lyp_6-31g(d).log.xz 003996355.mol 003996355.PUBCHEM 003996355.mol (via Jmol)
003996383.b3lyp_6-31g(d).inp

003996383.b3lyp_6-31g(d).qchem.inp (generated)

003996383.b3lyp_6-31g(d).gjf (generated)

003996383.b3lyp_6-31g(d).firefly.inp (generated)

003996383.b3lyp_6-31g(d).smash.inp (generated)

003996383.b3lyp_6-31g(d).nwchem.inp (generated) 003996383.b3lyp_6-31g(d).log.xz 003996383.td-b3lyp_6-31g+(d).inp 003996383.td-b3lyp_6-31g+(d).log.xz

003996383.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996383.td-b3lyp_6-31+g(d).gjf (generated)

003996383.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996383.mol 003996383.PUBCHEM 003996383.mol (via Jmol)
003996428.b3lyp_6-31g(d).inp

003996428.b3lyp_6-31g(d).qchem.inp (generated)

003996428.b3lyp_6-31g(d).gjf (generated)

003996428.b3lyp_6-31g(d).firefly.inp (generated)

003996428.b3lyp_6-31g(d).smash.inp (generated)

003996428.b3lyp_6-31g(d).nwchem.inp (generated) 003996428.b3lyp_6-31g(d).log.xz 003996428.td-b3lyp_6-31g+(d).inp 003996428.td-b3lyp_6-31g+(d).log.xz

003996428.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996428.td-b3lyp_6-31+g(d).gjf (generated)

003996428.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996428.mol 003996428.PUBCHEM 003996428.mol (via Jmol)
003996444.b3lyp_6-31g(d).inp

003996444.b3lyp_6-31g(d).qchem.inp (generated)

003996444.b3lyp_6-31g(d).gjf (generated)

003996444.b3lyp_6-31g(d).firefly.inp (generated)

003996444.b3lyp_6-31g(d).smash.inp (generated)

003996444.b3lyp_6-31g(d).nwchem.inp (generated) 003996444.b3lyp_6-31g(d).log.xz 003996444.td-b3lyp_6-31g+(d).inp 003996444.td-b3lyp_6-31g+(d).log.xz

003996444.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996444.td-b3lyp_6-31+g(d).gjf (generated)

003996444.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996444.mol 003996444.PUBCHEM 003996444.mol (via Jmol)
003996445.b3lyp_6-31g(d).inp

003996445.b3lyp_6-31g(d).qchem.inp (generated)

003996445.b3lyp_6-31g(d).gjf (generated)

003996445.b3lyp_6-31g(d).firefly.inp (generated)

003996445.b3lyp_6-31g(d).smash.inp (generated)

003996445.b3lyp_6-31g(d).nwchem.inp (generated) 003996445.b3lyp_6-31g(d).log.xz 003996445.td-b3lyp_6-31g+(d).inp 003996445.td-b3lyp_6-31g+(d).log.xz

003996445.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996445.td-b3lyp_6-31+g(d).gjf (generated)

003996445.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996445.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996445.mol 003996445.PUBCHEM 003996445.mol (via Jmol)
003996487.b3lyp_6-31g(d).inp

003996487.b3lyp_6-31g(d).qchem.inp (generated)

003996487.b3lyp_6-31g(d).gjf (generated)

003996487.b3lyp_6-31g(d).firefly.inp (generated)

003996487.b3lyp_6-31g(d).smash.inp (generated)

003996487.b3lyp_6-31g(d).nwchem.inp (generated) 003996487.b3lyp_6-31g(d).log.xz 003996487.td-b3lyp_6-31g+(d).inp 003996487.td-b3lyp_6-31g+(d).log.xz

003996487.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996487.td-b3lyp_6-31+g(d).gjf (generated)

003996487.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996487.mol 003996487.PUBCHEM 003996487.mol (via Jmol)
003996488.b3lyp_6-31g(d).inp

003996488.b3lyp_6-31g(d).qchem.inp (generated)

003996488.b3lyp_6-31g(d).gjf (generated)

003996488.b3lyp_6-31g(d).firefly.inp (generated)

003996488.b3lyp_6-31g(d).smash.inp (generated)

003996488.b3lyp_6-31g(d).nwchem.inp (generated) 003996488.b3lyp_6-31g(d).log.xz 003996488.td-b3lyp_6-31g+(d).inp 003996488.td-b3lyp_6-31g+(d).log.xz

003996488.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996488.td-b3lyp_6-31+g(d).gjf (generated)

003996488.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996488.mol 003996488.PUBCHEM 003996488.mol (via Jmol)
003996502.b3lyp_6-31g(d).inp

003996502.b3lyp_6-31g(d).qchem.inp (generated)

003996502.b3lyp_6-31g(d).gjf (generated)

003996502.b3lyp_6-31g(d).firefly.inp (generated)

003996502.b3lyp_6-31g(d).smash.inp (generated)

003996502.b3lyp_6-31g(d).nwchem.inp (generated) 003996502.b3lyp_6-31g(d).log.xz 003996502.td-b3lyp_6-31g+(d).inp 003996502.td-b3lyp_6-31g+(d).log.xz

003996502.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996502.td-b3lyp_6-31+g(d).gjf (generated)

003996502.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996502.mol 003996502.PUBCHEM 003996502.mol (via Jmol)
003996590.b3lyp_6-31g(d).inp

003996590.b3lyp_6-31g(d).qchem.inp (generated)

003996590.b3lyp_6-31g(d).gjf (generated)

003996590.b3lyp_6-31g(d).firefly.inp (generated)

003996590.b3lyp_6-31g(d).smash.inp (generated)

003996590.b3lyp_6-31g(d).nwchem.inp (generated) 003996590.b3lyp_6-31g(d).log.xz 003996590.td-b3lyp_6-31g+(d).inp 003996590.td-b3lyp_6-31g+(d).log.xz

003996590.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996590.td-b3lyp_6-31+g(d).gjf (generated)

003996590.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996590.mol 003996590.PUBCHEM 003996590.mol (via Jmol)
003996620.b3lyp_6-31g(d).inp

003996620.b3lyp_6-31g(d).qchem.inp (generated)

003996620.b3lyp_6-31g(d).gjf (generated)

003996620.b3lyp_6-31g(d).firefly.inp (generated)

003996620.b3lyp_6-31g(d).smash.inp (generated)

003996620.b3lyp_6-31g(d).nwchem.inp (generated) 003996620.b3lyp_6-31g(d).log.xz 003996620.td-b3lyp_6-31g+(d).inp 003996620.td-b3lyp_6-31g+(d).log.xz

003996620.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996620.td-b3lyp_6-31+g(d).gjf (generated)

003996620.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996620.mol 003996620.PUBCHEM 003996620.mol (via Jmol)
003996893.b3lyp_6-31g(d).inp

003996893.b3lyp_6-31g(d).qchem.inp (generated)

003996893.b3lyp_6-31g(d).gjf (generated)

003996893.b3lyp_6-31g(d).firefly.inp (generated)

003996893.b3lyp_6-31g(d).smash.inp (generated)

003996893.b3lyp_6-31g(d).nwchem.inp (generated) 003996893.b3lyp_6-31g(d).log.xz 003996893.td-b3lyp_6-31g+(d).inp 003996893.td-b3lyp_6-31g+(d).log.xz

003996893.td-b3lyp_6-31+g(d).qchem.inp (generated)

003996893.td-b3lyp_6-31+g(d).gjf (generated)

003996893.td-b3lyp_6-31+g(d).firefly.inp (generated)

003996893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003996893.mol 003996893.PUBCHEM 003996893.mol (via Jmol)
003996998.b3lyp_6-31g(d).inp

003996998.b3lyp_6-31g(d).qchem.inp (generated)

003996998.b3lyp_6-31g(d).gjf (generated)

003996998.b3lyp_6-31g(d).firefly.inp (generated)

003996998.b3lyp_6-31g(d).smash.inp (generated)

003996998.b3lyp_6-31g(d).nwchem.inp (generated) 003996998.b3lyp_6-31g(d).log.xz 003996998.mol 003996998.PUBCHEM 003996998.mol (via Jmol)
003997026.b3lyp_6-31g(d).inp

003997026.b3lyp_6-31g(d).qchem.inp (generated)

003997026.b3lyp_6-31g(d).gjf (generated)

003997026.b3lyp_6-31g(d).firefly.inp (generated)

003997026.b3lyp_6-31g(d).smash.inp (generated)

003997026.b3lyp_6-31g(d).nwchem.inp (generated) 003997026.b3lyp_6-31g(d).log.xz 003997026.mol 003997026.PUBCHEM 003997026.mol (via Jmol)
003997243.b3lyp_6-31g(d).inp

003997243.b3lyp_6-31g(d).qchem.inp (generated)

003997243.b3lyp_6-31g(d).gjf (generated)

003997243.b3lyp_6-31g(d).firefly.inp (generated)

003997243.b3lyp_6-31g(d).smash.inp (generated)

003997243.b3lyp_6-31g(d).nwchem.inp (generated) 003997243.b3lyp_6-31g(d).log.xz 003997243.td-b3lyp_6-31g+(d).inp 003997243.td-b3lyp_6-31g+(d).log.xz

003997243.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997243.td-b3lyp_6-31+g(d).gjf (generated)

003997243.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997243.mol 003997243.PUBCHEM 003997243.mol (via Jmol)
003997288.b3lyp_6-31g(d).inp

003997288.b3lyp_6-31g(d).qchem.inp (generated)

003997288.b3lyp_6-31g(d).gjf (generated)

003997288.b3lyp_6-31g(d).firefly.inp (generated)

003997288.b3lyp_6-31g(d).smash.inp (generated)

003997288.b3lyp_6-31g(d).nwchem.inp (generated) 003997288.b3lyp_6-31g(d).log.xz 003997288.td-b3lyp_6-31g+(d).inp 003997288.td-b3lyp_6-31g+(d).log.xz

003997288.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997288.td-b3lyp_6-31+g(d).gjf (generated)

003997288.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997288.mol 003997288.PUBCHEM 003997288.mol (via Jmol)
003997487.b3lyp_6-31g(d).inp

003997487.b3lyp_6-31g(d).qchem.inp (generated)

003997487.b3lyp_6-31g(d).gjf (generated)

003997487.b3lyp_6-31g(d).firefly.inp (generated)

003997487.b3lyp_6-31g(d).smash.inp (generated)

003997487.b3lyp_6-31g(d).nwchem.inp (generated) 003997487.b3lyp_6-31g(d).log.xz 003997487.td-b3lyp_6-31g+(d).inp 003997487.td-b3lyp_6-31g+(d).log.xz

003997487.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997487.td-b3lyp_6-31+g(d).gjf (generated)

003997487.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997487.mol 003997487.PUBCHEM 003997487.mol (via Jmol)
003997706.b3lyp_6-31g(d).inp

003997706.b3lyp_6-31g(d).qchem.inp (generated)

003997706.b3lyp_6-31g(d).gjf (generated)

003997706.b3lyp_6-31g(d).firefly.inp (generated)

003997706.b3lyp_6-31g(d).smash.inp (generated)

003997706.b3lyp_6-31g(d).nwchem.inp (generated) 003997706.b3lyp_6-31g(d).log.xz 003997706.td-b3lyp_6-31g+(d).inp 003997706.td-b3lyp_6-31g+(d).log.xz

003997706.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997706.td-b3lyp_6-31+g(d).gjf (generated)

003997706.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997706.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997706.mol 003997706.PUBCHEM 003997706.mol (via Jmol)
003997707.b3lyp_6-31g(d).inp

003997707.b3lyp_6-31g(d).qchem.inp (generated)

003997707.b3lyp_6-31g(d).gjf (generated)

003997707.b3lyp_6-31g(d).firefly.inp (generated)

003997707.b3lyp_6-31g(d).smash.inp (generated)

003997707.b3lyp_6-31g(d).nwchem.inp (generated) 003997707.b3lyp_6-31g(d).log.xz 003997707.td-b3lyp_6-31g+(d).inp 003997707.td-b3lyp_6-31g+(d).log.xz

003997707.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997707.td-b3lyp_6-31+g(d).gjf (generated)

003997707.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997707.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997707.mol 003997707.PUBCHEM 003997707.mol (via Jmol)
003997770.b3lyp_6-31g(d).inp

003997770.b3lyp_6-31g(d).qchem.inp (generated)

003997770.b3lyp_6-31g(d).gjf (generated)

003997770.b3lyp_6-31g(d).firefly.inp (generated)

003997770.b3lyp_6-31g(d).smash.inp (generated)

003997770.b3lyp_6-31g(d).nwchem.inp (generated) 003997770.b3lyp_6-31g(d).log.xz 003997770.td-b3lyp_6-31g+(d).inp 003997770.td-b3lyp_6-31g+(d).log.xz

003997770.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997770.td-b3lyp_6-31+g(d).gjf (generated)

003997770.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997770.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997770.mol 003997770.PUBCHEM 003997770.mol (via Jmol)
003997785.b3lyp_6-31g(d).inp

003997785.b3lyp_6-31g(d).qchem.inp (generated)

003997785.b3lyp_6-31g(d).gjf (generated)

003997785.b3lyp_6-31g(d).firefly.inp (generated)

003997785.b3lyp_6-31g(d).smash.inp (generated)

003997785.b3lyp_6-31g(d).nwchem.inp (generated) 003997785.b3lyp_6-31g(d).log.xz 003997785.td-b3lyp_6-31g+(d).inp 003997785.td-b3lyp_6-31g+(d).log.xz

003997785.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997785.td-b3lyp_6-31+g(d).gjf (generated)

003997785.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997785.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997785.mol 003997785.PUBCHEM 003997785.mol (via Jmol)
003997891.b3lyp_6-31g(d).inp

003997891.b3lyp_6-31g(d).qchem.inp (generated)

003997891.b3lyp_6-31g(d).gjf (generated)

003997891.b3lyp_6-31g(d).firefly.inp (generated)

003997891.b3lyp_6-31g(d).smash.inp (generated)

003997891.b3lyp_6-31g(d).nwchem.inp (generated) 003997891.b3lyp_6-31g(d).log.xz 003997891.mol 003997891.PUBCHEM 003997891.mol (via Jmol)
003997893.b3lyp_6-31g(d).inp

003997893.b3lyp_6-31g(d).qchem.inp (generated)

003997893.b3lyp_6-31g(d).gjf (generated)

003997893.b3lyp_6-31g(d).firefly.inp (generated)

003997893.b3lyp_6-31g(d).smash.inp (generated)

003997893.b3lyp_6-31g(d).nwchem.inp (generated) 003997893.b3lyp_6-31g(d).log.xz 003997893.td-b3lyp_6-31g+(d).inp 003997893.td-b3lyp_6-31g+(d).log.xz

003997893.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997893.td-b3lyp_6-31+g(d).gjf (generated)

003997893.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997893.mol 003997893.PUBCHEM 003997893.mol (via Jmol)
003997958.b3lyp_6-31g(d).inp

003997958.b3lyp_6-31g(d).qchem.inp (generated)

003997958.b3lyp_6-31g(d).gjf (generated)

003997958.b3lyp_6-31g(d).firefly.inp (generated)

003997958.b3lyp_6-31g(d).smash.inp (generated)

003997958.b3lyp_6-31g(d).nwchem.inp (generated) 003997958.b3lyp_6-31g(d).log.xz 003997958.mol 003997958.PUBCHEM 003997958.mol (via Jmol)
003997959.b3lyp_6-31g(d).inp

003997959.b3lyp_6-31g(d).qchem.inp (generated)

003997959.b3lyp_6-31g(d).gjf (generated)

003997959.b3lyp_6-31g(d).firefly.inp (generated)

003997959.b3lyp_6-31g(d).smash.inp (generated)

003997959.b3lyp_6-31g(d).nwchem.inp (generated) 003997959.b3lyp_6-31g(d).log.xz 003997959.mol 003997959.PUBCHEM 003997959.mol (via Jmol)
003997961.b3lyp_6-31g(d).inp

003997961.b3lyp_6-31g(d).qchem.inp (generated)

003997961.b3lyp_6-31g(d).gjf (generated)

003997961.b3lyp_6-31g(d).firefly.inp (generated)

003997961.b3lyp_6-31g(d).smash.inp (generated)

003997961.b3lyp_6-31g(d).nwchem.inp (generated) 003997961.b3lyp_6-31g(d).log.xz 003997961.mol 003997961.PUBCHEM 003997961.mol (via Jmol)
003997975.b3lyp_6-31g(d).inp

003997975.b3lyp_6-31g(d).qchem.inp (generated)

003997975.b3lyp_6-31g(d).gjf (generated)

003997975.b3lyp_6-31g(d).firefly.inp (generated)

003997975.b3lyp_6-31g(d).smash.inp (generated)

003997975.b3lyp_6-31g(d).nwchem.inp (generated) 003997975.b3lyp_6-31g(d).log.xz 003997975.td-b3lyp_6-31g+(d).inp 003997975.td-b3lyp_6-31g+(d).log.xz

003997975.td-b3lyp_6-31+g(d).qchem.inp (generated)

003997975.td-b3lyp_6-31+g(d).gjf (generated)

003997975.td-b3lyp_6-31+g(d).firefly.inp (generated)

003997975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003997975.mol 003997975.PUBCHEM 003997975.mol (via Jmol)
003998034.b3lyp_6-31g(d).inp

003998034.b3lyp_6-31g(d).qchem.inp (generated)

003998034.b3lyp_6-31g(d).gjf (generated)

003998034.b3lyp_6-31g(d).firefly.inp (generated)

003998034.b3lyp_6-31g(d).smash.inp (generated)

003998034.b3lyp_6-31g(d).nwchem.inp (generated) 003998034.b3lyp_6-31g(d).log.xz 003998034.td-b3lyp_6-31g+(d).inp 003998034.td-b3lyp_6-31g+(d).log.xz

003998034.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998034.td-b3lyp_6-31+g(d).gjf (generated)

003998034.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998034.mol 003998034.PUBCHEM 003998034.mol (via Jmol)
003998059.b3lyp_6-31g(d).inp

003998059.b3lyp_6-31g(d).qchem.inp (generated)

003998059.b3lyp_6-31g(d).gjf (generated)

003998059.b3lyp_6-31g(d).firefly.inp (generated)

003998059.b3lyp_6-31g(d).smash.inp (generated)

003998059.b3lyp_6-31g(d).nwchem.inp (generated) 003998059.b3lyp_6-31g(d).log.xz 003998059.mol 003998059.PUBCHEM 003998059.mol (via Jmol)
003998064.b3lyp_6-31g(d).inp

003998064.b3lyp_6-31g(d).qchem.inp (generated)

003998064.b3lyp_6-31g(d).gjf (generated)

003998064.b3lyp_6-31g(d).firefly.inp (generated)

003998064.b3lyp_6-31g(d).smash.inp (generated)

003998064.b3lyp_6-31g(d).nwchem.inp (generated) 003998064.b3lyp_6-31g(d).log.xz 003998064.td-b3lyp_6-31g+(d).inp 003998064.td-b3lyp_6-31g+(d).log.xz

003998064.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998064.td-b3lyp_6-31+g(d).gjf (generated)

003998064.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998064.mol 003998064.PUBCHEM 003998064.mol (via Jmol)
003998082.b3lyp_6-31g(d).inp

003998082.b3lyp_6-31g(d).qchem.inp (generated)

003998082.b3lyp_6-31g(d).gjf (generated)

003998082.b3lyp_6-31g(d).firefly.inp (generated)

003998082.b3lyp_6-31g(d).smash.inp (generated)

003998082.b3lyp_6-31g(d).nwchem.inp (generated) 003998082.b3lyp_6-31g(d).log.xz 003998082.td-b3lyp_6-31g+(d).inp 003998082.td-b3lyp_6-31g+(d).log.xz

003998082.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998082.td-b3lyp_6-31+g(d).gjf (generated)

003998082.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998082.mol 003998082.PUBCHEM 003998082.mol (via Jmol)
003998131.b3lyp_6-31g(d).inp

003998131.b3lyp_6-31g(d).qchem.inp (generated)

003998131.b3lyp_6-31g(d).gjf (generated)

003998131.b3lyp_6-31g(d).firefly.inp (generated)

003998131.b3lyp_6-31g(d).smash.inp (generated)

003998131.b3lyp_6-31g(d).nwchem.inp (generated) 003998131.b3lyp_6-31g(d).log.xz 003998131.mol 003998131.PUBCHEM 003998131.mol (via Jmol)
003998303.b3lyp_6-31g(d).inp

003998303.b3lyp_6-31g(d).qchem.inp (generated)

003998303.b3lyp_6-31g(d).gjf (generated)

003998303.b3lyp_6-31g(d).firefly.inp (generated)

003998303.b3lyp_6-31g(d).smash.inp (generated)

003998303.b3lyp_6-31g(d).nwchem.inp (generated) 003998303.b3lyp_6-31g(d).log.xz 003998303.td-b3lyp_6-31g+(d).inp 003998303.td-b3lyp_6-31g+(d).log.xz

003998303.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998303.td-b3lyp_6-31+g(d).gjf (generated)

003998303.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998303.mol 003998303.PUBCHEM 003998303.mol (via Jmol)
003998332.b3lyp_6-31g(d).inp

003998332.b3lyp_6-31g(d).qchem.inp (generated)

003998332.b3lyp_6-31g(d).gjf (generated)

003998332.b3lyp_6-31g(d).firefly.inp (generated)

003998332.b3lyp_6-31g(d).smash.inp (generated)

003998332.b3lyp_6-31g(d).nwchem.inp (generated) 003998332.b3lyp_6-31g(d).log.xz 003998332.td-b3lyp_6-31g+(d).inp 003998332.td-b3lyp_6-31g+(d).log.xz

003998332.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998332.td-b3lyp_6-31+g(d).gjf (generated)

003998332.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998332.mol 003998332.PUBCHEM 003998332.mol (via Jmol)
003998382.b3lyp_6-31g(d).inp

003998382.b3lyp_6-31g(d).qchem.inp (generated)

003998382.b3lyp_6-31g(d).gjf (generated)

003998382.b3lyp_6-31g(d).firefly.inp (generated)

003998382.b3lyp_6-31g(d).smash.inp (generated)

003998382.b3lyp_6-31g(d).nwchem.inp (generated) 003998382.b3lyp_6-31g(d).log.xz 003998382.mol 003998382.PUBCHEM 003998382.mol (via Jmol)
003998388.b3lyp_6-31g(d).inp

003998388.b3lyp_6-31g(d).qchem.inp (generated)

003998388.b3lyp_6-31g(d).gjf (generated)

003998388.b3lyp_6-31g(d).firefly.inp (generated)

003998388.b3lyp_6-31g(d).smash.inp (generated)

003998388.b3lyp_6-31g(d).nwchem.inp (generated) 003998388.b3lyp_6-31g(d).log.xz 003998388.td-b3lyp_6-31g+(d).inp 003998388.td-b3lyp_6-31g+(d).log.xz

003998388.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998388.td-b3lyp_6-31+g(d).gjf (generated)

003998388.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998388.mol 003998388.PUBCHEM 003998388.mol (via Jmol)
003998545.b3lyp_6-31g(d).inp

003998545.b3lyp_6-31g(d).qchem.inp (generated)

003998545.b3lyp_6-31g(d).gjf (generated)

003998545.b3lyp_6-31g(d).firefly.inp (generated)

003998545.b3lyp_6-31g(d).smash.inp (generated)

003998545.b3lyp_6-31g(d).nwchem.inp (generated) 003998545.b3lyp_6-31g(d).log.xz 003998545.td-b3lyp_6-31g+(d).inp 003998545.td-b3lyp_6-31g+(d).log.xz

003998545.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998545.td-b3lyp_6-31+g(d).gjf (generated)

003998545.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998545.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998545.mol 003998545.PUBCHEM 003998545.mol (via Jmol)
003998708.b3lyp_6-31g(d).inp

003998708.b3lyp_6-31g(d).qchem.inp (generated)

003998708.b3lyp_6-31g(d).gjf (generated)

003998708.b3lyp_6-31g(d).firefly.inp (generated)

003998708.b3lyp_6-31g(d).smash.inp (generated)

003998708.b3lyp_6-31g(d).nwchem.inp (generated) 003998708.b3lyp_6-31g(d).log.xz 003998708.td-b3lyp_6-31g+(d).inp 003998708.td-b3lyp_6-31g+(d).log.xz

003998708.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998708.td-b3lyp_6-31+g(d).gjf (generated)

003998708.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998708.mol 003998708.PUBCHEM 003998708.mol (via Jmol)
003998719.b3lyp_6-31g(d).inp

003998719.b3lyp_6-31g(d).qchem.inp (generated)

003998719.b3lyp_6-31g(d).gjf (generated)

003998719.b3lyp_6-31g(d).firefly.inp (generated)

003998719.b3lyp_6-31g(d).smash.inp (generated)

003998719.b3lyp_6-31g(d).nwchem.inp (generated) 003998719.b3lyp_6-31g(d).log.xz 003998719.td-b3lyp_6-31g+(d).inp 003998719.td-b3lyp_6-31g+(d).log.xz

003998719.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998719.td-b3lyp_6-31+g(d).gjf (generated)

003998719.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998719.mol 003998719.PUBCHEM 003998719.mol (via Jmol)
003998922.b3lyp_6-31g(d).inp

003998922.b3lyp_6-31g(d).qchem.inp (generated)

003998922.b3lyp_6-31g(d).gjf (generated)

003998922.b3lyp_6-31g(d).firefly.inp (generated)

003998922.b3lyp_6-31g(d).smash.inp (generated)

003998922.b3lyp_6-31g(d).nwchem.inp (generated) 003998922.b3lyp_6-31g(d).log.xz 003998922.td-b3lyp_6-31g+(d).inp 003998922.td-b3lyp_6-31g+(d).log.xz

003998922.td-b3lyp_6-31+g(d).qchem.inp (generated)

003998922.td-b3lyp_6-31+g(d).gjf (generated)

003998922.td-b3lyp_6-31+g(d).firefly.inp (generated)

003998922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003998922.mol 003998922.PUBCHEM 003998922.mol (via Jmol)
003999029.b3lyp_6-31g(d).inp

003999029.b3lyp_6-31g(d).qchem.inp (generated)

003999029.b3lyp_6-31g(d).gjf (generated)

003999029.b3lyp_6-31g(d).firefly.inp (generated)

003999029.b3lyp_6-31g(d).smash.inp (generated)

003999029.b3lyp_6-31g(d).nwchem.inp (generated) 003999029.b3lyp_6-31g(d).log.xz 003999029.td-b3lyp_6-31g+(d).inp 003999029.td-b3lyp_6-31g+(d).log.xz

003999029.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999029.td-b3lyp_6-31+g(d).gjf (generated)

003999029.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999029.mol 003999029.PUBCHEM 003999029.mol (via Jmol)
003999096.b3lyp_6-31g(d).inp

003999096.b3lyp_6-31g(d).qchem.inp (generated)

003999096.b3lyp_6-31g(d).gjf (generated)

003999096.b3lyp_6-31g(d).firefly.inp (generated)

003999096.b3lyp_6-31g(d).smash.inp (generated)

003999096.b3lyp_6-31g(d).nwchem.inp (generated) 003999096.b3lyp_6-31g(d).log.xz 003999096.td-b3lyp_6-31g+(d).inp 003999096.td-b3lyp_6-31g+(d).log.xz

003999096.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999096.td-b3lyp_6-31+g(d).gjf (generated)

003999096.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999096.mol 003999096.PUBCHEM 003999096.mol (via Jmol)
003999192.b3lyp_6-31g(d).inp

003999192.b3lyp_6-31g(d).qchem.inp (generated)

003999192.b3lyp_6-31g(d).gjf (generated)

003999192.b3lyp_6-31g(d).firefly.inp (generated)

003999192.b3lyp_6-31g(d).smash.inp (generated)

003999192.b3lyp_6-31g(d).nwchem.inp (generated) 003999192.b3lyp_6-31g(d).log.xz 003999192.mol 003999192.PUBCHEM 003999192.mol (via Jmol)
003999345.b3lyp_6-31g(d).inp

003999345.b3lyp_6-31g(d).qchem.inp (generated)

003999345.b3lyp_6-31g(d).gjf (generated)

003999345.b3lyp_6-31g(d).firefly.inp (generated)

003999345.b3lyp_6-31g(d).smash.inp (generated)

003999345.b3lyp_6-31g(d).nwchem.inp (generated) 003999345.b3lyp_6-31g(d).log.xz 003999345.mol 003999345.PUBCHEM 003999345.mol (via Jmol)
003999348.b3lyp_6-31g(d).inp

003999348.b3lyp_6-31g(d).qchem.inp (generated)

003999348.b3lyp_6-31g(d).gjf (generated)

003999348.b3lyp_6-31g(d).firefly.inp (generated)

003999348.b3lyp_6-31g(d).smash.inp (generated)

003999348.b3lyp_6-31g(d).nwchem.inp (generated) 003999348.b3lyp_6-31g(d).log.xz 003999348.mol 003999348.PUBCHEM 003999348.mol (via Jmol)
003999404.b3lyp_6-31g(d).inp

003999404.b3lyp_6-31g(d).qchem.inp (generated)

003999404.b3lyp_6-31g(d).gjf (generated)

003999404.b3lyp_6-31g(d).firefly.inp (generated)

003999404.b3lyp_6-31g(d).smash.inp (generated)

003999404.b3lyp_6-31g(d).nwchem.inp (generated) 003999404.b3lyp_6-31g(d).log.xz 003999404.td-b3lyp_6-31g+(d).inp 003999404.td-b3lyp_6-31g+(d).log.xz

003999404.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999404.td-b3lyp_6-31+g(d).gjf (generated)

003999404.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999404.mol 003999404.PUBCHEM 003999404.mol (via Jmol)
003999481.b3lyp_6-31g(d).inp

003999481.b3lyp_6-31g(d).qchem.inp (generated)

003999481.b3lyp_6-31g(d).gjf (generated)

003999481.b3lyp_6-31g(d).firefly.inp (generated)

003999481.b3lyp_6-31g(d).smash.inp (generated)

003999481.b3lyp_6-31g(d).nwchem.inp (generated) 003999481.b3lyp_6-31g(d).log.xz 003999481.td-b3lyp_6-31g+(d).inp 003999481.td-b3lyp_6-31g+(d).log.xz

003999481.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999481.td-b3lyp_6-31+g(d).gjf (generated)

003999481.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999481.mol 003999481.PUBCHEM 003999481.mol (via Jmol)
003999499.b3lyp_6-31g(d).inp

003999499.b3lyp_6-31g(d).qchem.inp (generated)

003999499.b3lyp_6-31g(d).gjf (generated)

003999499.b3lyp_6-31g(d).firefly.inp (generated)

003999499.b3lyp_6-31g(d).smash.inp (generated)

003999499.b3lyp_6-31g(d).nwchem.inp (generated) 003999499.b3lyp_6-31g(d).log.xz 003999499.td-b3lyp_6-31g+(d).inp 003999499.td-b3lyp_6-31g+(d).log.xz

003999499.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999499.td-b3lyp_6-31+g(d).gjf (generated)

003999499.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999499.mol 003999499.PUBCHEM 003999499.mol (via Jmol)
003999685.b3lyp_6-31g(d).inp

003999685.b3lyp_6-31g(d).qchem.inp (generated)

003999685.b3lyp_6-31g(d).gjf (generated)

003999685.b3lyp_6-31g(d).firefly.inp (generated)

003999685.b3lyp_6-31g(d).smash.inp (generated)

003999685.b3lyp_6-31g(d).nwchem.inp (generated) 003999685.b3lyp_6-31g(d).log.xz 003999685.td-b3lyp_6-31g+(d).inp 003999685.td-b3lyp_6-31g+(d).log.xz

003999685.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999685.td-b3lyp_6-31+g(d).gjf (generated)

003999685.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999685.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999685.mol 003999685.PUBCHEM 003999685.mol (via Jmol)
003999686.b3lyp_6-31g(d).inp

003999686.b3lyp_6-31g(d).qchem.inp (generated)

003999686.b3lyp_6-31g(d).gjf (generated)

003999686.b3lyp_6-31g(d).firefly.inp (generated)

003999686.b3lyp_6-31g(d).smash.inp (generated)

003999686.b3lyp_6-31g(d).nwchem.inp (generated) 003999686.b3lyp_6-31g(d).log.xz 003999686.td-b3lyp_6-31g+(d).inp 003999686.td-b3lyp_6-31g+(d).log.xz

003999686.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999686.td-b3lyp_6-31+g(d).gjf (generated)

003999686.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999686.mol 003999686.PUBCHEM 003999686.mol (via Jmol)
003999719.b3lyp_6-31g(d).inp

003999719.b3lyp_6-31g(d).qchem.inp (generated)

003999719.b3lyp_6-31g(d).gjf (generated)

003999719.b3lyp_6-31g(d).firefly.inp (generated)

003999719.b3lyp_6-31g(d).smash.inp (generated)

003999719.b3lyp_6-31g(d).nwchem.inp (generated) 003999719.b3lyp_6-31g(d).log.xz 003999719.td-b3lyp_6-31g+(d).inp 003999719.td-b3lyp_6-31g+(d).log.xz

003999719.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999719.td-b3lyp_6-31+g(d).gjf (generated)

003999719.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999719.mol 003999719.PUBCHEM 003999719.mol (via Jmol)
003999742.b3lyp_6-31g(d).inp

003999742.b3lyp_6-31g(d).qchem.inp (generated)

003999742.b3lyp_6-31g(d).gjf (generated)

003999742.b3lyp_6-31g(d).firefly.inp (generated)

003999742.b3lyp_6-31g(d).smash.inp (generated)

003999742.b3lyp_6-31g(d).nwchem.inp (generated) 003999742.b3lyp_6-31g(d).log.xz 003999742.td-b3lyp_6-31g+(d).inp 003999742.td-b3lyp_6-31g+(d).log.xz

003999742.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999742.td-b3lyp_6-31+g(d).gjf (generated)

003999742.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999742.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999742.mol 003999742.PUBCHEM 003999742.mol (via Jmol)
003999755.b3lyp_6-31g(d).inp

003999755.b3lyp_6-31g(d).qchem.inp (generated)

003999755.b3lyp_6-31g(d).gjf (generated)

003999755.b3lyp_6-31g(d).firefly.inp (generated)

003999755.b3lyp_6-31g(d).smash.inp (generated)

003999755.b3lyp_6-31g(d).nwchem.inp (generated) 003999755.b3lyp_6-31g(d).log.xz 003999755.td-b3lyp_6-31g+(d).inp 003999755.td-b3lyp_6-31g+(d).log.xz

003999755.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999755.td-b3lyp_6-31+g(d).gjf (generated)

003999755.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999755.mol 003999755.PUBCHEM 003999755.mol (via Jmol)
003999853.b3lyp_6-31g(d).inp

003999853.b3lyp_6-31g(d).qchem.inp (generated)

003999853.b3lyp_6-31g(d).gjf (generated)

003999853.b3lyp_6-31g(d).firefly.inp (generated)

003999853.b3lyp_6-31g(d).smash.inp (generated)

003999853.b3lyp_6-31g(d).nwchem.inp (generated) 003999853.b3lyp_6-31g(d).log.xz 003999853.td-b3lyp_6-31g+(d).inp 003999853.td-b3lyp_6-31g+(d).log.xz

003999853.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999853.td-b3lyp_6-31+g(d).gjf (generated)

003999853.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999853.mol 003999853.PUBCHEM 003999853.mol (via Jmol)
003999856.b3lyp_6-31g(d).inp

003999856.b3lyp_6-31g(d).qchem.inp (generated)

003999856.b3lyp_6-31g(d).gjf (generated)

003999856.b3lyp_6-31g(d).firefly.inp (generated)

003999856.b3lyp_6-31g(d).smash.inp (generated)

003999856.b3lyp_6-31g(d).nwchem.inp (generated) 003999856.b3lyp_6-31g(d).log.xz 003999856.td-b3lyp_6-31g+(d).inp 003999856.td-b3lyp_6-31g+(d).log.xz

003999856.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999856.td-b3lyp_6-31+g(d).gjf (generated)

003999856.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999856.mol 003999856.PUBCHEM 003999856.mol (via Jmol)
003999891.b3lyp_6-31g(d).inp

003999891.b3lyp_6-31g(d).qchem.inp (generated)

003999891.b3lyp_6-31g(d).gjf (generated)

003999891.b3lyp_6-31g(d).firefly.inp (generated)

003999891.b3lyp_6-31g(d).smash.inp (generated)

003999891.b3lyp_6-31g(d).nwchem.inp (generated) 003999891.b3lyp_6-31g(d).log.xz 003999891.mol 003999891.PUBCHEM 003999891.mol (via Jmol)
003999892.b3lyp_6-31g(d).inp

003999892.b3lyp_6-31g(d).qchem.inp (generated)

003999892.b3lyp_6-31g(d).gjf (generated)

003999892.b3lyp_6-31g(d).firefly.inp (generated)

003999892.b3lyp_6-31g(d).smash.inp (generated)

003999892.b3lyp_6-31g(d).nwchem.inp (generated) 003999892.b3lyp_6-31g(d).log.xz 003999892.td-b3lyp_6-31g+(d).inp 003999892.td-b3lyp_6-31g+(d).log.xz

003999892.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999892.td-b3lyp_6-31+g(d).gjf (generated)

003999892.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999892.mol 003999892.PUBCHEM 003999892.mol (via Jmol)
003999941.b3lyp_6-31g(d).inp

003999941.b3lyp_6-31g(d).qchem.inp (generated)

003999941.b3lyp_6-31g(d).gjf (generated)

003999941.b3lyp_6-31g(d).firefly.inp (generated)

003999941.b3lyp_6-31g(d).smash.inp (generated)

003999941.b3lyp_6-31g(d).nwchem.inp (generated) 003999941.b3lyp_6-31g(d).log.xz 003999941.mol 003999941.PUBCHEM 003999941.mol (via Jmol)
003999947.b3lyp_6-31g(d).inp

003999947.b3lyp_6-31g(d).qchem.inp (generated)

003999947.b3lyp_6-31g(d).gjf (generated)

003999947.b3lyp_6-31g(d).firefly.inp (generated)

003999947.b3lyp_6-31g(d).smash.inp (generated)

003999947.b3lyp_6-31g(d).nwchem.inp (generated) 003999947.b3lyp_6-31g(d).log.xz 003999947.td-b3lyp_6-31g+(d).inp 003999947.td-b3lyp_6-31g+(d).log.xz

003999947.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999947.td-b3lyp_6-31+g(d).gjf (generated)

003999947.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999947.mol 003999947.PUBCHEM 003999947.mol (via Jmol)
003999962.b3lyp_6-31g(d).inp

003999962.b3lyp_6-31g(d).qchem.inp (generated)

003999962.b3lyp_6-31g(d).gjf (generated)

003999962.b3lyp_6-31g(d).firefly.inp (generated)

003999962.b3lyp_6-31g(d).smash.inp (generated)

003999962.b3lyp_6-31g(d).nwchem.inp (generated) 003999962.b3lyp_6-31g(d).log.xz 003999962.td-b3lyp_6-31g+(d).inp 003999962.td-b3lyp_6-31g+(d).log.xz

003999962.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999962.td-b3lyp_6-31+g(d).gjf (generated)

003999962.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999962.mol 003999962.PUBCHEM 003999962.mol (via Jmol)
003999965.b3lyp_6-31g(d).inp

003999965.b3lyp_6-31g(d).qchem.inp (generated)

003999965.b3lyp_6-31g(d).gjf (generated)

003999965.b3lyp_6-31g(d).firefly.inp (generated)

003999965.b3lyp_6-31g(d).smash.inp (generated)

003999965.b3lyp_6-31g(d).nwchem.inp (generated) 003999965.b3lyp_6-31g(d).log.xz 003999965.mol 003999965.PUBCHEM 003999965.mol (via Jmol)
003999982.b3lyp_6-31g(d).inp

003999982.b3lyp_6-31g(d).qchem.inp (generated)

003999982.b3lyp_6-31g(d).gjf (generated)

003999982.b3lyp_6-31g(d).firefly.inp (generated)

003999982.b3lyp_6-31g(d).smash.inp (generated)

003999982.b3lyp_6-31g(d).nwchem.inp (generated) 003999982.b3lyp_6-31g(d).log.xz 003999982.td-b3lyp_6-31g+(d).inp 003999982.td-b3lyp_6-31g+(d).log.xz

003999982.td-b3lyp_6-31+g(d).qchem.inp (generated)

003999982.td-b3lyp_6-31+g(d).gjf (generated)

003999982.td-b3lyp_6-31+g(d).firefly.inp (generated)

003999982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 003999982.mol 003999982.PUBCHEM 003999982.mol (via Jmol)


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