Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 573 (422) in this page
047125109.b3lyp_6-31g(d).inp

047125109.b3lyp_6-31g(d).qchem.inp (generated)

047125109.b3lyp_6-31g(d).gjf (generated)

047125109.b3lyp_6-31g(d).firefly.inp (generated)

047125109.b3lyp_6-31g(d).smash.inp (generated)

047125109.b3lyp_6-31g(d).nwchem.inp (generated) 047125109.b3lyp_6-31g(d).log.xz 047125109.td-b3lyp_6-31g+(d).inp 047125109.td-b3lyp_6-31g+(d).log.xz

047125109.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125109.td-b3lyp_6-31+g(d).gjf (generated)

047125109.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125109.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125109.mol 047125109.PUBCHEM 047125109.mol (via Jmol)
047125113.b3lyp_6-31g(d).inp

047125113.b3lyp_6-31g(d).qchem.inp (generated)

047125113.b3lyp_6-31g(d).gjf (generated)

047125113.b3lyp_6-31g(d).firefly.inp (generated)

047125113.b3lyp_6-31g(d).smash.inp (generated)

047125113.b3lyp_6-31g(d).nwchem.inp (generated) 047125113.b3lyp_6-31g(d).log.xz 047125113.td-b3lyp_6-31g+(d).inp 047125113.td-b3lyp_6-31g+(d).log.xz

047125113.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125113.td-b3lyp_6-31+g(d).gjf (generated)

047125113.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125113.mol 047125113.PUBCHEM 047125113.mol (via Jmol)
047125114.b3lyp_6-31g(d).inp

047125114.b3lyp_6-31g(d).qchem.inp (generated)

047125114.b3lyp_6-31g(d).gjf (generated)

047125114.b3lyp_6-31g(d).firefly.inp (generated)

047125114.b3lyp_6-31g(d).smash.inp (generated)

047125114.b3lyp_6-31g(d).nwchem.inp (generated) 047125114.b3lyp_6-31g(d).log.xz 047125114.td-b3lyp_6-31g+(d).inp 047125114.td-b3lyp_6-31g+(d).log.xz

047125114.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125114.td-b3lyp_6-31+g(d).gjf (generated)

047125114.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125114.mol 047125114.PUBCHEM 047125114.mol (via Jmol)
047125146.b3lyp_6-31g(d).inp

047125146.b3lyp_6-31g(d).qchem.inp (generated)

047125146.b3lyp_6-31g(d).gjf (generated)

047125146.b3lyp_6-31g(d).firefly.inp (generated)

047125146.b3lyp_6-31g(d).smash.inp (generated)

047125146.b3lyp_6-31g(d).nwchem.inp (generated) 047125146.b3lyp_6-31g(d).log.xz 047125146.td-b3lyp_6-31g+(d).inp 047125146.td-b3lyp_6-31g+(d).log.xz

047125146.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125146.td-b3lyp_6-31+g(d).gjf (generated)

047125146.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125146.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125146.mol 047125146.PUBCHEM 047125146.mol (via Jmol)
047125235.b3lyp_6-31g(d).inp

047125235.b3lyp_6-31g(d).qchem.inp (generated)

047125235.b3lyp_6-31g(d).gjf (generated)

047125235.b3lyp_6-31g(d).firefly.inp (generated)

047125235.b3lyp_6-31g(d).smash.inp (generated)

047125235.b3lyp_6-31g(d).nwchem.inp (generated) 047125235.b3lyp_6-31g(d).log.xz 047125235.td-b3lyp_6-31g+(d).inp 047125235.td-b3lyp_6-31g+(d).log.xz

047125235.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125235.td-b3lyp_6-31+g(d).gjf (generated)

047125235.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125235.mol 047125235.PUBCHEM 047125235.mol (via Jmol)
047125258.b3lyp_6-31g(d).inp

047125258.b3lyp_6-31g(d).qchem.inp (generated)

047125258.b3lyp_6-31g(d).gjf (generated)

047125258.b3lyp_6-31g(d).firefly.inp (generated)

047125258.b3lyp_6-31g(d).smash.inp (generated)

047125258.b3lyp_6-31g(d).nwchem.inp (generated) 047125258.b3lyp_6-31g(d).log.xz 047125258.mol 047125258.PUBCHEM 047125258.mol (via Jmol)
047125260.b3lyp_6-31g(d).inp

047125260.b3lyp_6-31g(d).qchem.inp (generated)

047125260.b3lyp_6-31g(d).gjf (generated)

047125260.b3lyp_6-31g(d).firefly.inp (generated)

047125260.b3lyp_6-31g(d).smash.inp (generated)

047125260.b3lyp_6-31g(d).nwchem.inp (generated) 047125260.b3lyp_6-31g(d).log.xz 047125260.td-b3lyp_6-31g+(d).inp 047125260.td-b3lyp_6-31g+(d).log.xz

047125260.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125260.td-b3lyp_6-31+g(d).gjf (generated)

047125260.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125260.mol 047125260.PUBCHEM 047125260.mol (via Jmol)
047125261.b3lyp_6-31g(d).inp

047125261.b3lyp_6-31g(d).qchem.inp (generated)

047125261.b3lyp_6-31g(d).gjf (generated)

047125261.b3lyp_6-31g(d).firefly.inp (generated)

047125261.b3lyp_6-31g(d).smash.inp (generated)

047125261.b3lyp_6-31g(d).nwchem.inp (generated) 047125261.b3lyp_6-31g(d).log.xz 047125261.td-b3lyp_6-31g+(d).inp 047125261.td-b3lyp_6-31g+(d).log.xz

047125261.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125261.td-b3lyp_6-31+g(d).gjf (generated)

047125261.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125261.mol 047125261.PUBCHEM 047125261.mol (via Jmol)
047125262.b3lyp_6-31g(d).inp

047125262.b3lyp_6-31g(d).qchem.inp (generated)

047125262.b3lyp_6-31g(d).gjf (generated)

047125262.b3lyp_6-31g(d).firefly.inp (generated)

047125262.b3lyp_6-31g(d).smash.inp (generated)

047125262.b3lyp_6-31g(d).nwchem.inp (generated) 047125262.b3lyp_6-31g(d).log.xz 047125262.td-b3lyp_6-31g+(d).inp 047125262.td-b3lyp_6-31g+(d).log.xz

047125262.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125262.td-b3lyp_6-31+g(d).gjf (generated)

047125262.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125262.mol 047125262.PUBCHEM 047125262.mol (via Jmol)
047125277.b3lyp_6-31g(d).inp

047125277.b3lyp_6-31g(d).qchem.inp (generated)

047125277.b3lyp_6-31g(d).gjf (generated)

047125277.b3lyp_6-31g(d).firefly.inp (generated)

047125277.b3lyp_6-31g(d).smash.inp (generated)

047125277.b3lyp_6-31g(d).nwchem.inp (generated) 047125277.b3lyp_6-31g(d).log.xz 047125277.mol 047125277.PUBCHEM 047125277.mol (via Jmol)
047125443.b3lyp_6-31g(d).inp

047125443.b3lyp_6-31g(d).qchem.inp (generated)

047125443.b3lyp_6-31g(d).gjf (generated)

047125443.b3lyp_6-31g(d).firefly.inp (generated)

047125443.b3lyp_6-31g(d).smash.inp (generated)

047125443.b3lyp_6-31g(d).nwchem.inp (generated) 047125443.b3lyp_6-31g(d).log.xz 047125443.td-b3lyp_6-31g+(d).inp 047125443.td-b3lyp_6-31g+(d).log.xz

047125443.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125443.td-b3lyp_6-31+g(d).gjf (generated)

047125443.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125443.mol 047125443.PUBCHEM 047125443.mol (via Jmol)
047125488.b3lyp_6-31g(d).inp

047125488.b3lyp_6-31g(d).qchem.inp (generated)

047125488.b3lyp_6-31g(d).gjf (generated)

047125488.b3lyp_6-31g(d).firefly.inp (generated)

047125488.b3lyp_6-31g(d).smash.inp (generated)

047125488.b3lyp_6-31g(d).nwchem.inp (generated) 047125488.b3lyp_6-31g(d).log.xz 047125488.td-b3lyp_6-31g+(d).inp 047125488.td-b3lyp_6-31g+(d).log.xz

047125488.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125488.td-b3lyp_6-31+g(d).gjf (generated)

047125488.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125488.mol 047125488.PUBCHEM 047125488.mol (via Jmol)
047125509.b3lyp_6-31g(d).inp

047125509.b3lyp_6-31g(d).qchem.inp (generated)

047125509.b3lyp_6-31g(d).gjf (generated)

047125509.b3lyp_6-31g(d).firefly.inp (generated)

047125509.b3lyp_6-31g(d).smash.inp (generated)

047125509.b3lyp_6-31g(d).nwchem.inp (generated) 047125509.b3lyp_6-31g(d).log.xz 047125509.td-b3lyp_6-31g+(d).inp 047125509.td-b3lyp_6-31g+(d).log.xz

047125509.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125509.td-b3lyp_6-31+g(d).gjf (generated)

047125509.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125509.mol 047125509.PUBCHEM 047125509.mol (via Jmol)
047125599.b3lyp_6-31g(d).inp

047125599.b3lyp_6-31g(d).qchem.inp (generated)

047125599.b3lyp_6-31g(d).gjf (generated)

047125599.b3lyp_6-31g(d).firefly.inp (generated)

047125599.b3lyp_6-31g(d).smash.inp (generated)

047125599.b3lyp_6-31g(d).nwchem.inp (generated) 047125599.b3lyp_6-31g(d).log.xz 047125599.td-b3lyp_6-31g+(d).inp 047125599.td-b3lyp_6-31g+(d).log.xz

047125599.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125599.td-b3lyp_6-31+g(d).gjf (generated)

047125599.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125599.mol 047125599.PUBCHEM 047125599.mol (via Jmol)
047125605.b3lyp_6-31g(d).inp

047125605.b3lyp_6-31g(d).qchem.inp (generated)

047125605.b3lyp_6-31g(d).gjf (generated)

047125605.b3lyp_6-31g(d).firefly.inp (generated)

047125605.b3lyp_6-31g(d).smash.inp (generated)

047125605.b3lyp_6-31g(d).nwchem.inp (generated) 047125605.b3lyp_6-31g(d).log.xz 047125605.td-b3lyp_6-31g+(d).inp 047125605.td-b3lyp_6-31g+(d).log.xz

047125605.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125605.td-b3lyp_6-31+g(d).gjf (generated)

047125605.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125605.mol 047125605.PUBCHEM 047125605.mol (via Jmol)
047125606.b3lyp_6-31g(d).inp

047125606.b3lyp_6-31g(d).qchem.inp (generated)

047125606.b3lyp_6-31g(d).gjf (generated)

047125606.b3lyp_6-31g(d).firefly.inp (generated)

047125606.b3lyp_6-31g(d).smash.inp (generated)

047125606.b3lyp_6-31g(d).nwchem.inp (generated) 047125606.b3lyp_6-31g(d).log.xz 047125606.td-b3lyp_6-31g+(d).inp 047125606.td-b3lyp_6-31g+(d).log.xz

047125606.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125606.td-b3lyp_6-31+g(d).gjf (generated)

047125606.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125606.mol 047125606.PUBCHEM 047125606.mol (via Jmol)
047125609.b3lyp_6-31g(d).inp

047125609.b3lyp_6-31g(d).qchem.inp (generated)

047125609.b3lyp_6-31g(d).gjf (generated)

047125609.b3lyp_6-31g(d).firefly.inp (generated)

047125609.b3lyp_6-31g(d).smash.inp (generated)

047125609.b3lyp_6-31g(d).nwchem.inp (generated) 047125609.b3lyp_6-31g(d).log.xz 047125609.td-b3lyp_6-31g+(d).inp 047125609.td-b3lyp_6-31g+(d).log.xz

047125609.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125609.td-b3lyp_6-31+g(d).gjf (generated)

047125609.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125609.mol 047125609.PUBCHEM 047125609.mol (via Jmol)
047125610.b3lyp_6-31g(d).inp

047125610.b3lyp_6-31g(d).qchem.inp (generated)

047125610.b3lyp_6-31g(d).gjf (generated)

047125610.b3lyp_6-31g(d).firefly.inp (generated)

047125610.b3lyp_6-31g(d).smash.inp (generated)

047125610.b3lyp_6-31g(d).nwchem.inp (generated) 047125610.b3lyp_6-31g(d).log.xz 047125610.td-b3lyp_6-31g+(d).inp 047125610.td-b3lyp_6-31g+(d).log.xz

047125610.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125610.td-b3lyp_6-31+g(d).gjf (generated)

047125610.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125610.mol 047125610.PUBCHEM 047125610.mol (via Jmol)
047125614.b3lyp_6-31g(d).inp

047125614.b3lyp_6-31g(d).qchem.inp (generated)

047125614.b3lyp_6-31g(d).gjf (generated)

047125614.b3lyp_6-31g(d).firefly.inp (generated)

047125614.b3lyp_6-31g(d).smash.inp (generated)

047125614.b3lyp_6-31g(d).nwchem.inp (generated) 047125614.b3lyp_6-31g(d).log.xz 047125614.td-b3lyp_6-31g+(d).inp 047125614.td-b3lyp_6-31g+(d).log.xz

047125614.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125614.td-b3lyp_6-31+g(d).gjf (generated)

047125614.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125614.mol 047125614.PUBCHEM 047125614.mol (via Jmol)
047125618.b3lyp_6-31g(d).inp

047125618.b3lyp_6-31g(d).qchem.inp (generated)

047125618.b3lyp_6-31g(d).gjf (generated)

047125618.b3lyp_6-31g(d).firefly.inp (generated)

047125618.b3lyp_6-31g(d).smash.inp (generated)

047125618.b3lyp_6-31g(d).nwchem.inp (generated) 047125618.b3lyp_6-31g(d).log.xz 047125618.mol 047125618.PUBCHEM 047125618.mol (via Jmol)
047125625.b3lyp_6-31g(d).inp

047125625.b3lyp_6-31g(d).qchem.inp (generated)

047125625.b3lyp_6-31g(d).gjf (generated)

047125625.b3lyp_6-31g(d).firefly.inp (generated)

047125625.b3lyp_6-31g(d).smash.inp (generated)

047125625.b3lyp_6-31g(d).nwchem.inp (generated) 047125625.b3lyp_6-31g(d).log.xz 047125625.mol 047125625.PUBCHEM 047125625.mol (via Jmol)
047125653.b3lyp_6-31g(d).inp

047125653.b3lyp_6-31g(d).qchem.inp (generated)

047125653.b3lyp_6-31g(d).gjf (generated)

047125653.b3lyp_6-31g(d).firefly.inp (generated)

047125653.b3lyp_6-31g(d).smash.inp (generated)

047125653.b3lyp_6-31g(d).nwchem.inp (generated) 047125653.b3lyp_6-31g(d).log.xz 047125653.td-b3lyp_6-31g+(d).inp 047125653.td-b3lyp_6-31g+(d).log.xz

047125653.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125653.td-b3lyp_6-31+g(d).gjf (generated)

047125653.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125653.mol 047125653.PUBCHEM 047125653.mol (via Jmol)
047125659.b3lyp_6-31g(d).inp

047125659.b3lyp_6-31g(d).qchem.inp (generated)

047125659.b3lyp_6-31g(d).gjf (generated)

047125659.b3lyp_6-31g(d).firefly.inp (generated)

047125659.b3lyp_6-31g(d).smash.inp (generated)

047125659.b3lyp_6-31g(d).nwchem.inp (generated) 047125659.b3lyp_6-31g(d).log.xz 047125659.td-b3lyp_6-31g+(d).inp 047125659.td-b3lyp_6-31g+(d).log.xz

047125659.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125659.td-b3lyp_6-31+g(d).gjf (generated)

047125659.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125659.mol 047125659.PUBCHEM 047125659.mol (via Jmol)
047125671.b3lyp_6-31g(d).inp

047125671.b3lyp_6-31g(d).qchem.inp (generated)

047125671.b3lyp_6-31g(d).gjf (generated)

047125671.b3lyp_6-31g(d).firefly.inp (generated)

047125671.b3lyp_6-31g(d).smash.inp (generated)

047125671.b3lyp_6-31g(d).nwchem.inp (generated) 047125671.b3lyp_6-31g(d).log.xz 047125671.td-b3lyp_6-31g+(d).inp 047125671.td-b3lyp_6-31g+(d).log.xz

047125671.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125671.td-b3lyp_6-31+g(d).gjf (generated)

047125671.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125671.mol 047125671.PUBCHEM 047125671.mol (via Jmol)
047125695.b3lyp_6-31g(d).inp

047125695.b3lyp_6-31g(d).qchem.inp (generated)

047125695.b3lyp_6-31g(d).gjf (generated)

047125695.b3lyp_6-31g(d).firefly.inp (generated)

047125695.b3lyp_6-31g(d).smash.inp (generated)

047125695.b3lyp_6-31g(d).nwchem.inp (generated) 047125695.b3lyp_6-31g(d).log.xz 047125695.td-b3lyp_6-31g+(d).inp 047125695.td-b3lyp_6-31g+(d).log.xz

047125695.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125695.td-b3lyp_6-31+g(d).gjf (generated)

047125695.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125695.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125695.mol 047125695.PUBCHEM 047125695.mol (via Jmol)
047125723.b3lyp_6-31g(d).inp

047125723.b3lyp_6-31g(d).qchem.inp (generated)

047125723.b3lyp_6-31g(d).gjf (generated)

047125723.b3lyp_6-31g(d).firefly.inp (generated)

047125723.b3lyp_6-31g(d).smash.inp (generated)

047125723.b3lyp_6-31g(d).nwchem.inp (generated) 047125723.b3lyp_6-31g(d).log.xz 047125723.td-b3lyp_6-31g+(d).inp 047125723.td-b3lyp_6-31g+(d).log.xz

047125723.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125723.td-b3lyp_6-31+g(d).gjf (generated)

047125723.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125723.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125723.mol 047125723.PUBCHEM 047125723.mol (via Jmol)
047125731.b3lyp_6-31g(d).inp

047125731.b3lyp_6-31g(d).qchem.inp (generated)

047125731.b3lyp_6-31g(d).gjf (generated)

047125731.b3lyp_6-31g(d).firefly.inp (generated)

047125731.b3lyp_6-31g(d).smash.inp (generated)

047125731.b3lyp_6-31g(d).nwchem.inp (generated) 047125731.b3lyp_6-31g(d).log.xz 047125731.td-b3lyp_6-31g+(d).inp 047125731.td-b3lyp_6-31g+(d).log.xz

047125731.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125731.td-b3lyp_6-31+g(d).gjf (generated)

047125731.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125731.mol 047125731.PUBCHEM 047125731.mol (via Jmol)
047125748.b3lyp_6-31g(d).inp

047125748.b3lyp_6-31g(d).qchem.inp (generated)

047125748.b3lyp_6-31g(d).gjf (generated)

047125748.b3lyp_6-31g(d).firefly.inp (generated)

047125748.b3lyp_6-31g(d).smash.inp (generated)

047125748.b3lyp_6-31g(d).nwchem.inp (generated) 047125748.b3lyp_6-31g(d).log.xz 047125748.td-b3lyp_6-31g+(d).inp 047125748.td-b3lyp_6-31g+(d).log.xz

047125748.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125748.td-b3lyp_6-31+g(d).gjf (generated)

047125748.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125748.mol 047125748.PUBCHEM 047125748.mol (via Jmol)
047125749.b3lyp_6-31g(d).inp

047125749.b3lyp_6-31g(d).qchem.inp (generated)

047125749.b3lyp_6-31g(d).gjf (generated)

047125749.b3lyp_6-31g(d).firefly.inp (generated)

047125749.b3lyp_6-31g(d).smash.inp (generated)

047125749.b3lyp_6-31g(d).nwchem.inp (generated) 047125749.b3lyp_6-31g(d).log.xz 047125749.td-b3lyp_6-31g+(d).inp 047125749.td-b3lyp_6-31g+(d).log.xz

047125749.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125749.td-b3lyp_6-31+g(d).gjf (generated)

047125749.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125749.mol 047125749.PUBCHEM 047125749.mol (via Jmol)
047125750.b3lyp_6-31g(d).inp

047125750.b3lyp_6-31g(d).qchem.inp (generated)

047125750.b3lyp_6-31g(d).gjf (generated)

047125750.b3lyp_6-31g(d).firefly.inp (generated)

047125750.b3lyp_6-31g(d).smash.inp (generated)

047125750.b3lyp_6-31g(d).nwchem.inp (generated) 047125750.b3lyp_6-31g(d).log.xz 047125750.td-b3lyp_6-31g+(d).inp 047125750.td-b3lyp_6-31g+(d).log.xz

047125750.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125750.td-b3lyp_6-31+g(d).gjf (generated)

047125750.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125750.mol 047125750.PUBCHEM 047125750.mol (via Jmol)
047125751.b3lyp_6-31g(d).inp

047125751.b3lyp_6-31g(d).qchem.inp (generated)

047125751.b3lyp_6-31g(d).gjf (generated)

047125751.b3lyp_6-31g(d).firefly.inp (generated)

047125751.b3lyp_6-31g(d).smash.inp (generated)

047125751.b3lyp_6-31g(d).nwchem.inp (generated) 047125751.b3lyp_6-31g(d).log.xz 047125751.td-b3lyp_6-31g+(d).inp 047125751.td-b3lyp_6-31g+(d).log.xz

047125751.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125751.td-b3lyp_6-31+g(d).gjf (generated)

047125751.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125751.mol 047125751.PUBCHEM 047125751.mol (via Jmol)
047125788.b3lyp_6-31g(d).inp

047125788.b3lyp_6-31g(d).qchem.inp (generated)

047125788.b3lyp_6-31g(d).gjf (generated)

047125788.b3lyp_6-31g(d).firefly.inp (generated)

047125788.b3lyp_6-31g(d).smash.inp (generated)

047125788.b3lyp_6-31g(d).nwchem.inp (generated) 047125788.b3lyp_6-31g(d).log.xz 047125788.td-b3lyp_6-31g+(d).inp 047125788.td-b3lyp_6-31g+(d).log.xz

047125788.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125788.td-b3lyp_6-31+g(d).gjf (generated)

047125788.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125788.mol 047125788.PUBCHEM 047125788.mol (via Jmol)
047125797.b3lyp_6-31g(d).inp

047125797.b3lyp_6-31g(d).qchem.inp (generated)

047125797.b3lyp_6-31g(d).gjf (generated)

047125797.b3lyp_6-31g(d).firefly.inp (generated)

047125797.b3lyp_6-31g(d).smash.inp (generated)

047125797.b3lyp_6-31g(d).nwchem.inp (generated) 047125797.b3lyp_6-31g(d).log.xz 047125797.td-b3lyp_6-31g+(d).inp 047125797.td-b3lyp_6-31g+(d).log.xz

047125797.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125797.td-b3lyp_6-31+g(d).gjf (generated)

047125797.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125797.mol 047125797.PUBCHEM 047125797.mol (via Jmol)
047125822.b3lyp_6-31g(d).inp

047125822.b3lyp_6-31g(d).qchem.inp (generated)

047125822.b3lyp_6-31g(d).gjf (generated)

047125822.b3lyp_6-31g(d).firefly.inp (generated)

047125822.b3lyp_6-31g(d).smash.inp (generated)

047125822.b3lyp_6-31g(d).nwchem.inp (generated) 047125822.b3lyp_6-31g(d).log.xz 047125822.td-b3lyp_6-31g+(d).inp 047125822.td-b3lyp_6-31g+(d).log.xz

047125822.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125822.td-b3lyp_6-31+g(d).gjf (generated)

047125822.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125822.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125822.mol 047125822.PUBCHEM 047125822.mol (via Jmol)
047125832.b3lyp_6-31g(d).inp

047125832.b3lyp_6-31g(d).qchem.inp (generated)

047125832.b3lyp_6-31g(d).gjf (generated)

047125832.b3lyp_6-31g(d).firefly.inp (generated)

047125832.b3lyp_6-31g(d).smash.inp (generated)

047125832.b3lyp_6-31g(d).nwchem.inp (generated) 047125832.b3lyp_6-31g(d).log.xz 047125832.mol 047125832.PUBCHEM 047125832.mol (via Jmol)
047125833.b3lyp_6-31g(d).inp

047125833.b3lyp_6-31g(d).qchem.inp (generated)

047125833.b3lyp_6-31g(d).gjf (generated)

047125833.b3lyp_6-31g(d).firefly.inp (generated)

047125833.b3lyp_6-31g(d).smash.inp (generated)

047125833.b3lyp_6-31g(d).nwchem.inp (generated) 047125833.b3lyp_6-31g(d).log.xz 047125833.mol 047125833.PUBCHEM 047125833.mol (via Jmol)
047125841.b3lyp_6-31g(d).inp

047125841.b3lyp_6-31g(d).qchem.inp (generated)

047125841.b3lyp_6-31g(d).gjf (generated)

047125841.b3lyp_6-31g(d).firefly.inp (generated)

047125841.b3lyp_6-31g(d).smash.inp (generated)

047125841.b3lyp_6-31g(d).nwchem.inp (generated) 047125841.b3lyp_6-31g(d).log.xz 047125841.td-b3lyp_6-31g+(d).inp 047125841.td-b3lyp_6-31g+(d).log.xz

047125841.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125841.td-b3lyp_6-31+g(d).gjf (generated)

047125841.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125841.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125841.mol 047125841.PUBCHEM 047125841.mol (via Jmol)
047125876.b3lyp_6-31g(d).inp

047125876.b3lyp_6-31g(d).qchem.inp (generated)

047125876.b3lyp_6-31g(d).gjf (generated)

047125876.b3lyp_6-31g(d).firefly.inp (generated)

047125876.b3lyp_6-31g(d).smash.inp (generated)

047125876.b3lyp_6-31g(d).nwchem.inp (generated) 047125876.b3lyp_6-31g(d).log.xz 047125876.mol 047125876.PUBCHEM 047125876.mol (via Jmol)
047125900.b3lyp_6-31g(d).inp

047125900.b3lyp_6-31g(d).qchem.inp (generated)

047125900.b3lyp_6-31g(d).gjf (generated)

047125900.b3lyp_6-31g(d).firefly.inp (generated)

047125900.b3lyp_6-31g(d).smash.inp (generated)

047125900.b3lyp_6-31g(d).nwchem.inp (generated) 047125900.b3lyp_6-31g(d).log.xz 047125900.td-b3lyp_6-31g+(d).inp 047125900.td-b3lyp_6-31g+(d).log.xz

047125900.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125900.td-b3lyp_6-31+g(d).gjf (generated)

047125900.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125900.mol 047125900.PUBCHEM 047125900.mol (via Jmol)
047125915.b3lyp_6-31g(d).inp

047125915.b3lyp_6-31g(d).qchem.inp (generated)

047125915.b3lyp_6-31g(d).gjf (generated)

047125915.b3lyp_6-31g(d).firefly.inp (generated)

047125915.b3lyp_6-31g(d).smash.inp (generated)

047125915.b3lyp_6-31g(d).nwchem.inp (generated) 047125915.b3lyp_6-31g(d).log.xz 047125915.td-b3lyp_6-31g+(d).inp 047125915.td-b3lyp_6-31g+(d).log.xz

047125915.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125915.td-b3lyp_6-31+g(d).gjf (generated)

047125915.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125915.mol 047125915.PUBCHEM 047125915.mol (via Jmol)
047125916.b3lyp_6-31g(d).inp

047125916.b3lyp_6-31g(d).qchem.inp (generated)

047125916.b3lyp_6-31g(d).gjf (generated)

047125916.b3lyp_6-31g(d).firefly.inp (generated)

047125916.b3lyp_6-31g(d).smash.inp (generated)

047125916.b3lyp_6-31g(d).nwchem.inp (generated) 047125916.b3lyp_6-31g(d).log.xz 047125916.td-b3lyp_6-31g+(d).inp 047125916.td-b3lyp_6-31g+(d).log.xz

047125916.td-b3lyp_6-31+g(d).qchem.inp (generated)

047125916.td-b3lyp_6-31+g(d).gjf (generated)

047125916.td-b3lyp_6-31+g(d).firefly.inp (generated)

047125916.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047125916.mol 047125916.PUBCHEM 047125916.mol (via Jmol)
047126003.b3lyp_6-31g(d).inp

047126003.b3lyp_6-31g(d).qchem.inp (generated)

047126003.b3lyp_6-31g(d).gjf (generated)

047126003.b3lyp_6-31g(d).firefly.inp (generated)

047126003.b3lyp_6-31g(d).smash.inp (generated)

047126003.b3lyp_6-31g(d).nwchem.inp (generated) 047126003.b3lyp_6-31g(d).log.xz 047126003.mol 047126003.PUBCHEM 047126003.mol (via Jmol)
047126005.b3lyp_6-31g(d).inp

047126005.b3lyp_6-31g(d).qchem.inp (generated)

047126005.b3lyp_6-31g(d).gjf (generated)

047126005.b3lyp_6-31g(d).firefly.inp (generated)

047126005.b3lyp_6-31g(d).smash.inp (generated)

047126005.b3lyp_6-31g(d).nwchem.inp (generated) 047126005.b3lyp_6-31g(d).log.xz 047126005.mol 047126005.PUBCHEM 047126005.mol (via Jmol)
047126051.b3lyp_6-31g(d).inp

047126051.b3lyp_6-31g(d).qchem.inp (generated)

047126051.b3lyp_6-31g(d).gjf (generated)

047126051.b3lyp_6-31g(d).firefly.inp (generated)

047126051.b3lyp_6-31g(d).smash.inp (generated)

047126051.b3lyp_6-31g(d).nwchem.inp (generated) 047126051.b3lyp_6-31g(d).log.xz 047126051.td-b3lyp_6-31g+(d).inp 047126051.td-b3lyp_6-31g+(d).log.xz

047126051.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126051.td-b3lyp_6-31+g(d).gjf (generated)

047126051.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126051.mol 047126051.PUBCHEM 047126051.mol (via Jmol)
047126063.b3lyp_6-31g(d).inp

047126063.b3lyp_6-31g(d).qchem.inp (generated)

047126063.b3lyp_6-31g(d).gjf (generated)

047126063.b3lyp_6-31g(d).firefly.inp (generated)

047126063.b3lyp_6-31g(d).smash.inp (generated)

047126063.b3lyp_6-31g(d).nwchem.inp (generated) 047126063.b3lyp_6-31g(d).log.xz 047126063.td-b3lyp_6-31g+(d).inp 047126063.td-b3lyp_6-31g+(d).log.xz

047126063.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126063.td-b3lyp_6-31+g(d).gjf (generated)

047126063.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126063.mol 047126063.PUBCHEM 047126063.mol (via Jmol)
047126113.b3lyp_6-31g(d).inp

047126113.b3lyp_6-31g(d).qchem.inp (generated)

047126113.b3lyp_6-31g(d).gjf (generated)

047126113.b3lyp_6-31g(d).firefly.inp (generated)

047126113.b3lyp_6-31g(d).smash.inp (generated)

047126113.b3lyp_6-31g(d).nwchem.inp (generated) 047126113.b3lyp_6-31g(d).log.xz 047126113.td-b3lyp_6-31g+(d).inp 047126113.td-b3lyp_6-31g+(d).log.xz

047126113.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126113.td-b3lyp_6-31+g(d).gjf (generated)

047126113.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126113.mol 047126113.PUBCHEM 047126113.mol (via Jmol)
047126122.b3lyp_6-31g(d).inp

047126122.b3lyp_6-31g(d).qchem.inp (generated)

047126122.b3lyp_6-31g(d).gjf (generated)

047126122.b3lyp_6-31g(d).firefly.inp (generated)

047126122.b3lyp_6-31g(d).smash.inp (generated)

047126122.b3lyp_6-31g(d).nwchem.inp (generated) 047126122.b3lyp_6-31g(d).log.xz 047126122.td-b3lyp_6-31g+(d).inp 047126122.td-b3lyp_6-31g+(d).log.xz

047126122.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126122.td-b3lyp_6-31+g(d).gjf (generated)

047126122.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126122.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126122.mol 047126122.PUBCHEM 047126122.mol (via Jmol)
047126130.b3lyp_6-31g(d).inp

047126130.b3lyp_6-31g(d).qchem.inp (generated)

047126130.b3lyp_6-31g(d).gjf (generated)

047126130.b3lyp_6-31g(d).firefly.inp (generated)

047126130.b3lyp_6-31g(d).smash.inp (generated)

047126130.b3lyp_6-31g(d).nwchem.inp (generated) 047126130.b3lyp_6-31g(d).log.xz 047126130.mol 047126130.PUBCHEM 047126130.mol (via Jmol)
047126134.b3lyp_6-31g(d).inp

047126134.b3lyp_6-31g(d).qchem.inp (generated)

047126134.b3lyp_6-31g(d).gjf (generated)

047126134.b3lyp_6-31g(d).firefly.inp (generated)

047126134.b3lyp_6-31g(d).smash.inp (generated)

047126134.b3lyp_6-31g(d).nwchem.inp (generated) 047126134.b3lyp_6-31g(d).log.xz 047126134.mol 047126134.PUBCHEM 047126134.mol (via Jmol)
047126140.b3lyp_6-31g(d).inp

047126140.b3lyp_6-31g(d).qchem.inp (generated)

047126140.b3lyp_6-31g(d).gjf (generated)

047126140.b3lyp_6-31g(d).firefly.inp (generated)

047126140.b3lyp_6-31g(d).smash.inp (generated)

047126140.b3lyp_6-31g(d).nwchem.inp (generated) 047126140.b3lyp_6-31g(d).log.xz 047126140.td-b3lyp_6-31g+(d).inp 047126140.td-b3lyp_6-31g+(d).log.xz

047126140.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126140.td-b3lyp_6-31+g(d).gjf (generated)

047126140.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126140.mol 047126140.PUBCHEM 047126140.mol (via Jmol)
047126175.b3lyp_6-31g(d).inp

047126175.b3lyp_6-31g(d).qchem.inp (generated)

047126175.b3lyp_6-31g(d).gjf (generated)

047126175.b3lyp_6-31g(d).firefly.inp (generated)

047126175.b3lyp_6-31g(d).smash.inp (generated)

047126175.b3lyp_6-31g(d).nwchem.inp (generated) 047126175.b3lyp_6-31g(d).log.xz 047126175.td-b3lyp_6-31g+(d).inp 047126175.td-b3lyp_6-31g+(d).log.xz

047126175.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126175.td-b3lyp_6-31+g(d).gjf (generated)

047126175.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126175.mol 047126175.PUBCHEM 047126175.mol (via Jmol)
047126228.b3lyp_6-31g(d).inp

047126228.b3lyp_6-31g(d).qchem.inp (generated)

047126228.b3lyp_6-31g(d).gjf (generated)

047126228.b3lyp_6-31g(d).firefly.inp (generated)

047126228.b3lyp_6-31g(d).smash.inp (generated)

047126228.b3lyp_6-31g(d).nwchem.inp (generated) 047126228.b3lyp_6-31g(d).log.xz 047126228.td-b3lyp_6-31g+(d).inp 047126228.td-b3lyp_6-31g+(d).log.xz

047126228.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126228.td-b3lyp_6-31+g(d).gjf (generated)

047126228.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126228.mol 047126228.PUBCHEM 047126228.mol (via Jmol)
047126414.b3lyp_6-31g(d).inp

047126414.b3lyp_6-31g(d).qchem.inp (generated)

047126414.b3lyp_6-31g(d).gjf (generated)

047126414.b3lyp_6-31g(d).firefly.inp (generated)

047126414.b3lyp_6-31g(d).smash.inp (generated)

047126414.b3lyp_6-31g(d).nwchem.inp (generated) 047126414.b3lyp_6-31g(d).log.xz 047126414.td-b3lyp_6-31g+(d).inp 047126414.td-b3lyp_6-31g+(d).log.xz

047126414.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126414.td-b3lyp_6-31+g(d).gjf (generated)

047126414.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126414.mol 047126414.PUBCHEM 047126414.mol (via Jmol)
047126418.b3lyp_6-31g(d).inp

047126418.b3lyp_6-31g(d).qchem.inp (generated)

047126418.b3lyp_6-31g(d).gjf (generated)

047126418.b3lyp_6-31g(d).firefly.inp (generated)

047126418.b3lyp_6-31g(d).smash.inp (generated)

047126418.b3lyp_6-31g(d).nwchem.inp (generated) 047126418.b3lyp_6-31g(d).log.xz 047126418.td-b3lyp_6-31g+(d).inp 047126418.td-b3lyp_6-31g+(d).log.xz

047126418.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126418.td-b3lyp_6-31+g(d).gjf (generated)

047126418.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126418.mol 047126418.PUBCHEM 047126418.mol (via Jmol)
047126466.b3lyp_6-31g(d).inp

047126466.b3lyp_6-31g(d).qchem.inp (generated)

047126466.b3lyp_6-31g(d).gjf (generated)

047126466.b3lyp_6-31g(d).firefly.inp (generated)

047126466.b3lyp_6-31g(d).smash.inp (generated)

047126466.b3lyp_6-31g(d).nwchem.inp (generated) 047126466.b3lyp_6-31g(d).log.xz 047126466.td-b3lyp_6-31g+(d).inp 047126466.td-b3lyp_6-31g+(d).log.xz

047126466.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126466.td-b3lyp_6-31+g(d).gjf (generated)

047126466.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126466.mol 047126466.PUBCHEM 047126466.mol (via Jmol)
047126475.b3lyp_6-31g(d).inp

047126475.b3lyp_6-31g(d).qchem.inp (generated)

047126475.b3lyp_6-31g(d).gjf (generated)

047126475.b3lyp_6-31g(d).firefly.inp (generated)

047126475.b3lyp_6-31g(d).smash.inp (generated)

047126475.b3lyp_6-31g(d).nwchem.inp (generated) 047126475.b3lyp_6-31g(d).log.xz 047126475.mol 047126475.PUBCHEM 047126475.mol (via Jmol)
047126499.b3lyp_6-31g(d).inp

047126499.b3lyp_6-31g(d).qchem.inp (generated)

047126499.b3lyp_6-31g(d).gjf (generated)

047126499.b3lyp_6-31g(d).firefly.inp (generated)

047126499.b3lyp_6-31g(d).smash.inp (generated)

047126499.b3lyp_6-31g(d).nwchem.inp (generated) 047126499.b3lyp_6-31g(d).log.xz 047126499.td-b3lyp_6-31g+(d).inp 047126499.td-b3lyp_6-31g+(d).log.xz

047126499.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126499.td-b3lyp_6-31+g(d).gjf (generated)

047126499.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126499.mol 047126499.PUBCHEM 047126499.mol (via Jmol)
047126507.b3lyp_6-31g(d).inp

047126507.b3lyp_6-31g(d).qchem.inp (generated)

047126507.b3lyp_6-31g(d).gjf (generated)

047126507.b3lyp_6-31g(d).firefly.inp (generated)

047126507.b3lyp_6-31g(d).smash.inp (generated)

047126507.b3lyp_6-31g(d).nwchem.inp (generated) 047126507.b3lyp_6-31g(d).log.xz 047126507.td-b3lyp_6-31g+(d).inp 047126507.td-b3lyp_6-31g+(d).log.xz

047126507.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126507.td-b3lyp_6-31+g(d).gjf (generated)

047126507.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126507.mol 047126507.PUBCHEM 047126507.mol (via Jmol)
047126548.b3lyp_6-31g(d).inp

047126548.b3lyp_6-31g(d).qchem.inp (generated)

047126548.b3lyp_6-31g(d).gjf (generated)

047126548.b3lyp_6-31g(d).firefly.inp (generated)

047126548.b3lyp_6-31g(d).smash.inp (generated)

047126548.b3lyp_6-31g(d).nwchem.inp (generated) 047126548.b3lyp_6-31g(d).log.xz 047126548.td-b3lyp_6-31g+(d).inp 047126548.td-b3lyp_6-31g+(d).log.xz

047126548.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126548.td-b3lyp_6-31+g(d).gjf (generated)

047126548.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126548.mol 047126548.PUBCHEM 047126548.mol (via Jmol)
047126555.b3lyp_6-31g(d).inp

047126555.b3lyp_6-31g(d).qchem.inp (generated)

047126555.b3lyp_6-31g(d).gjf (generated)

047126555.b3lyp_6-31g(d).firefly.inp (generated)

047126555.b3lyp_6-31g(d).smash.inp (generated)

047126555.b3lyp_6-31g(d).nwchem.inp (generated) 047126555.b3lyp_6-31g(d).log.xz 047126555.mol 047126555.PUBCHEM 047126555.mol (via Jmol)
047126562.b3lyp_6-31g(d).inp

047126562.b3lyp_6-31g(d).qchem.inp (generated)

047126562.b3lyp_6-31g(d).gjf (generated)

047126562.b3lyp_6-31g(d).firefly.inp (generated)

047126562.b3lyp_6-31g(d).smash.inp (generated)

047126562.b3lyp_6-31g(d).nwchem.inp (generated) 047126562.b3lyp_6-31g(d).log.xz 047126562.td-b3lyp_6-31g+(d).inp 047126562.td-b3lyp_6-31g+(d).log.xz

047126562.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126562.td-b3lyp_6-31+g(d).gjf (generated)

047126562.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126562.mol 047126562.PUBCHEM 047126562.mol (via Jmol)
047126573.b3lyp_6-31g(d).inp

047126573.b3lyp_6-31g(d).qchem.inp (generated)

047126573.b3lyp_6-31g(d).gjf (generated)

047126573.b3lyp_6-31g(d).firefly.inp (generated)

047126573.b3lyp_6-31g(d).smash.inp (generated)

047126573.b3lyp_6-31g(d).nwchem.inp (generated) 047126573.b3lyp_6-31g(d).log.xz 047126573.mol 047126573.PUBCHEM 047126573.mol (via Jmol)
047126578.b3lyp_6-31g(d).inp

047126578.b3lyp_6-31g(d).qchem.inp (generated)

047126578.b3lyp_6-31g(d).gjf (generated)

047126578.b3lyp_6-31g(d).firefly.inp (generated)

047126578.b3lyp_6-31g(d).smash.inp (generated)

047126578.b3lyp_6-31g(d).nwchem.inp (generated) 047126578.b3lyp_6-31g(d).log.xz 047126578.mol 047126578.PUBCHEM 047126578.mol (via Jmol)
047126606.b3lyp_6-31g(d).inp

047126606.b3lyp_6-31g(d).qchem.inp (generated)

047126606.b3lyp_6-31g(d).gjf (generated)

047126606.b3lyp_6-31g(d).firefly.inp (generated)

047126606.b3lyp_6-31g(d).smash.inp (generated)

047126606.b3lyp_6-31g(d).nwchem.inp (generated) 047126606.b3lyp_6-31g(d).log.xz 047126606.td-b3lyp_6-31g+(d).inp 047126606.td-b3lyp_6-31g+(d).log.xz

047126606.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126606.td-b3lyp_6-31+g(d).gjf (generated)

047126606.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126606.mol 047126606.PUBCHEM 047126606.mol (via Jmol)
047126625.b3lyp_6-31g(d).inp

047126625.b3lyp_6-31g(d).qchem.inp (generated)

047126625.b3lyp_6-31g(d).gjf (generated)

047126625.b3lyp_6-31g(d).firefly.inp (generated)

047126625.b3lyp_6-31g(d).smash.inp (generated)

047126625.b3lyp_6-31g(d).nwchem.inp (generated) 047126625.b3lyp_6-31g(d).log.xz 047126625.td-b3lyp_6-31g+(d).inp 047126625.td-b3lyp_6-31g+(d).log.xz

047126625.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126625.td-b3lyp_6-31+g(d).gjf (generated)

047126625.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126625.mol 047126625.PUBCHEM 047126625.mol (via Jmol)
047126634.b3lyp_6-31g(d).inp

047126634.b3lyp_6-31g(d).qchem.inp (generated)

047126634.b3lyp_6-31g(d).gjf (generated)

047126634.b3lyp_6-31g(d).firefly.inp (generated)

047126634.b3lyp_6-31g(d).smash.inp (generated)

047126634.b3lyp_6-31g(d).nwchem.inp (generated) 047126634.b3lyp_6-31g(d).log.xz 047126634.td-b3lyp_6-31g+(d).inp 047126634.td-b3lyp_6-31g+(d).log.xz

047126634.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126634.td-b3lyp_6-31+g(d).gjf (generated)

047126634.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126634.mol 047126634.PUBCHEM 047126634.mol (via Jmol)
047126728.b3lyp_6-31g(d).inp

047126728.b3lyp_6-31g(d).qchem.inp (generated)

047126728.b3lyp_6-31g(d).gjf (generated)

047126728.b3lyp_6-31g(d).firefly.inp (generated)

047126728.b3lyp_6-31g(d).smash.inp (generated)

047126728.b3lyp_6-31g(d).nwchem.inp (generated) 047126728.b3lyp_6-31g(d).log.xz 047126728.td-b3lyp_6-31g+(d).inp 047126728.td-b3lyp_6-31g+(d).log.xz

047126728.td-b3lyp_6-31+g(d).qchem.inp (generated)

047126728.td-b3lyp_6-31+g(d).gjf (generated)

047126728.td-b3lyp_6-31+g(d).firefly.inp (generated)

047126728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047126728.mol 047126728.PUBCHEM 047126728.mol (via Jmol)
047126732.b3lyp_6-31g(d).inp

047126732.b3lyp_6-31g(d).qchem.inp (generated)

047126732.b3lyp_6-31g(d).gjf (generated)

047126732.b3lyp_6-31g(d).firefly.inp (generated)

047126732.b3lyp_6-31g(d).smash.inp (generated)

047126732.b3lyp_6-31g(d).nwchem.inp (generated) 047126732.b3lyp_6-31g(d).log.xz 047126732.mol 047126732.PUBCHEM 047126732.mol (via Jmol)
047127087.b3lyp_6-31g(d).inp

047127087.b3lyp_6-31g(d).qchem.inp (generated)

047127087.b3lyp_6-31g(d).gjf (generated)

047127087.b3lyp_6-31g(d).firefly.inp (generated)

047127087.b3lyp_6-31g(d).smash.inp (generated)

047127087.b3lyp_6-31g(d).nwchem.inp (generated) 047127087.b3lyp_6-31g(d).log.xz 047127087.td-b3lyp_6-31g+(d).inp 047127087.td-b3lyp_6-31g+(d).log.xz

047127087.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127087.td-b3lyp_6-31+g(d).gjf (generated)

047127087.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127087.mol 047127087.PUBCHEM 047127087.mol (via Jmol)
047127181.b3lyp_6-31g(d).inp

047127181.b3lyp_6-31g(d).qchem.inp (generated)

047127181.b3lyp_6-31g(d).gjf (generated)

047127181.b3lyp_6-31g(d).firefly.inp (generated)

047127181.b3lyp_6-31g(d).smash.inp (generated)

047127181.b3lyp_6-31g(d).nwchem.inp (generated) 047127181.b3lyp_6-31g(d).log.xz 047127181.td-b3lyp_6-31g+(d).inp 047127181.td-b3lyp_6-31g+(d).log.xz

047127181.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127181.td-b3lyp_6-31+g(d).gjf (generated)

047127181.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127181.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127181.mol 047127181.PUBCHEM 047127181.mol (via Jmol)
047127186.b3lyp_6-31g(d).inp

047127186.b3lyp_6-31g(d).qchem.inp (generated)

047127186.b3lyp_6-31g(d).gjf (generated)

047127186.b3lyp_6-31g(d).firefly.inp (generated)

047127186.b3lyp_6-31g(d).smash.inp (generated)

047127186.b3lyp_6-31g(d).nwchem.inp (generated) 047127186.b3lyp_6-31g(d).log.xz 047127186.td-b3lyp_6-31g+(d).inp 047127186.td-b3lyp_6-31g+(d).log.xz

047127186.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127186.td-b3lyp_6-31+g(d).gjf (generated)

047127186.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127186.mol 047127186.PUBCHEM 047127186.mol (via Jmol)
047127214.b3lyp_6-31g(d).inp

047127214.b3lyp_6-31g(d).qchem.inp (generated)

047127214.b3lyp_6-31g(d).gjf (generated)

047127214.b3lyp_6-31g(d).firefly.inp (generated)

047127214.b3lyp_6-31g(d).smash.inp (generated)

047127214.b3lyp_6-31g(d).nwchem.inp (generated) 047127214.b3lyp_6-31g(d).log.xz 047127214.mol 047127214.PUBCHEM 047127214.mol (via Jmol)
047127271.b3lyp_6-31g(d).inp

047127271.b3lyp_6-31g(d).qchem.inp (generated)

047127271.b3lyp_6-31g(d).gjf (generated)

047127271.b3lyp_6-31g(d).firefly.inp (generated)

047127271.b3lyp_6-31g(d).smash.inp (generated)

047127271.b3lyp_6-31g(d).nwchem.inp (generated) 047127271.b3lyp_6-31g(d).log.xz 047127271.td-b3lyp_6-31g+(d).inp 047127271.td-b3lyp_6-31g+(d).log.xz

047127271.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127271.td-b3lyp_6-31+g(d).gjf (generated)

047127271.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127271.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127271.mol 047127271.PUBCHEM 047127271.mol (via Jmol)
047127291.b3lyp_6-31g(d).inp

047127291.b3lyp_6-31g(d).qchem.inp (generated)

047127291.b3lyp_6-31g(d).gjf (generated)

047127291.b3lyp_6-31g(d).firefly.inp (generated)

047127291.b3lyp_6-31g(d).smash.inp (generated)

047127291.b3lyp_6-31g(d).nwchem.inp (generated) 047127291.b3lyp_6-31g(d).log.xz 047127291.td-b3lyp_6-31g+(d).inp 047127291.td-b3lyp_6-31g+(d).log.xz

047127291.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127291.td-b3lyp_6-31+g(d).gjf (generated)

047127291.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127291.mol 047127291.PUBCHEM 047127291.mol (via Jmol)
047127300.b3lyp_6-31g(d).inp

047127300.b3lyp_6-31g(d).qchem.inp (generated)

047127300.b3lyp_6-31g(d).gjf (generated)

047127300.b3lyp_6-31g(d).firefly.inp (generated)

047127300.b3lyp_6-31g(d).smash.inp (generated)

047127300.b3lyp_6-31g(d).nwchem.inp (generated) 047127300.b3lyp_6-31g(d).log.xz 047127300.mol 047127300.PUBCHEM 047127300.mol (via Jmol)
047127303.b3lyp_6-31g(d).inp

047127303.b3lyp_6-31g(d).qchem.inp (generated)

047127303.b3lyp_6-31g(d).gjf (generated)

047127303.b3lyp_6-31g(d).firefly.inp (generated)

047127303.b3lyp_6-31g(d).smash.inp (generated)

047127303.b3lyp_6-31g(d).nwchem.inp (generated) 047127303.b3lyp_6-31g(d).log.xz 047127303.td-b3lyp_6-31g+(d).inp 047127303.td-b3lyp_6-31g+(d).log.xz

047127303.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127303.td-b3lyp_6-31+g(d).gjf (generated)

047127303.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127303.mol 047127303.PUBCHEM 047127303.mol (via Jmol)
047127341.b3lyp_6-31g(d).inp

047127341.b3lyp_6-31g(d).qchem.inp (generated)

047127341.b3lyp_6-31g(d).gjf (generated)

047127341.b3lyp_6-31g(d).firefly.inp (generated)

047127341.b3lyp_6-31g(d).smash.inp (generated)

047127341.b3lyp_6-31g(d).nwchem.inp (generated) 047127341.b3lyp_6-31g(d).log.xz 047127341.td-b3lyp_6-31g+(d).inp 047127341.td-b3lyp_6-31g+(d).log.xz

047127341.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127341.td-b3lyp_6-31+g(d).gjf (generated)

047127341.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127341.mol 047127341.PUBCHEM 047127341.mol (via Jmol)
047127342.b3lyp_6-31g(d).inp

047127342.b3lyp_6-31g(d).qchem.inp (generated)

047127342.b3lyp_6-31g(d).gjf (generated)

047127342.b3lyp_6-31g(d).firefly.inp (generated)

047127342.b3lyp_6-31g(d).smash.inp (generated)

047127342.b3lyp_6-31g(d).nwchem.inp (generated) 047127342.b3lyp_6-31g(d).log.xz 047127342.td-b3lyp_6-31g+(d).inp 047127342.td-b3lyp_6-31g+(d).log.xz

047127342.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127342.td-b3lyp_6-31+g(d).gjf (generated)

047127342.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127342.mol 047127342.PUBCHEM 047127342.mol (via Jmol)
047127351.b3lyp_6-31g(d).inp

047127351.b3lyp_6-31g(d).qchem.inp (generated)

047127351.b3lyp_6-31g(d).gjf (generated)

047127351.b3lyp_6-31g(d).firefly.inp (generated)

047127351.b3lyp_6-31g(d).smash.inp (generated)

047127351.b3lyp_6-31g(d).nwchem.inp (generated) 047127351.b3lyp_6-31g(d).log.xz 047127351.td-b3lyp_6-31g+(d).inp 047127351.td-b3lyp_6-31g+(d).log.xz

047127351.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127351.td-b3lyp_6-31+g(d).gjf (generated)

047127351.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127351.mol 047127351.PUBCHEM 047127351.mol (via Jmol)
047127357.b3lyp_6-31g(d).inp

047127357.b3lyp_6-31g(d).qchem.inp (generated)

047127357.b3lyp_6-31g(d).gjf (generated)

047127357.b3lyp_6-31g(d).firefly.inp (generated)

047127357.b3lyp_6-31g(d).smash.inp (generated)

047127357.b3lyp_6-31g(d).nwchem.inp (generated) 047127357.b3lyp_6-31g(d).log.xz 047127357.mol 047127357.PUBCHEM 047127357.mol (via Jmol)
047127362.b3lyp_6-31g(d).inp

047127362.b3lyp_6-31g(d).qchem.inp (generated)

047127362.b3lyp_6-31g(d).gjf (generated)

047127362.b3lyp_6-31g(d).firefly.inp (generated)

047127362.b3lyp_6-31g(d).smash.inp (generated)

047127362.b3lyp_6-31g(d).nwchem.inp (generated) 047127362.b3lyp_6-31g(d).log.xz 047127362.td-b3lyp_6-31g+(d).inp 047127362.td-b3lyp_6-31g+(d).log.xz

047127362.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127362.td-b3lyp_6-31+g(d).gjf (generated)

047127362.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127362.mol 047127362.PUBCHEM 047127362.mol (via Jmol)
047127366.b3lyp_6-31g(d).inp

047127366.b3lyp_6-31g(d).qchem.inp (generated)

047127366.b3lyp_6-31g(d).gjf (generated)

047127366.b3lyp_6-31g(d).firefly.inp (generated)

047127366.b3lyp_6-31g(d).smash.inp (generated)

047127366.b3lyp_6-31g(d).nwchem.inp (generated) 047127366.b3lyp_6-31g(d).log.xz 047127366.td-b3lyp_6-31g+(d).inp 047127366.td-b3lyp_6-31g+(d).log.xz

047127366.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127366.td-b3lyp_6-31+g(d).gjf (generated)

047127366.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127366.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127366.mol 047127366.PUBCHEM 047127366.mol (via Jmol)
047127371.b3lyp_6-31g(d).inp

047127371.b3lyp_6-31g(d).qchem.inp (generated)

047127371.b3lyp_6-31g(d).gjf (generated)

047127371.b3lyp_6-31g(d).firefly.inp (generated)

047127371.b3lyp_6-31g(d).smash.inp (generated)

047127371.b3lyp_6-31g(d).nwchem.inp (generated) 047127371.b3lyp_6-31g(d).log.xz 047127371.td-b3lyp_6-31g+(d).inp 047127371.td-b3lyp_6-31g+(d).log.xz

047127371.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127371.td-b3lyp_6-31+g(d).gjf (generated)

047127371.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127371.mol 047127371.PUBCHEM 047127371.mol (via Jmol)
047127374.b3lyp_6-31g(d).inp

047127374.b3lyp_6-31g(d).qchem.inp (generated)

047127374.b3lyp_6-31g(d).gjf (generated)

047127374.b3lyp_6-31g(d).firefly.inp (generated)

047127374.b3lyp_6-31g(d).smash.inp (generated)

047127374.b3lyp_6-31g(d).nwchem.inp (generated) 047127374.b3lyp_6-31g(d).log.xz 047127374.mol 047127374.PUBCHEM 047127374.mol (via Jmol)
047127375.b3lyp_6-31g(d).inp

047127375.b3lyp_6-31g(d).qchem.inp (generated)

047127375.b3lyp_6-31g(d).gjf (generated)

047127375.b3lyp_6-31g(d).firefly.inp (generated)

047127375.b3lyp_6-31g(d).smash.inp (generated)

047127375.b3lyp_6-31g(d).nwchem.inp (generated) 047127375.b3lyp_6-31g(d).log.xz 047127375.td-b3lyp_6-31g+(d).inp 047127375.td-b3lyp_6-31g+(d).log.xz

047127375.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127375.td-b3lyp_6-31+g(d).gjf (generated)

047127375.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127375.mol 047127375.PUBCHEM 047127375.mol (via Jmol)
047127378.b3lyp_6-31g(d).inp

047127378.b3lyp_6-31g(d).qchem.inp (generated)

047127378.b3lyp_6-31g(d).gjf (generated)

047127378.b3lyp_6-31g(d).firefly.inp (generated)

047127378.b3lyp_6-31g(d).smash.inp (generated)

047127378.b3lyp_6-31g(d).nwchem.inp (generated) 047127378.b3lyp_6-31g(d).log.xz 047127378.td-b3lyp_6-31g+(d).inp 047127378.td-b3lyp_6-31g+(d).log.xz

047127378.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127378.td-b3lyp_6-31+g(d).gjf (generated)

047127378.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127378.mol 047127378.PUBCHEM 047127378.mol (via Jmol)
047127385.b3lyp_6-31g(d).inp

047127385.b3lyp_6-31g(d).qchem.inp (generated)

047127385.b3lyp_6-31g(d).gjf (generated)

047127385.b3lyp_6-31g(d).firefly.inp (generated)

047127385.b3lyp_6-31g(d).smash.inp (generated)

047127385.b3lyp_6-31g(d).nwchem.inp (generated) 047127385.b3lyp_6-31g(d).log.xz 047127385.mol 047127385.PUBCHEM 047127385.mol (via Jmol)
047127389.b3lyp_6-31g(d).inp

047127389.b3lyp_6-31g(d).qchem.inp (generated)

047127389.b3lyp_6-31g(d).gjf (generated)

047127389.b3lyp_6-31g(d).firefly.inp (generated)

047127389.b3lyp_6-31g(d).smash.inp (generated)

047127389.b3lyp_6-31g(d).nwchem.inp (generated) 047127389.b3lyp_6-31g(d).log.xz 047127389.mol 047127389.PUBCHEM 047127389.mol (via Jmol)
047127397.b3lyp_6-31g(d).inp

047127397.b3lyp_6-31g(d).qchem.inp (generated)

047127397.b3lyp_6-31g(d).gjf (generated)

047127397.b3lyp_6-31g(d).firefly.inp (generated)

047127397.b3lyp_6-31g(d).smash.inp (generated)

047127397.b3lyp_6-31g(d).nwchem.inp (generated) 047127397.b3lyp_6-31g(d).log.xz 047127397.td-b3lyp_6-31g+(d).inp 047127397.td-b3lyp_6-31g+(d).log.xz

047127397.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127397.td-b3lyp_6-31+g(d).gjf (generated)

047127397.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127397.mol 047127397.PUBCHEM 047127397.mol (via Jmol)
047127400.b3lyp_6-31g(d).inp

047127400.b3lyp_6-31g(d).qchem.inp (generated)

047127400.b3lyp_6-31g(d).gjf (generated)

047127400.b3lyp_6-31g(d).firefly.inp (generated)

047127400.b3lyp_6-31g(d).smash.inp (generated)

047127400.b3lyp_6-31g(d).nwchem.inp (generated) 047127400.b3lyp_6-31g(d).log.xz 047127400.td-b3lyp_6-31g+(d).inp 047127400.td-b3lyp_6-31g+(d).log.xz

047127400.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127400.td-b3lyp_6-31+g(d).gjf (generated)

047127400.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127400.mol 047127400.PUBCHEM 047127400.mol (via Jmol)
047127420.b3lyp_6-31g(d).inp

047127420.b3lyp_6-31g(d).qchem.inp (generated)

047127420.b3lyp_6-31g(d).gjf (generated)

047127420.b3lyp_6-31g(d).firefly.inp (generated)

047127420.b3lyp_6-31g(d).smash.inp (generated)

047127420.b3lyp_6-31g(d).nwchem.inp (generated) 047127420.b3lyp_6-31g(d).log.xz 047127420.td-b3lyp_6-31g+(d).inp 047127420.td-b3lyp_6-31g+(d).log.xz

047127420.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127420.td-b3lyp_6-31+g(d).gjf (generated)

047127420.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127420.mol 047127420.PUBCHEM 047127420.mol (via Jmol)
047127423.b3lyp_6-31g(d).inp

047127423.b3lyp_6-31g(d).qchem.inp (generated)

047127423.b3lyp_6-31g(d).gjf (generated)

047127423.b3lyp_6-31g(d).firefly.inp (generated)

047127423.b3lyp_6-31g(d).smash.inp (generated)

047127423.b3lyp_6-31g(d).nwchem.inp (generated) 047127423.b3lyp_6-31g(d).log.xz 047127423.td-b3lyp_6-31g+(d).inp 047127423.td-b3lyp_6-31g+(d).log.xz

047127423.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127423.td-b3lyp_6-31+g(d).gjf (generated)

047127423.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127423.mol 047127423.PUBCHEM 047127423.mol (via Jmol)
047127434.b3lyp_6-31g(d).inp

047127434.b3lyp_6-31g(d).qchem.inp (generated)

047127434.b3lyp_6-31g(d).gjf (generated)

047127434.b3lyp_6-31g(d).firefly.inp (generated)

047127434.b3lyp_6-31g(d).smash.inp (generated)

047127434.b3lyp_6-31g(d).nwchem.inp (generated) 047127434.b3lyp_6-31g(d).log.xz 047127434.mol 047127434.PUBCHEM 047127434.mol (via Jmol)
047127443.b3lyp_6-31g(d).inp

047127443.b3lyp_6-31g(d).qchem.inp (generated)

047127443.b3lyp_6-31g(d).gjf (generated)

047127443.b3lyp_6-31g(d).firefly.inp (generated)

047127443.b3lyp_6-31g(d).smash.inp (generated)

047127443.b3lyp_6-31g(d).nwchem.inp (generated) 047127443.b3lyp_6-31g(d).log.xz 047127443.td-b3lyp_6-31g+(d).inp 047127443.td-b3lyp_6-31g+(d).log.xz

047127443.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127443.td-b3lyp_6-31+g(d).gjf (generated)

047127443.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127443.mol 047127443.PUBCHEM 047127443.mol (via Jmol)
047127458.b3lyp_6-31g(d).inp

047127458.b3lyp_6-31g(d).qchem.inp (generated)

047127458.b3lyp_6-31g(d).gjf (generated)

047127458.b3lyp_6-31g(d).firefly.inp (generated)

047127458.b3lyp_6-31g(d).smash.inp (generated)

047127458.b3lyp_6-31g(d).nwchem.inp (generated) 047127458.b3lyp_6-31g(d).log.xz 047127458.td-b3lyp_6-31g+(d).inp 047127458.td-b3lyp_6-31g+(d).log.xz

047127458.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127458.td-b3lyp_6-31+g(d).gjf (generated)

047127458.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127458.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127458.mol 047127458.PUBCHEM 047127458.mol (via Jmol)
047127464.b3lyp_6-31g(d).inp

047127464.b3lyp_6-31g(d).qchem.inp (generated)

047127464.b3lyp_6-31g(d).gjf (generated)

047127464.b3lyp_6-31g(d).firefly.inp (generated)

047127464.b3lyp_6-31g(d).smash.inp (generated)

047127464.b3lyp_6-31g(d).nwchem.inp (generated) 047127464.b3lyp_6-31g(d).log.xz 047127464.td-b3lyp_6-31g+(d).inp 047127464.td-b3lyp_6-31g+(d).log.xz

047127464.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127464.td-b3lyp_6-31+g(d).gjf (generated)

047127464.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127464.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127464.mol 047127464.PUBCHEM 047127464.mol (via Jmol)
047127465.b3lyp_6-31g(d).inp

047127465.b3lyp_6-31g(d).qchem.inp (generated)

047127465.b3lyp_6-31g(d).gjf (generated)

047127465.b3lyp_6-31g(d).firefly.inp (generated)

047127465.b3lyp_6-31g(d).smash.inp (generated)

047127465.b3lyp_6-31g(d).nwchem.inp (generated) 047127465.b3lyp_6-31g(d).log.xz 047127465.td-b3lyp_6-31g+(d).inp 047127465.td-b3lyp_6-31g+(d).log.xz

047127465.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127465.td-b3lyp_6-31+g(d).gjf (generated)

047127465.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127465.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127465.mol 047127465.PUBCHEM 047127465.mol (via Jmol)
047127467.b3lyp_6-31g(d).inp

047127467.b3lyp_6-31g(d).qchem.inp (generated)

047127467.b3lyp_6-31g(d).gjf (generated)

047127467.b3lyp_6-31g(d).firefly.inp (generated)

047127467.b3lyp_6-31g(d).smash.inp (generated)

047127467.b3lyp_6-31g(d).nwchem.inp (generated) 047127467.b3lyp_6-31g(d).log.xz 047127467.td-b3lyp_6-31g+(d).inp 047127467.td-b3lyp_6-31g+(d).log.xz

047127467.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127467.td-b3lyp_6-31+g(d).gjf (generated)

047127467.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127467.mol 047127467.PUBCHEM 047127467.mol (via Jmol)
047127468.b3lyp_6-31g(d).inp

047127468.b3lyp_6-31g(d).qchem.inp (generated)

047127468.b3lyp_6-31g(d).gjf (generated)

047127468.b3lyp_6-31g(d).firefly.inp (generated)

047127468.b3lyp_6-31g(d).smash.inp (generated)

047127468.b3lyp_6-31g(d).nwchem.inp (generated) 047127468.b3lyp_6-31g(d).log.xz 047127468.mol 047127468.PUBCHEM 047127468.mol (via Jmol)
047127478.b3lyp_6-31g(d).inp

047127478.b3lyp_6-31g(d).qchem.inp (generated)

047127478.b3lyp_6-31g(d).gjf (generated)

047127478.b3lyp_6-31g(d).firefly.inp (generated)

047127478.b3lyp_6-31g(d).smash.inp (generated)

047127478.b3lyp_6-31g(d).nwchem.inp (generated) 047127478.b3lyp_6-31g(d).log.xz 047127478.td-b3lyp_6-31g+(d).inp 047127478.td-b3lyp_6-31g+(d).log.xz

047127478.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127478.td-b3lyp_6-31+g(d).gjf (generated)

047127478.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127478.mol 047127478.PUBCHEM 047127478.mol (via Jmol)
047127485.b3lyp_6-31g(d).inp

047127485.b3lyp_6-31g(d).qchem.inp (generated)

047127485.b3lyp_6-31g(d).gjf (generated)

047127485.b3lyp_6-31g(d).firefly.inp (generated)

047127485.b3lyp_6-31g(d).smash.inp (generated)

047127485.b3lyp_6-31g(d).nwchem.inp (generated) 047127485.b3lyp_6-31g(d).log.xz 047127485.mol 047127485.PUBCHEM 047127485.mol (via Jmol)
047127616.b3lyp_6-31g(d).inp

047127616.b3lyp_6-31g(d).qchem.inp (generated)

047127616.b3lyp_6-31g(d).gjf (generated)

047127616.b3lyp_6-31g(d).firefly.inp (generated)

047127616.b3lyp_6-31g(d).smash.inp (generated)

047127616.b3lyp_6-31g(d).nwchem.inp (generated) 047127616.b3lyp_6-31g(d).log.xz 047127616.mol 047127616.PUBCHEM 047127616.mol (via Jmol)
047127629.b3lyp_6-31g(d).inp

047127629.b3lyp_6-31g(d).qchem.inp (generated)

047127629.b3lyp_6-31g(d).gjf (generated)

047127629.b3lyp_6-31g(d).firefly.inp (generated)

047127629.b3lyp_6-31g(d).smash.inp (generated)

047127629.b3lyp_6-31g(d).nwchem.inp (generated) 047127629.b3lyp_6-31g(d).log.xz 047127629.td-b3lyp_6-31g+(d).inp 047127629.td-b3lyp_6-31g+(d).log.xz

047127629.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127629.td-b3lyp_6-31+g(d).gjf (generated)

047127629.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127629.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127629.mol 047127629.PUBCHEM 047127629.mol (via Jmol)
047127634.b3lyp_6-31g(d).inp

047127634.b3lyp_6-31g(d).qchem.inp (generated)

047127634.b3lyp_6-31g(d).gjf (generated)

047127634.b3lyp_6-31g(d).firefly.inp (generated)

047127634.b3lyp_6-31g(d).smash.inp (generated)

047127634.b3lyp_6-31g(d).nwchem.inp (generated) 047127634.b3lyp_6-31g(d).log.xz 047127634.td-b3lyp_6-31g+(d).inp 047127634.td-b3lyp_6-31g+(d).log.xz

047127634.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127634.td-b3lyp_6-31+g(d).gjf (generated)

047127634.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127634.mol 047127634.PUBCHEM 047127634.mol (via Jmol)
047127694.b3lyp_6-31g(d).inp

047127694.b3lyp_6-31g(d).qchem.inp (generated)

047127694.b3lyp_6-31g(d).gjf (generated)

047127694.b3lyp_6-31g(d).firefly.inp (generated)

047127694.b3lyp_6-31g(d).smash.inp (generated)

047127694.b3lyp_6-31g(d).nwchem.inp (generated) 047127694.b3lyp_6-31g(d).log.xz 047127694.td-b3lyp_6-31g+(d).inp 047127694.td-b3lyp_6-31g+(d).log.xz

047127694.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127694.td-b3lyp_6-31+g(d).gjf (generated)

047127694.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127694.mol 047127694.PUBCHEM 047127694.mol (via Jmol)
047127754.b3lyp_6-31g(d).inp

047127754.b3lyp_6-31g(d).qchem.inp (generated)

047127754.b3lyp_6-31g(d).gjf (generated)

047127754.b3lyp_6-31g(d).firefly.inp (generated)

047127754.b3lyp_6-31g(d).smash.inp (generated)

047127754.b3lyp_6-31g(d).nwchem.inp (generated) 047127754.b3lyp_6-31g(d).log.xz 047127754.mol 047127754.PUBCHEM 047127754.mol (via Jmol)
047127789.b3lyp_6-31g(d).inp

047127789.b3lyp_6-31g(d).qchem.inp (generated)

047127789.b3lyp_6-31g(d).gjf (generated)

047127789.b3lyp_6-31g(d).firefly.inp (generated)

047127789.b3lyp_6-31g(d).smash.inp (generated)

047127789.b3lyp_6-31g(d).nwchem.inp (generated) 047127789.b3lyp_6-31g(d).log.xz 047127789.td-b3lyp_6-31g+(d).inp 047127789.td-b3lyp_6-31g+(d).log.xz

047127789.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127789.td-b3lyp_6-31+g(d).gjf (generated)

047127789.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127789.mol 047127789.PUBCHEM 047127789.mol (via Jmol)
047127799.b3lyp_6-31g(d).inp

047127799.b3lyp_6-31g(d).qchem.inp (generated)

047127799.b3lyp_6-31g(d).gjf (generated)

047127799.b3lyp_6-31g(d).firefly.inp (generated)

047127799.b3lyp_6-31g(d).smash.inp (generated)

047127799.b3lyp_6-31g(d).nwchem.inp (generated) 047127799.b3lyp_6-31g(d).log.xz 047127799.td-b3lyp_6-31g+(d).inp 047127799.td-b3lyp_6-31g+(d).log.xz

047127799.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127799.td-b3lyp_6-31+g(d).gjf (generated)

047127799.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127799.mol 047127799.PUBCHEM 047127799.mol (via Jmol)
047127871.b3lyp_6-31g(d).inp

047127871.b3lyp_6-31g(d).qchem.inp (generated)

047127871.b3lyp_6-31g(d).gjf (generated)

047127871.b3lyp_6-31g(d).firefly.inp (generated)

047127871.b3lyp_6-31g(d).smash.inp (generated)

047127871.b3lyp_6-31g(d).nwchem.inp (generated) 047127871.b3lyp_6-31g(d).log.xz 047127871.td-b3lyp_6-31g+(d).inp 047127871.td-b3lyp_6-31g+(d).log.xz

047127871.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127871.td-b3lyp_6-31+g(d).gjf (generated)

047127871.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127871.mol 047127871.PUBCHEM 047127871.mol (via Jmol)
047127872.b3lyp_6-31g(d).inp

047127872.b3lyp_6-31g(d).qchem.inp (generated)

047127872.b3lyp_6-31g(d).gjf (generated)

047127872.b3lyp_6-31g(d).firefly.inp (generated)

047127872.b3lyp_6-31g(d).smash.inp (generated)

047127872.b3lyp_6-31g(d).nwchem.inp (generated) 047127872.b3lyp_6-31g(d).log.xz 047127872.td-b3lyp_6-31g+(d).inp 047127872.td-b3lyp_6-31g+(d).log.xz

047127872.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127872.td-b3lyp_6-31+g(d).gjf (generated)

047127872.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127872.mol 047127872.PUBCHEM 047127872.mol (via Jmol)
047127873.b3lyp_6-31g(d).inp

047127873.b3lyp_6-31g(d).qchem.inp (generated)

047127873.b3lyp_6-31g(d).gjf (generated)

047127873.b3lyp_6-31g(d).firefly.inp (generated)

047127873.b3lyp_6-31g(d).smash.inp (generated)

047127873.b3lyp_6-31g(d).nwchem.inp (generated) 047127873.b3lyp_6-31g(d).log.xz 047127873.mol 047127873.PUBCHEM 047127873.mol (via Jmol)
047127876.b3lyp_6-31g(d).inp

047127876.b3lyp_6-31g(d).qchem.inp (generated)

047127876.b3lyp_6-31g(d).gjf (generated)

047127876.b3lyp_6-31g(d).firefly.inp (generated)

047127876.b3lyp_6-31g(d).smash.inp (generated)

047127876.b3lyp_6-31g(d).nwchem.inp (generated) 047127876.b3lyp_6-31g(d).log.xz 047127876.td-b3lyp_6-31g+(d).inp 047127876.td-b3lyp_6-31g+(d).log.xz

047127876.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127876.td-b3lyp_6-31+g(d).gjf (generated)

047127876.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127876.mol 047127876.PUBCHEM 047127876.mol (via Jmol)
047127880.b3lyp_6-31g(d).inp

047127880.b3lyp_6-31g(d).qchem.inp (generated)

047127880.b3lyp_6-31g(d).gjf (generated)

047127880.b3lyp_6-31g(d).firefly.inp (generated)

047127880.b3lyp_6-31g(d).smash.inp (generated)

047127880.b3lyp_6-31g(d).nwchem.inp (generated) 047127880.b3lyp_6-31g(d).log.xz 047127880.td-b3lyp_6-31g+(d).inp 047127880.td-b3lyp_6-31g+(d).log.xz

047127880.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127880.td-b3lyp_6-31+g(d).gjf (generated)

047127880.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127880.mol 047127880.PUBCHEM 047127880.mol (via Jmol)
047127987.b3lyp_6-31g(d).inp

047127987.b3lyp_6-31g(d).qchem.inp (generated)

047127987.b3lyp_6-31g(d).gjf (generated)

047127987.b3lyp_6-31g(d).firefly.inp (generated)

047127987.b3lyp_6-31g(d).smash.inp (generated)

047127987.b3lyp_6-31g(d).nwchem.inp (generated) 047127987.b3lyp_6-31g(d).log.xz 047127987.td-b3lyp_6-31g+(d).inp 047127987.td-b3lyp_6-31g+(d).log.xz

047127987.td-b3lyp_6-31+g(d).qchem.inp (generated)

047127987.td-b3lyp_6-31+g(d).gjf (generated)

047127987.td-b3lyp_6-31+g(d).firefly.inp (generated)

047127987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047127987.mol 047127987.PUBCHEM 047127987.mol (via Jmol)
047128248.b3lyp_6-31g(d).inp

047128248.b3lyp_6-31g(d).qchem.inp (generated)

047128248.b3lyp_6-31g(d).gjf (generated)

047128248.b3lyp_6-31g(d).firefly.inp (generated)

047128248.b3lyp_6-31g(d).smash.inp (generated)

047128248.b3lyp_6-31g(d).nwchem.inp (generated) 047128248.b3lyp_6-31g(d).log.xz 047128248.td-b3lyp_6-31g+(d).inp 047128248.td-b3lyp_6-31g+(d).log.xz

047128248.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128248.td-b3lyp_6-31+g(d).gjf (generated)

047128248.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128248.mol 047128248.PUBCHEM 047128248.mol (via Jmol)
047128297.b3lyp_6-31g(d).inp

047128297.b3lyp_6-31g(d).qchem.inp (generated)

047128297.b3lyp_6-31g(d).gjf (generated)

047128297.b3lyp_6-31g(d).firefly.inp (generated)

047128297.b3lyp_6-31g(d).smash.inp (generated)

047128297.b3lyp_6-31g(d).nwchem.inp (generated) 047128297.b3lyp_6-31g(d).log.xz 047128297.td-b3lyp_6-31g+(d).inp 047128297.td-b3lyp_6-31g+(d).log.xz

047128297.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128297.td-b3lyp_6-31+g(d).gjf (generated)

047128297.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128297.mol 047128297.PUBCHEM 047128297.mol (via Jmol)
047128307.b3lyp_6-31g(d).inp

047128307.b3lyp_6-31g(d).qchem.inp (generated)

047128307.b3lyp_6-31g(d).gjf (generated)

047128307.b3lyp_6-31g(d).firefly.inp (generated)

047128307.b3lyp_6-31g(d).smash.inp (generated)

047128307.b3lyp_6-31g(d).nwchem.inp (generated) 047128307.b3lyp_6-31g(d).log.xz 047128307.mol 047128307.PUBCHEM 047128307.mol (via Jmol)
047128313.b3lyp_6-31g(d).inp

047128313.b3lyp_6-31g(d).qchem.inp (generated)

047128313.b3lyp_6-31g(d).gjf (generated)

047128313.b3lyp_6-31g(d).firefly.inp (generated)

047128313.b3lyp_6-31g(d).smash.inp (generated)

047128313.b3lyp_6-31g(d).nwchem.inp (generated) 047128313.b3lyp_6-31g(d).log.xz 047128313.mol 047128313.PUBCHEM 047128313.mol (via Jmol)
047128328.b3lyp_6-31g(d).inp

047128328.b3lyp_6-31g(d).qchem.inp (generated)

047128328.b3lyp_6-31g(d).gjf (generated)

047128328.b3lyp_6-31g(d).firefly.inp (generated)

047128328.b3lyp_6-31g(d).smash.inp (generated)

047128328.b3lyp_6-31g(d).nwchem.inp (generated) 047128328.b3lyp_6-31g(d).log.xz 047128328.td-b3lyp_6-31g+(d).inp 047128328.td-b3lyp_6-31g+(d).log.xz

047128328.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128328.td-b3lyp_6-31+g(d).gjf (generated)

047128328.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128328.mol 047128328.PUBCHEM 047128328.mol (via Jmol)
047128331.b3lyp_6-31g(d).inp

047128331.b3lyp_6-31g(d).qchem.inp (generated)

047128331.b3lyp_6-31g(d).gjf (generated)

047128331.b3lyp_6-31g(d).firefly.inp (generated)

047128331.b3lyp_6-31g(d).smash.inp (generated)

047128331.b3lyp_6-31g(d).nwchem.inp (generated) 047128331.b3lyp_6-31g(d).log.xz 047128331.td-b3lyp_6-31g+(d).inp 047128331.td-b3lyp_6-31g+(d).log.xz

047128331.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128331.td-b3lyp_6-31+g(d).gjf (generated)

047128331.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128331.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128331.mol 047128331.PUBCHEM 047128331.mol (via Jmol)
047128341.b3lyp_6-31g(d).inp

047128341.b3lyp_6-31g(d).qchem.inp (generated)

047128341.b3lyp_6-31g(d).gjf (generated)

047128341.b3lyp_6-31g(d).firefly.inp (generated)

047128341.b3lyp_6-31g(d).smash.inp (generated)

047128341.b3lyp_6-31g(d).nwchem.inp (generated) 047128341.b3lyp_6-31g(d).log.xz 047128341.td-b3lyp_6-31g+(d).inp 047128341.td-b3lyp_6-31g+(d).log.xz

047128341.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128341.td-b3lyp_6-31+g(d).gjf (generated)

047128341.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128341.mol 047128341.PUBCHEM 047128341.mol (via Jmol)
047128392.b3lyp_6-31g(d).inp

047128392.b3lyp_6-31g(d).qchem.inp (generated)

047128392.b3lyp_6-31g(d).gjf (generated)

047128392.b3lyp_6-31g(d).firefly.inp (generated)

047128392.b3lyp_6-31g(d).smash.inp (generated)

047128392.b3lyp_6-31g(d).nwchem.inp (generated) 047128392.b3lyp_6-31g(d).log.xz 047128392.mol 047128392.PUBCHEM 047128392.mol (via Jmol)
047128450.b3lyp_6-31g(d).inp

047128450.b3lyp_6-31g(d).qchem.inp (generated)

047128450.b3lyp_6-31g(d).gjf (generated)

047128450.b3lyp_6-31g(d).firefly.inp (generated)

047128450.b3lyp_6-31g(d).smash.inp (generated)

047128450.b3lyp_6-31g(d).nwchem.inp (generated) 047128450.b3lyp_6-31g(d).log.xz 047128450.mol 047128450.PUBCHEM 047128450.mol (via Jmol)
047128497.b3lyp_6-31g(d).inp

047128497.b3lyp_6-31g(d).qchem.inp (generated)

047128497.b3lyp_6-31g(d).gjf (generated)

047128497.b3lyp_6-31g(d).firefly.inp (generated)

047128497.b3lyp_6-31g(d).smash.inp (generated)

047128497.b3lyp_6-31g(d).nwchem.inp (generated) 047128497.b3lyp_6-31g(d).log.xz 047128497.td-b3lyp_6-31g+(d).inp 047128497.td-b3lyp_6-31g+(d).log.xz

047128497.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128497.td-b3lyp_6-31+g(d).gjf (generated)

047128497.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128497.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128497.mol 047128497.PUBCHEM 047128497.mol (via Jmol)
047128522.b3lyp_6-31g(d).inp

047128522.b3lyp_6-31g(d).qchem.inp (generated)

047128522.b3lyp_6-31g(d).gjf (generated)

047128522.b3lyp_6-31g(d).firefly.inp (generated)

047128522.b3lyp_6-31g(d).smash.inp (generated)

047128522.b3lyp_6-31g(d).nwchem.inp (generated) 047128522.b3lyp_6-31g(d).log.xz 047128522.mol 047128522.PUBCHEM 047128522.mol (via Jmol)
047128531.b3lyp_6-31g(d).inp

047128531.b3lyp_6-31g(d).qchem.inp (generated)

047128531.b3lyp_6-31g(d).gjf (generated)

047128531.b3lyp_6-31g(d).firefly.inp (generated)

047128531.b3lyp_6-31g(d).smash.inp (generated)

047128531.b3lyp_6-31g(d).nwchem.inp (generated) 047128531.b3lyp_6-31g(d).log.xz 047128531.mol 047128531.PUBCHEM 047128531.mol (via Jmol)
047128557.b3lyp_6-31g(d).inp

047128557.b3lyp_6-31g(d).qchem.inp (generated)

047128557.b3lyp_6-31g(d).gjf (generated)

047128557.b3lyp_6-31g(d).firefly.inp (generated)

047128557.b3lyp_6-31g(d).smash.inp (generated)

047128557.b3lyp_6-31g(d).nwchem.inp (generated) 047128557.b3lyp_6-31g(d).log.xz 047128557.td-b3lyp_6-31g+(d).inp 047128557.td-b3lyp_6-31g+(d).log.xz

047128557.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128557.td-b3lyp_6-31+g(d).gjf (generated)

047128557.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128557.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128557.mol 047128557.PUBCHEM 047128557.mol (via Jmol)
047128736.b3lyp_6-31g(d).inp

047128736.b3lyp_6-31g(d).qchem.inp (generated)

047128736.b3lyp_6-31g(d).gjf (generated)

047128736.b3lyp_6-31g(d).firefly.inp (generated)

047128736.b3lyp_6-31g(d).smash.inp (generated)

047128736.b3lyp_6-31g(d).nwchem.inp (generated) 047128736.b3lyp_6-31g(d).log.xz 047128736.td-b3lyp_6-31g+(d).inp 047128736.td-b3lyp_6-31g+(d).log.xz

047128736.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128736.td-b3lyp_6-31+g(d).gjf (generated)

047128736.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128736.mol 047128736.PUBCHEM 047128736.mol (via Jmol)
047128788.b3lyp_6-31g(d).inp

047128788.b3lyp_6-31g(d).qchem.inp (generated)

047128788.b3lyp_6-31g(d).gjf (generated)

047128788.b3lyp_6-31g(d).firefly.inp (generated)

047128788.b3lyp_6-31g(d).smash.inp (generated)

047128788.b3lyp_6-31g(d).nwchem.inp (generated) 047128788.b3lyp_6-31g(d).log.xz 047128788.td-b3lyp_6-31g+(d).inp 047128788.td-b3lyp_6-31g+(d).log.xz

047128788.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128788.td-b3lyp_6-31+g(d).gjf (generated)

047128788.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128788.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128788.mol 047128788.PUBCHEM 047128788.mol (via Jmol)
047128828.b3lyp_6-31g(d).inp

047128828.b3lyp_6-31g(d).qchem.inp (generated)

047128828.b3lyp_6-31g(d).gjf (generated)

047128828.b3lyp_6-31g(d).firefly.inp (generated)

047128828.b3lyp_6-31g(d).smash.inp (generated)

047128828.b3lyp_6-31g(d).nwchem.inp (generated) 047128828.b3lyp_6-31g(d).log.xz 047128828.td-b3lyp_6-31g+(d).inp 047128828.td-b3lyp_6-31g+(d).log.xz

047128828.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128828.td-b3lyp_6-31+g(d).gjf (generated)

047128828.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128828.mol 047128828.PUBCHEM 047128828.mol (via Jmol)
047128968.b3lyp_6-31g(d).inp

047128968.b3lyp_6-31g(d).qchem.inp (generated)

047128968.b3lyp_6-31g(d).gjf (generated)

047128968.b3lyp_6-31g(d).firefly.inp (generated)

047128968.b3lyp_6-31g(d).smash.inp (generated)

047128968.b3lyp_6-31g(d).nwchem.inp (generated) 047128968.b3lyp_6-31g(d).log.xz 047128968.td-b3lyp_6-31g+(d).inp 047128968.td-b3lyp_6-31g+(d).log.xz

047128968.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128968.td-b3lyp_6-31+g(d).gjf (generated)

047128968.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128968.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128968.mol 047128968.PUBCHEM 047128968.mol (via Jmol)
047128984.b3lyp_6-31g(d).inp

047128984.b3lyp_6-31g(d).qchem.inp (generated)

047128984.b3lyp_6-31g(d).gjf (generated)

047128984.b3lyp_6-31g(d).firefly.inp (generated)

047128984.b3lyp_6-31g(d).smash.inp (generated)

047128984.b3lyp_6-31g(d).nwchem.inp (generated) 047128984.b3lyp_6-31g(d).log.xz 047128984.td-b3lyp_6-31g+(d).inp 047128984.td-b3lyp_6-31g+(d).log.xz

047128984.td-b3lyp_6-31+g(d).qchem.inp (generated)

047128984.td-b3lyp_6-31+g(d).gjf (generated)

047128984.td-b3lyp_6-31+g(d).firefly.inp (generated)

047128984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047128984.mol 047128984.PUBCHEM 047128984.mol (via Jmol)
047129044.b3lyp_6-31g(d).inp

047129044.b3lyp_6-31g(d).qchem.inp (generated)

047129044.b3lyp_6-31g(d).gjf (generated)

047129044.b3lyp_6-31g(d).firefly.inp (generated)

047129044.b3lyp_6-31g(d).smash.inp (generated)

047129044.b3lyp_6-31g(d).nwchem.inp (generated) 047129044.b3lyp_6-31g(d).log.xz 047129044.td-b3lyp_6-31g+(d).inp 047129044.td-b3lyp_6-31g+(d).log.xz

047129044.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129044.td-b3lyp_6-31+g(d).gjf (generated)

047129044.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129044.mol 047129044.PUBCHEM 047129044.mol (via Jmol)
047129094.b3lyp_6-31g(d).inp

047129094.b3lyp_6-31g(d).qchem.inp (generated)

047129094.b3lyp_6-31g(d).gjf (generated)

047129094.b3lyp_6-31g(d).firefly.inp (generated)

047129094.b3lyp_6-31g(d).smash.inp (generated)

047129094.b3lyp_6-31g(d).nwchem.inp (generated) 047129094.b3lyp_6-31g(d).log.xz 047129094.td-b3lyp_6-31g+(d).inp 047129094.td-b3lyp_6-31g+(d).log.xz

047129094.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129094.td-b3lyp_6-31+g(d).gjf (generated)

047129094.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129094.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129094.mol 047129094.PUBCHEM 047129094.mol (via Jmol)
047129104.b3lyp_6-31g(d).inp

047129104.b3lyp_6-31g(d).qchem.inp (generated)

047129104.b3lyp_6-31g(d).gjf (generated)

047129104.b3lyp_6-31g(d).firefly.inp (generated)

047129104.b3lyp_6-31g(d).smash.inp (generated)

047129104.b3lyp_6-31g(d).nwchem.inp (generated) 047129104.b3lyp_6-31g(d).log.xz 047129104.td-b3lyp_6-31g+(d).inp 047129104.td-b3lyp_6-31g+(d).log.xz

047129104.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129104.td-b3lyp_6-31+g(d).gjf (generated)

047129104.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129104.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129104.mol 047129104.PUBCHEM 047129104.mol (via Jmol)
047129147.b3lyp_6-31g(d).inp

047129147.b3lyp_6-31g(d).qchem.inp (generated)

047129147.b3lyp_6-31g(d).gjf (generated)

047129147.b3lyp_6-31g(d).firefly.inp (generated)

047129147.b3lyp_6-31g(d).smash.inp (generated)

047129147.b3lyp_6-31g(d).nwchem.inp (generated) 047129147.b3lyp_6-31g(d).log.xz 047129147.td-b3lyp_6-31g+(d).inp 047129147.td-b3lyp_6-31g+(d).log.xz

047129147.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129147.td-b3lyp_6-31+g(d).gjf (generated)

047129147.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129147.mol 047129147.PUBCHEM 047129147.mol (via Jmol)
047129194.b3lyp_6-31g(d).inp

047129194.b3lyp_6-31g(d).qchem.inp (generated)

047129194.b3lyp_6-31g(d).gjf (generated)

047129194.b3lyp_6-31g(d).firefly.inp (generated)

047129194.b3lyp_6-31g(d).smash.inp (generated)

047129194.b3lyp_6-31g(d).nwchem.inp (generated) 047129194.b3lyp_6-31g(d).log.xz 047129194.td-b3lyp_6-31g+(d).inp 047129194.td-b3lyp_6-31g+(d).log.xz

047129194.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129194.td-b3lyp_6-31+g(d).gjf (generated)

047129194.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129194.mol 047129194.PUBCHEM 047129194.mol (via Jmol)
047129224.b3lyp_6-31g(d).inp

047129224.b3lyp_6-31g(d).qchem.inp (generated)

047129224.b3lyp_6-31g(d).gjf (generated)

047129224.b3lyp_6-31g(d).firefly.inp (generated)

047129224.b3lyp_6-31g(d).smash.inp (generated)

047129224.b3lyp_6-31g(d).nwchem.inp (generated) 047129224.b3lyp_6-31g(d).log.xz 047129224.mol 047129224.PUBCHEM 047129224.mol (via Jmol)
047129242.b3lyp_6-31g(d).inp

047129242.b3lyp_6-31g(d).qchem.inp (generated)

047129242.b3lyp_6-31g(d).gjf (generated)

047129242.b3lyp_6-31g(d).firefly.inp (generated)

047129242.b3lyp_6-31g(d).smash.inp (generated)

047129242.b3lyp_6-31g(d).nwchem.inp (generated) 047129242.b3lyp_6-31g(d).log.xz 047129242.td-b3lyp_6-31g+(d).inp 047129242.td-b3lyp_6-31g+(d).log.xz

047129242.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129242.td-b3lyp_6-31+g(d).gjf (generated)

047129242.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129242.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129242.mol 047129242.PUBCHEM 047129242.mol (via Jmol)
047129246.b3lyp_6-31g(d).inp

047129246.b3lyp_6-31g(d).qchem.inp (generated)

047129246.b3lyp_6-31g(d).gjf (generated)

047129246.b3lyp_6-31g(d).firefly.inp (generated)

047129246.b3lyp_6-31g(d).smash.inp (generated)

047129246.b3lyp_6-31g(d).nwchem.inp (generated) 047129246.b3lyp_6-31g(d).log.xz 047129246.mol 047129246.PUBCHEM 047129246.mol (via Jmol)
047129248.b3lyp_6-31g(d).inp

047129248.b3lyp_6-31g(d).qchem.inp (generated)

047129248.b3lyp_6-31g(d).gjf (generated)

047129248.b3lyp_6-31g(d).firefly.inp (generated)

047129248.b3lyp_6-31g(d).smash.inp (generated)

047129248.b3lyp_6-31g(d).nwchem.inp (generated) 047129248.b3lyp_6-31g(d).log.xz 047129248.td-b3lyp_6-31g+(d).inp 047129248.td-b3lyp_6-31g+(d).log.xz

047129248.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129248.td-b3lyp_6-31+g(d).gjf (generated)

047129248.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129248.mol 047129248.PUBCHEM 047129248.mol (via Jmol)
047129256.b3lyp_6-31g(d).inp

047129256.b3lyp_6-31g(d).qchem.inp (generated)

047129256.b3lyp_6-31g(d).gjf (generated)

047129256.b3lyp_6-31g(d).firefly.inp (generated)

047129256.b3lyp_6-31g(d).smash.inp (generated)

047129256.b3lyp_6-31g(d).nwchem.inp (generated) 047129256.b3lyp_6-31g(d).log.xz 047129256.td-b3lyp_6-31g+(d).inp 047129256.td-b3lyp_6-31g+(d).log.xz

047129256.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129256.td-b3lyp_6-31+g(d).gjf (generated)

047129256.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129256.mol 047129256.PUBCHEM 047129256.mol (via Jmol)
047129261.b3lyp_6-31g(d).inp

047129261.b3lyp_6-31g(d).qchem.inp (generated)

047129261.b3lyp_6-31g(d).gjf (generated)

047129261.b3lyp_6-31g(d).firefly.inp (generated)

047129261.b3lyp_6-31g(d).smash.inp (generated)

047129261.b3lyp_6-31g(d).nwchem.inp (generated) 047129261.b3lyp_6-31g(d).log.xz 047129261.td-b3lyp_6-31g+(d).inp 047129261.td-b3lyp_6-31g+(d).log.xz

047129261.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129261.td-b3lyp_6-31+g(d).gjf (generated)

047129261.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129261.mol 047129261.PUBCHEM 047129261.mol (via Jmol)
047129262.b3lyp_6-31g(d).inp

047129262.b3lyp_6-31g(d).qchem.inp (generated)

047129262.b3lyp_6-31g(d).gjf (generated)

047129262.b3lyp_6-31g(d).firefly.inp (generated)

047129262.b3lyp_6-31g(d).smash.inp (generated)

047129262.b3lyp_6-31g(d).nwchem.inp (generated) 047129262.b3lyp_6-31g(d).log.xz 047129262.td-b3lyp_6-31g+(d).inp 047129262.td-b3lyp_6-31g+(d).log.xz

047129262.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129262.td-b3lyp_6-31+g(d).gjf (generated)

047129262.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129262.mol 047129262.PUBCHEM 047129262.mol (via Jmol)
047129266.b3lyp_6-31g(d).inp

047129266.b3lyp_6-31g(d).qchem.inp (generated)

047129266.b3lyp_6-31g(d).gjf (generated)

047129266.b3lyp_6-31g(d).firefly.inp (generated)

047129266.b3lyp_6-31g(d).smash.inp (generated)

047129266.b3lyp_6-31g(d).nwchem.inp (generated) 047129266.b3lyp_6-31g(d).log.xz 047129266.td-b3lyp_6-31g+(d).inp 047129266.td-b3lyp_6-31g+(d).log.xz

047129266.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129266.td-b3lyp_6-31+g(d).gjf (generated)

047129266.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129266.mol 047129266.PUBCHEM 047129266.mol (via Jmol)
047129278.b3lyp_6-31g(d).inp

047129278.b3lyp_6-31g(d).qchem.inp (generated)

047129278.b3lyp_6-31g(d).gjf (generated)

047129278.b3lyp_6-31g(d).firefly.inp (generated)

047129278.b3lyp_6-31g(d).smash.inp (generated)

047129278.b3lyp_6-31g(d).nwchem.inp (generated) 047129278.b3lyp_6-31g(d).log.xz 047129278.mol 047129278.PUBCHEM 047129278.mol (via Jmol)
047129279.b3lyp_6-31g(d).inp

047129279.b3lyp_6-31g(d).qchem.inp (generated)

047129279.b3lyp_6-31g(d).gjf (generated)

047129279.b3lyp_6-31g(d).firefly.inp (generated)

047129279.b3lyp_6-31g(d).smash.inp (generated)

047129279.b3lyp_6-31g(d).nwchem.inp (generated) 047129279.b3lyp_6-31g(d).log.xz 047129279.td-b3lyp_6-31g+(d).inp 047129279.td-b3lyp_6-31g+(d).log.xz

047129279.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129279.td-b3lyp_6-31+g(d).gjf (generated)

047129279.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129279.mol 047129279.PUBCHEM 047129279.mol (via Jmol)
047129284.b3lyp_6-31g(d).inp

047129284.b3lyp_6-31g(d).qchem.inp (generated)

047129284.b3lyp_6-31g(d).gjf (generated)

047129284.b3lyp_6-31g(d).firefly.inp (generated)

047129284.b3lyp_6-31g(d).smash.inp (generated)

047129284.b3lyp_6-31g(d).nwchem.inp (generated) 047129284.b3lyp_6-31g(d).log.xz 047129284.td-b3lyp_6-31g+(d).inp 047129284.td-b3lyp_6-31g+(d).log.xz

047129284.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129284.td-b3lyp_6-31+g(d).gjf (generated)

047129284.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129284.mol 047129284.PUBCHEM 047129284.mol (via Jmol)
047129288.b3lyp_6-31g(d).inp

047129288.b3lyp_6-31g(d).qchem.inp (generated)

047129288.b3lyp_6-31g(d).gjf (generated)

047129288.b3lyp_6-31g(d).firefly.inp (generated)

047129288.b3lyp_6-31g(d).smash.inp (generated)

047129288.b3lyp_6-31g(d).nwchem.inp (generated) 047129288.b3lyp_6-31g(d).log.xz 047129288.td-b3lyp_6-31g+(d).inp 047129288.td-b3lyp_6-31g+(d).log.xz

047129288.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129288.td-b3lyp_6-31+g(d).gjf (generated)

047129288.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129288.mol 047129288.PUBCHEM 047129288.mol (via Jmol)
047129297.b3lyp_6-31g(d).inp

047129297.b3lyp_6-31g(d).qchem.inp (generated)

047129297.b3lyp_6-31g(d).gjf (generated)

047129297.b3lyp_6-31g(d).firefly.inp (generated)

047129297.b3lyp_6-31g(d).smash.inp (generated)

047129297.b3lyp_6-31g(d).nwchem.inp (generated) 047129297.b3lyp_6-31g(d).log.xz 047129297.td-b3lyp_6-31g+(d).inp 047129297.td-b3lyp_6-31g+(d).log.xz

047129297.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129297.td-b3lyp_6-31+g(d).gjf (generated)

047129297.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129297.mol 047129297.PUBCHEM 047129297.mol (via Jmol)
047129302.b3lyp_6-31g(d).inp

047129302.b3lyp_6-31g(d).qchem.inp (generated)

047129302.b3lyp_6-31g(d).gjf (generated)

047129302.b3lyp_6-31g(d).firefly.inp (generated)

047129302.b3lyp_6-31g(d).smash.inp (generated)

047129302.b3lyp_6-31g(d).nwchem.inp (generated) 047129302.b3lyp_6-31g(d).log.xz 047129302.td-b3lyp_6-31g+(d).inp 047129302.td-b3lyp_6-31g+(d).log.xz

047129302.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129302.td-b3lyp_6-31+g(d).gjf (generated)

047129302.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129302.mol 047129302.PUBCHEM 047129302.mol (via Jmol)
047129309.b3lyp_6-31g(d).inp

047129309.b3lyp_6-31g(d).qchem.inp (generated)

047129309.b3lyp_6-31g(d).gjf (generated)

047129309.b3lyp_6-31g(d).firefly.inp (generated)

047129309.b3lyp_6-31g(d).smash.inp (generated)

047129309.b3lyp_6-31g(d).nwchem.inp (generated) 047129309.b3lyp_6-31g(d).log.xz 047129309.mol 047129309.PUBCHEM 047129309.mol (via Jmol)
047129324.b3lyp_6-31g(d).inp

047129324.b3lyp_6-31g(d).qchem.inp (generated)

047129324.b3lyp_6-31g(d).gjf (generated)

047129324.b3lyp_6-31g(d).firefly.inp (generated)

047129324.b3lyp_6-31g(d).smash.inp (generated)

047129324.b3lyp_6-31g(d).nwchem.inp (generated) 047129324.b3lyp_6-31g(d).log.xz 047129324.mol 047129324.PUBCHEM 047129324.mol (via Jmol)
047129328.b3lyp_6-31g(d).inp

047129328.b3lyp_6-31g(d).qchem.inp (generated)

047129328.b3lyp_6-31g(d).gjf (generated)

047129328.b3lyp_6-31g(d).firefly.inp (generated)

047129328.b3lyp_6-31g(d).smash.inp (generated)

047129328.b3lyp_6-31g(d).nwchem.inp (generated) 047129328.b3lyp_6-31g(d).log.xz 047129328.mol 047129328.PUBCHEM 047129328.mol (via Jmol)
047129355.b3lyp_6-31g(d).inp

047129355.b3lyp_6-31g(d).qchem.inp (generated)

047129355.b3lyp_6-31g(d).gjf (generated)

047129355.b3lyp_6-31g(d).firefly.inp (generated)

047129355.b3lyp_6-31g(d).smash.inp (generated)

047129355.b3lyp_6-31g(d).nwchem.inp (generated) 047129355.b3lyp_6-31g(d).log.xz 047129355.mol 047129355.PUBCHEM 047129355.mol (via Jmol)
047129374.b3lyp_6-31g(d).inp

047129374.b3lyp_6-31g(d).qchem.inp (generated)

047129374.b3lyp_6-31g(d).gjf (generated)

047129374.b3lyp_6-31g(d).firefly.inp (generated)

047129374.b3lyp_6-31g(d).smash.inp (generated)

047129374.b3lyp_6-31g(d).nwchem.inp (generated) 047129374.b3lyp_6-31g(d).log.xz 047129374.mol 047129374.PUBCHEM 047129374.mol (via Jmol)
047129375.b3lyp_6-31g(d).inp

047129375.b3lyp_6-31g(d).qchem.inp (generated)

047129375.b3lyp_6-31g(d).gjf (generated)

047129375.b3lyp_6-31g(d).firefly.inp (generated)

047129375.b3lyp_6-31g(d).smash.inp (generated)

047129375.b3lyp_6-31g(d).nwchem.inp (generated) 047129375.b3lyp_6-31g(d).log.xz 047129375.td-b3lyp_6-31g+(d).inp 047129375.td-b3lyp_6-31g+(d).log.xz

047129375.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129375.td-b3lyp_6-31+g(d).gjf (generated)

047129375.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129375.mol 047129375.PUBCHEM 047129375.mol (via Jmol)
047129387.b3lyp_6-31g(d).inp

047129387.b3lyp_6-31g(d).qchem.inp (generated)

047129387.b3lyp_6-31g(d).gjf (generated)

047129387.b3lyp_6-31g(d).firefly.inp (generated)

047129387.b3lyp_6-31g(d).smash.inp (generated)

047129387.b3lyp_6-31g(d).nwchem.inp (generated) 047129387.b3lyp_6-31g(d).log.xz 047129387.td-b3lyp_6-31g+(d).inp 047129387.td-b3lyp_6-31g+(d).log.xz

047129387.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129387.td-b3lyp_6-31+g(d).gjf (generated)

047129387.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129387.mol 047129387.PUBCHEM 047129387.mol (via Jmol)
047129389.b3lyp_6-31g(d).inp

047129389.b3lyp_6-31g(d).qchem.inp (generated)

047129389.b3lyp_6-31g(d).gjf (generated)

047129389.b3lyp_6-31g(d).firefly.inp (generated)

047129389.b3lyp_6-31g(d).smash.inp (generated)

047129389.b3lyp_6-31g(d).nwchem.inp (generated) 047129389.b3lyp_6-31g(d).log.xz 047129389.mol 047129389.PUBCHEM 047129389.mol (via Jmol)
047129398.b3lyp_6-31g(d).inp

047129398.b3lyp_6-31g(d).qchem.inp (generated)

047129398.b3lyp_6-31g(d).gjf (generated)

047129398.b3lyp_6-31g(d).firefly.inp (generated)

047129398.b3lyp_6-31g(d).smash.inp (generated)

047129398.b3lyp_6-31g(d).nwchem.inp (generated) 047129398.b3lyp_6-31g(d).log.xz 047129398.mol 047129398.PUBCHEM 047129398.mol (via Jmol)
047129399.b3lyp_6-31g(d).inp

047129399.b3lyp_6-31g(d).qchem.inp (generated)

047129399.b3lyp_6-31g(d).gjf (generated)

047129399.b3lyp_6-31g(d).firefly.inp (generated)

047129399.b3lyp_6-31g(d).smash.inp (generated)

047129399.b3lyp_6-31g(d).nwchem.inp (generated) 047129399.b3lyp_6-31g(d).log.xz 047129399.td-b3lyp_6-31g+(d).inp 047129399.td-b3lyp_6-31g+(d).log.xz

047129399.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129399.td-b3lyp_6-31+g(d).gjf (generated)

047129399.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129399.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129399.mol 047129399.PUBCHEM 047129399.mol (via Jmol)
047129417.b3lyp_6-31g(d).inp

047129417.b3lyp_6-31g(d).qchem.inp (generated)

047129417.b3lyp_6-31g(d).gjf (generated)

047129417.b3lyp_6-31g(d).firefly.inp (generated)

047129417.b3lyp_6-31g(d).smash.inp (generated)

047129417.b3lyp_6-31g(d).nwchem.inp (generated) 047129417.b3lyp_6-31g(d).log.xz 047129417.td-b3lyp_6-31g+(d).inp 047129417.td-b3lyp_6-31g+(d).log.xz

047129417.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129417.td-b3lyp_6-31+g(d).gjf (generated)

047129417.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129417.mol 047129417.PUBCHEM 047129417.mol (via Jmol)
047129419.b3lyp_6-31g(d).inp

047129419.b3lyp_6-31g(d).qchem.inp (generated)

047129419.b3lyp_6-31g(d).gjf (generated)

047129419.b3lyp_6-31g(d).firefly.inp (generated)

047129419.b3lyp_6-31g(d).smash.inp (generated)

047129419.b3lyp_6-31g(d).nwchem.inp (generated) 047129419.b3lyp_6-31g(d).log.xz 047129419.td-b3lyp_6-31g+(d).inp 047129419.td-b3lyp_6-31g+(d).log.xz

047129419.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129419.td-b3lyp_6-31+g(d).gjf (generated)

047129419.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129419.mol 047129419.PUBCHEM 047129419.mol (via Jmol)
047129443.b3lyp_6-31g(d).inp

047129443.b3lyp_6-31g(d).qchem.inp (generated)

047129443.b3lyp_6-31g(d).gjf (generated)

047129443.b3lyp_6-31g(d).firefly.inp (generated)

047129443.b3lyp_6-31g(d).smash.inp (generated)

047129443.b3lyp_6-31g(d).nwchem.inp (generated) 047129443.b3lyp_6-31g(d).log.xz 047129443.td-b3lyp_6-31g+(d).inp 047129443.td-b3lyp_6-31g+(d).log.xz

047129443.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129443.td-b3lyp_6-31+g(d).gjf (generated)

047129443.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129443.mol 047129443.PUBCHEM 047129443.mol (via Jmol)
047129452.b3lyp_6-31g(d).inp

047129452.b3lyp_6-31g(d).qchem.inp (generated)

047129452.b3lyp_6-31g(d).gjf (generated)

047129452.b3lyp_6-31g(d).firefly.inp (generated)

047129452.b3lyp_6-31g(d).smash.inp (generated)

047129452.b3lyp_6-31g(d).nwchem.inp (generated) 047129452.b3lyp_6-31g(d).log.xz 047129452.td-b3lyp_6-31g+(d).inp 047129452.td-b3lyp_6-31g+(d).log.xz

047129452.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129452.td-b3lyp_6-31+g(d).gjf (generated)

047129452.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129452.mol 047129452.PUBCHEM 047129452.mol (via Jmol)
047129453.b3lyp_6-31g(d).inp

047129453.b3lyp_6-31g(d).qchem.inp (generated)

047129453.b3lyp_6-31g(d).gjf (generated)

047129453.b3lyp_6-31g(d).firefly.inp (generated)

047129453.b3lyp_6-31g(d).smash.inp (generated)

047129453.b3lyp_6-31g(d).nwchem.inp (generated) 047129453.b3lyp_6-31g(d).log.xz 047129453.td-b3lyp_6-31g+(d).inp 047129453.td-b3lyp_6-31g+(d).log.xz

047129453.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129453.td-b3lyp_6-31+g(d).gjf (generated)

047129453.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129453.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129453.mol 047129453.PUBCHEM 047129453.mol (via Jmol)
047129484.b3lyp_6-31g(d).inp

047129484.b3lyp_6-31g(d).qchem.inp (generated)

047129484.b3lyp_6-31g(d).gjf (generated)

047129484.b3lyp_6-31g(d).firefly.inp (generated)

047129484.b3lyp_6-31g(d).smash.inp (generated)

047129484.b3lyp_6-31g(d).nwchem.inp (generated) 047129484.b3lyp_6-31g(d).log.xz 047129484.td-b3lyp_6-31g+(d).inp 047129484.td-b3lyp_6-31g+(d).log.xz

047129484.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129484.td-b3lyp_6-31+g(d).gjf (generated)

047129484.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129484.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129484.mol 047129484.PUBCHEM 047129484.mol (via Jmol)
047129652.b3lyp_6-31g(d).inp

047129652.b3lyp_6-31g(d).qchem.inp (generated)

047129652.b3lyp_6-31g(d).gjf (generated)

047129652.b3lyp_6-31g(d).firefly.inp (generated)

047129652.b3lyp_6-31g(d).smash.inp (generated)

047129652.b3lyp_6-31g(d).nwchem.inp (generated) 047129652.b3lyp_6-31g(d).log.xz 047129652.td-b3lyp_6-31g+(d).inp 047129652.td-b3lyp_6-31g+(d).log.xz

047129652.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129652.td-b3lyp_6-31+g(d).gjf (generated)

047129652.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129652.mol 047129652.PUBCHEM 047129652.mol (via Jmol)
047129661.b3lyp_6-31g(d).inp

047129661.b3lyp_6-31g(d).qchem.inp (generated)

047129661.b3lyp_6-31g(d).gjf (generated)

047129661.b3lyp_6-31g(d).firefly.inp (generated)

047129661.b3lyp_6-31g(d).smash.inp (generated)

047129661.b3lyp_6-31g(d).nwchem.inp (generated) 047129661.b3lyp_6-31g(d).log.xz 047129661.td-b3lyp_6-31g+(d).inp 047129661.td-b3lyp_6-31g+(d).log.xz

047129661.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129661.td-b3lyp_6-31+g(d).gjf (generated)

047129661.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129661.mol 047129661.PUBCHEM 047129661.mol (via Jmol)
047129684.b3lyp_6-31g(d).inp

047129684.b3lyp_6-31g(d).qchem.inp (generated)

047129684.b3lyp_6-31g(d).gjf (generated)

047129684.b3lyp_6-31g(d).firefly.inp (generated)

047129684.b3lyp_6-31g(d).smash.inp (generated)

047129684.b3lyp_6-31g(d).nwchem.inp (generated) 047129684.b3lyp_6-31g(d).log.xz 047129684.td-b3lyp_6-31g+(d).inp 047129684.td-b3lyp_6-31g+(d).log.xz

047129684.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129684.td-b3lyp_6-31+g(d).gjf (generated)

047129684.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129684.mol 047129684.PUBCHEM 047129684.mol (via Jmol)
047129715.b3lyp_6-31g(d).inp

047129715.b3lyp_6-31g(d).qchem.inp (generated)

047129715.b3lyp_6-31g(d).gjf (generated)

047129715.b3lyp_6-31g(d).firefly.inp (generated)

047129715.b3lyp_6-31g(d).smash.inp (generated)

047129715.b3lyp_6-31g(d).nwchem.inp (generated) 047129715.b3lyp_6-31g(d).log.xz 047129715.td-b3lyp_6-31g+(d).inp 047129715.td-b3lyp_6-31g+(d).log.xz

047129715.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129715.td-b3lyp_6-31+g(d).gjf (generated)

047129715.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129715.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129715.mol 047129715.PUBCHEM 047129715.mol (via Jmol)
047129728.b3lyp_6-31g(d).inp

047129728.b3lyp_6-31g(d).qchem.inp (generated)

047129728.b3lyp_6-31g(d).gjf (generated)

047129728.b3lyp_6-31g(d).firefly.inp (generated)

047129728.b3lyp_6-31g(d).smash.inp (generated)

047129728.b3lyp_6-31g(d).nwchem.inp (generated) 047129728.b3lyp_6-31g(d).log.xz 047129728.td-b3lyp_6-31g+(d).inp 047129728.td-b3lyp_6-31g+(d).log.xz

047129728.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129728.td-b3lyp_6-31+g(d).gjf (generated)

047129728.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129728.mol 047129728.PUBCHEM 047129728.mol (via Jmol)
047129749.b3lyp_6-31g(d).inp

047129749.b3lyp_6-31g(d).qchem.inp (generated)

047129749.b3lyp_6-31g(d).gjf (generated)

047129749.b3lyp_6-31g(d).firefly.inp (generated)

047129749.b3lyp_6-31g(d).smash.inp (generated)

047129749.b3lyp_6-31g(d).nwchem.inp (generated) 047129749.b3lyp_6-31g(d).log.xz 047129749.td-b3lyp_6-31g+(d).inp 047129749.td-b3lyp_6-31g+(d).log.xz

047129749.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129749.td-b3lyp_6-31+g(d).gjf (generated)

047129749.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129749.mol 047129749.PUBCHEM 047129749.mol (via Jmol)
047129797.b3lyp_6-31g(d).inp

047129797.b3lyp_6-31g(d).qchem.inp (generated)

047129797.b3lyp_6-31g(d).gjf (generated)

047129797.b3lyp_6-31g(d).firefly.inp (generated)

047129797.b3lyp_6-31g(d).smash.inp (generated)

047129797.b3lyp_6-31g(d).nwchem.inp (generated) 047129797.b3lyp_6-31g(d).log.xz 047129797.td-b3lyp_6-31g+(d).inp 047129797.td-b3lyp_6-31g+(d).log.xz

047129797.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129797.td-b3lyp_6-31+g(d).gjf (generated)

047129797.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129797.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129797.mol 047129797.PUBCHEM 047129797.mol (via Jmol)
047129833.b3lyp_6-31g(d).inp

047129833.b3lyp_6-31g(d).qchem.inp (generated)

047129833.b3lyp_6-31g(d).gjf (generated)

047129833.b3lyp_6-31g(d).firefly.inp (generated)

047129833.b3lyp_6-31g(d).smash.inp (generated)

047129833.b3lyp_6-31g(d).nwchem.inp (generated) 047129833.b3lyp_6-31g(d).log.xz 047129833.td-b3lyp_6-31g+(d).inp 047129833.td-b3lyp_6-31g+(d).log.xz

047129833.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129833.td-b3lyp_6-31+g(d).gjf (generated)

047129833.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129833.mol 047129833.PUBCHEM 047129833.mol (via Jmol)
047129938.b3lyp_6-31g(d).inp

047129938.b3lyp_6-31g(d).qchem.inp (generated)

047129938.b3lyp_6-31g(d).gjf (generated)

047129938.b3lyp_6-31g(d).firefly.inp (generated)

047129938.b3lyp_6-31g(d).smash.inp (generated)

047129938.b3lyp_6-31g(d).nwchem.inp (generated) 047129938.b3lyp_6-31g(d).log.xz 047129938.mol 047129938.PUBCHEM 047129938.mol (via Jmol)
047129948.b3lyp_6-31g(d).inp

047129948.b3lyp_6-31g(d).qchem.inp (generated)

047129948.b3lyp_6-31g(d).gjf (generated)

047129948.b3lyp_6-31g(d).firefly.inp (generated)

047129948.b3lyp_6-31g(d).smash.inp (generated)

047129948.b3lyp_6-31g(d).nwchem.inp (generated) 047129948.b3lyp_6-31g(d).log.xz 047129948.td-b3lyp_6-31g+(d).inp 047129948.td-b3lyp_6-31g+(d).log.xz

047129948.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129948.td-b3lyp_6-31+g(d).gjf (generated)

047129948.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129948.mol 047129948.PUBCHEM 047129948.mol (via Jmol)
047129949.b3lyp_6-31g(d).inp

047129949.b3lyp_6-31g(d).qchem.inp (generated)

047129949.b3lyp_6-31g(d).gjf (generated)

047129949.b3lyp_6-31g(d).firefly.inp (generated)

047129949.b3lyp_6-31g(d).smash.inp (generated)

047129949.b3lyp_6-31g(d).nwchem.inp (generated) 047129949.b3lyp_6-31g(d).log.xz 047129949.td-b3lyp_6-31g+(d).inp 047129949.td-b3lyp_6-31g+(d).log.xz

047129949.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129949.td-b3lyp_6-31+g(d).gjf (generated)

047129949.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129949.mol 047129949.PUBCHEM 047129949.mol (via Jmol)
047129984.b3lyp_6-31g(d).inp

047129984.b3lyp_6-31g(d).qchem.inp (generated)

047129984.b3lyp_6-31g(d).gjf (generated)

047129984.b3lyp_6-31g(d).firefly.inp (generated)

047129984.b3lyp_6-31g(d).smash.inp (generated)

047129984.b3lyp_6-31g(d).nwchem.inp (generated) 047129984.b3lyp_6-31g(d).log.xz 047129984.td-b3lyp_6-31g+(d).inp 047129984.td-b3lyp_6-31g+(d).log.xz

047129984.td-b3lyp_6-31+g(d).qchem.inp (generated)

047129984.td-b3lyp_6-31+g(d).gjf (generated)

047129984.td-b3lyp_6-31+g(d).firefly.inp (generated)

047129984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047129984.mol 047129984.PUBCHEM 047129984.mol (via Jmol)
047130273.b3lyp_6-31g(d).inp

047130273.b3lyp_6-31g(d).qchem.inp (generated)

047130273.b3lyp_6-31g(d).gjf (generated)

047130273.b3lyp_6-31g(d).firefly.inp (generated)

047130273.b3lyp_6-31g(d).smash.inp (generated)

047130273.b3lyp_6-31g(d).nwchem.inp (generated) 047130273.b3lyp_6-31g(d).log.xz 047130273.td-b3lyp_6-31g+(d).inp 047130273.td-b3lyp_6-31g+(d).log.xz

047130273.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130273.td-b3lyp_6-31+g(d).gjf (generated)

047130273.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130273.mol 047130273.PUBCHEM 047130273.mol (via Jmol)
047130646.b3lyp_6-31g(d).inp

047130646.b3lyp_6-31g(d).qchem.inp (generated)

047130646.b3lyp_6-31g(d).gjf (generated)

047130646.b3lyp_6-31g(d).firefly.inp (generated)

047130646.b3lyp_6-31g(d).smash.inp (generated)

047130646.b3lyp_6-31g(d).nwchem.inp (generated) 047130646.b3lyp_6-31g(d).log.xz 047130646.td-b3lyp_6-31g+(d).inp 047130646.td-b3lyp_6-31g+(d).log.xz

047130646.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130646.td-b3lyp_6-31+g(d).gjf (generated)

047130646.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130646.mol 047130646.PUBCHEM 047130646.mol (via Jmol)
047130741.b3lyp_6-31g(d).inp

047130741.b3lyp_6-31g(d).qchem.inp (generated)

047130741.b3lyp_6-31g(d).gjf (generated)

047130741.b3lyp_6-31g(d).firefly.inp (generated)

047130741.b3lyp_6-31g(d).smash.inp (generated)

047130741.b3lyp_6-31g(d).nwchem.inp (generated) 047130741.b3lyp_6-31g(d).log.xz 047130741.td-b3lyp_6-31g+(d).inp 047130741.td-b3lyp_6-31g+(d).log.xz

047130741.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130741.td-b3lyp_6-31+g(d).gjf (generated)

047130741.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130741.mol 047130741.PUBCHEM 047130741.mol (via Jmol)
047130743.b3lyp_6-31g(d).inp

047130743.b3lyp_6-31g(d).qchem.inp (generated)

047130743.b3lyp_6-31g(d).gjf (generated)

047130743.b3lyp_6-31g(d).firefly.inp (generated)

047130743.b3lyp_6-31g(d).smash.inp (generated)

047130743.b3lyp_6-31g(d).nwchem.inp (generated) 047130743.b3lyp_6-31g(d).log.xz 047130743.td-b3lyp_6-31g+(d).inp 047130743.td-b3lyp_6-31g+(d).log.xz

047130743.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130743.td-b3lyp_6-31+g(d).gjf (generated)

047130743.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130743.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130743.mol 047130743.PUBCHEM 047130743.mol (via Jmol)
047130756.b3lyp_6-31g(d).inp

047130756.b3lyp_6-31g(d).qchem.inp (generated)

047130756.b3lyp_6-31g(d).gjf (generated)

047130756.b3lyp_6-31g(d).firefly.inp (generated)

047130756.b3lyp_6-31g(d).smash.inp (generated)

047130756.b3lyp_6-31g(d).nwchem.inp (generated) 047130756.b3lyp_6-31g(d).log.xz 047130756.td-b3lyp_6-31g+(d).inp 047130756.td-b3lyp_6-31g+(d).log.xz

047130756.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130756.td-b3lyp_6-31+g(d).gjf (generated)

047130756.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130756.mol 047130756.PUBCHEM 047130756.mol (via Jmol)
047130784.b3lyp_6-31g(d).inp

047130784.b3lyp_6-31g(d).qchem.inp (generated)

047130784.b3lyp_6-31g(d).gjf (generated)

047130784.b3lyp_6-31g(d).firefly.inp (generated)

047130784.b3lyp_6-31g(d).smash.inp (generated)

047130784.b3lyp_6-31g(d).nwchem.inp (generated) 047130784.b3lyp_6-31g(d).log.xz 047130784.td-b3lyp_6-31g+(d).inp 047130784.td-b3lyp_6-31g+(d).log.xz

047130784.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130784.td-b3lyp_6-31+g(d).gjf (generated)

047130784.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130784.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130784.mol 047130784.PUBCHEM 047130784.mol (via Jmol)
047130868.b3lyp_6-31g(d).inp

047130868.b3lyp_6-31g(d).qchem.inp (generated)

047130868.b3lyp_6-31g(d).gjf (generated)

047130868.b3lyp_6-31g(d).firefly.inp (generated)

047130868.b3lyp_6-31g(d).smash.inp (generated)

047130868.b3lyp_6-31g(d).nwchem.inp (generated) 047130868.b3lyp_6-31g(d).log.xz 047130868.td-b3lyp_6-31g+(d).inp 047130868.td-b3lyp_6-31g+(d).log.xz

047130868.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130868.td-b3lyp_6-31+g(d).gjf (generated)

047130868.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130868.mol 047130868.PUBCHEM 047130868.mol (via Jmol)
047130927.b3lyp_6-31g(d).inp

047130927.b3lyp_6-31g(d).qchem.inp (generated)

047130927.b3lyp_6-31g(d).gjf (generated)

047130927.b3lyp_6-31g(d).firefly.inp (generated)

047130927.b3lyp_6-31g(d).smash.inp (generated)

047130927.b3lyp_6-31g(d).nwchem.inp (generated) 047130927.b3lyp_6-31g(d).log.xz 047130927.mol 047130927.PUBCHEM 047130927.mol (via Jmol)
047130945.b3lyp_6-31g(d).inp

047130945.b3lyp_6-31g(d).qchem.inp (generated)

047130945.b3lyp_6-31g(d).gjf (generated)

047130945.b3lyp_6-31g(d).firefly.inp (generated)

047130945.b3lyp_6-31g(d).smash.inp (generated)

047130945.b3lyp_6-31g(d).nwchem.inp (generated) 047130945.b3lyp_6-31g(d).log.xz 047130945.td-b3lyp_6-31g+(d).inp 047130945.td-b3lyp_6-31g+(d).log.xz

047130945.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130945.td-b3lyp_6-31+g(d).gjf (generated)

047130945.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130945.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130945.mol 047130945.PUBCHEM 047130945.mol (via Jmol)
047130946.b3lyp_6-31g(d).inp

047130946.b3lyp_6-31g(d).qchem.inp (generated)

047130946.b3lyp_6-31g(d).gjf (generated)

047130946.b3lyp_6-31g(d).firefly.inp (generated)

047130946.b3lyp_6-31g(d).smash.inp (generated)

047130946.b3lyp_6-31g(d).nwchem.inp (generated) 047130946.b3lyp_6-31g(d).log.xz 047130946.td-b3lyp_6-31g+(d).inp 047130946.td-b3lyp_6-31g+(d).log.xz

047130946.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130946.td-b3lyp_6-31+g(d).gjf (generated)

047130946.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130946.mol 047130946.PUBCHEM 047130946.mol (via Jmol)
047130949.b3lyp_6-31g(d).inp

047130949.b3lyp_6-31g(d).qchem.inp (generated)

047130949.b3lyp_6-31g(d).gjf (generated)

047130949.b3lyp_6-31g(d).firefly.inp (generated)

047130949.b3lyp_6-31g(d).smash.inp (generated)

047130949.b3lyp_6-31g(d).nwchem.inp (generated) 047130949.b3lyp_6-31g(d).log.xz 047130949.td-b3lyp_6-31g+(d).inp 047130949.td-b3lyp_6-31g+(d).log.xz

047130949.td-b3lyp_6-31+g(d).qchem.inp (generated)

047130949.td-b3lyp_6-31+g(d).gjf (generated)

047130949.td-b3lyp_6-31+g(d).firefly.inp (generated)

047130949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047130949.mol 047130949.PUBCHEM 047130949.mol (via Jmol)
047131081.b3lyp_6-31g(d).inp

047131081.b3lyp_6-31g(d).qchem.inp (generated)

047131081.b3lyp_6-31g(d).gjf (generated)

047131081.b3lyp_6-31g(d).firefly.inp (generated)

047131081.b3lyp_6-31g(d).smash.inp (generated)

047131081.b3lyp_6-31g(d).nwchem.inp (generated) 047131081.b3lyp_6-31g(d).log.xz 047131081.mol 047131081.PUBCHEM 047131081.mol (via Jmol)
047131241.b3lyp_6-31g(d).inp

047131241.b3lyp_6-31g(d).qchem.inp (generated)

047131241.b3lyp_6-31g(d).gjf (generated)

047131241.b3lyp_6-31g(d).firefly.inp (generated)

047131241.b3lyp_6-31g(d).smash.inp (generated)

047131241.b3lyp_6-31g(d).nwchem.inp (generated) 047131241.b3lyp_6-31g(d).log.xz 047131241.td-b3lyp_6-31g+(d).inp 047131241.td-b3lyp_6-31g+(d).log.xz

047131241.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131241.td-b3lyp_6-31+g(d).gjf (generated)

047131241.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131241.mol 047131241.PUBCHEM 047131241.mol (via Jmol)
047131267.b3lyp_6-31g(d).inp

047131267.b3lyp_6-31g(d).qchem.inp (generated)

047131267.b3lyp_6-31g(d).gjf (generated)

047131267.b3lyp_6-31g(d).firefly.inp (generated)

047131267.b3lyp_6-31g(d).smash.inp (generated)

047131267.b3lyp_6-31g(d).nwchem.inp (generated) 047131267.b3lyp_6-31g(d).log.xz 047131267.td-b3lyp_6-31g+(d).inp 047131267.td-b3lyp_6-31g+(d).log.xz

047131267.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131267.td-b3lyp_6-31+g(d).gjf (generated)

047131267.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131267.mol 047131267.PUBCHEM 047131267.mol (via Jmol)
047131338.b3lyp_6-31g(d).inp

047131338.b3lyp_6-31g(d).qchem.inp (generated)

047131338.b3lyp_6-31g(d).gjf (generated)

047131338.b3lyp_6-31g(d).firefly.inp (generated)

047131338.b3lyp_6-31g(d).smash.inp (generated)

047131338.b3lyp_6-31g(d).nwchem.inp (generated) 047131338.b3lyp_6-31g(d).log.xz 047131338.td-b3lyp_6-31g+(d).inp 047131338.td-b3lyp_6-31g+(d).log.xz

047131338.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131338.td-b3lyp_6-31+g(d).gjf (generated)

047131338.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131338.mol 047131338.PUBCHEM 047131338.mol (via Jmol)
047131351.b3lyp_6-31g(d).inp

047131351.b3lyp_6-31g(d).qchem.inp (generated)

047131351.b3lyp_6-31g(d).gjf (generated)

047131351.b3lyp_6-31g(d).firefly.inp (generated)

047131351.b3lyp_6-31g(d).smash.inp (generated)

047131351.b3lyp_6-31g(d).nwchem.inp (generated) 047131351.b3lyp_6-31g(d).log.xz 047131351.mol 047131351.PUBCHEM 047131351.mol (via Jmol)
047131363.b3lyp_6-31g(d).inp

047131363.b3lyp_6-31g(d).qchem.inp (generated)

047131363.b3lyp_6-31g(d).gjf (generated)

047131363.b3lyp_6-31g(d).firefly.inp (generated)

047131363.b3lyp_6-31g(d).smash.inp (generated)

047131363.b3lyp_6-31g(d).nwchem.inp (generated) 047131363.b3lyp_6-31g(d).log.xz 047131363.mol 047131363.PUBCHEM 047131363.mol (via Jmol)
047131457.b3lyp_6-31g(d).inp

047131457.b3lyp_6-31g(d).qchem.inp (generated)

047131457.b3lyp_6-31g(d).gjf (generated)

047131457.b3lyp_6-31g(d).firefly.inp (generated)

047131457.b3lyp_6-31g(d).smash.inp (generated)

047131457.b3lyp_6-31g(d).nwchem.inp (generated) 047131457.b3lyp_6-31g(d).log.xz 047131457.td-b3lyp_6-31g+(d).inp 047131457.td-b3lyp_6-31g+(d).log.xz

047131457.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131457.td-b3lyp_6-31+g(d).gjf (generated)

047131457.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131457.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131457.mol 047131457.PUBCHEM 047131457.mol (via Jmol)
047131568.b3lyp_6-31g(d).inp

047131568.b3lyp_6-31g(d).qchem.inp (generated)

047131568.b3lyp_6-31g(d).gjf (generated)

047131568.b3lyp_6-31g(d).firefly.inp (generated)

047131568.b3lyp_6-31g(d).smash.inp (generated)

047131568.b3lyp_6-31g(d).nwchem.inp (generated) 047131568.b3lyp_6-31g(d).log.xz 047131568.td-b3lyp_6-31g+(d).inp 047131568.td-b3lyp_6-31g+(d).log.xz

047131568.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131568.td-b3lyp_6-31+g(d).gjf (generated)

047131568.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131568.mol 047131568.PUBCHEM 047131568.mol (via Jmol)
047131651.b3lyp_6-31g(d).inp

047131651.b3lyp_6-31g(d).qchem.inp (generated)

047131651.b3lyp_6-31g(d).gjf (generated)

047131651.b3lyp_6-31g(d).firefly.inp (generated)

047131651.b3lyp_6-31g(d).smash.inp (generated)

047131651.b3lyp_6-31g(d).nwchem.inp (generated) 047131651.b3lyp_6-31g(d).log.xz 047131651.td-b3lyp_6-31g+(d).inp 047131651.td-b3lyp_6-31g+(d).log.xz

047131651.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131651.td-b3lyp_6-31+g(d).gjf (generated)

047131651.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131651.mol 047131651.PUBCHEM 047131651.mol (via Jmol)
047131653.b3lyp_6-31g(d).inp

047131653.b3lyp_6-31g(d).qchem.inp (generated)

047131653.b3lyp_6-31g(d).gjf (generated)

047131653.b3lyp_6-31g(d).firefly.inp (generated)

047131653.b3lyp_6-31g(d).smash.inp (generated)

047131653.b3lyp_6-31g(d).nwchem.inp (generated) 047131653.b3lyp_6-31g(d).log.xz 047131653.td-b3lyp_6-31g+(d).inp 047131653.td-b3lyp_6-31g+(d).log.xz

047131653.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131653.td-b3lyp_6-31+g(d).gjf (generated)

047131653.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131653.mol 047131653.PUBCHEM 047131653.mol (via Jmol)
047131681.b3lyp_6-31g(d).inp

047131681.b3lyp_6-31g(d).qchem.inp (generated)

047131681.b3lyp_6-31g(d).gjf (generated)

047131681.b3lyp_6-31g(d).firefly.inp (generated)

047131681.b3lyp_6-31g(d).smash.inp (generated)

047131681.b3lyp_6-31g(d).nwchem.inp (generated) 047131681.b3lyp_6-31g(d).log.xz 047131681.mol 047131681.PUBCHEM 047131681.mol (via Jmol)
047131690.b3lyp_6-31g(d).inp

047131690.b3lyp_6-31g(d).qchem.inp (generated)

047131690.b3lyp_6-31g(d).gjf (generated)

047131690.b3lyp_6-31g(d).firefly.inp (generated)

047131690.b3lyp_6-31g(d).smash.inp (generated)

047131690.b3lyp_6-31g(d).nwchem.inp (generated) 047131690.b3lyp_6-31g(d).log.xz 047131690.td-b3lyp_6-31g+(d).inp 047131690.td-b3lyp_6-31g+(d).log.xz

047131690.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131690.td-b3lyp_6-31+g(d).gjf (generated)

047131690.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131690.mol 047131690.PUBCHEM 047131690.mol (via Jmol)
047131761.b3lyp_6-31g(d).inp

047131761.b3lyp_6-31g(d).qchem.inp (generated)

047131761.b3lyp_6-31g(d).gjf (generated)

047131761.b3lyp_6-31g(d).firefly.inp (generated)

047131761.b3lyp_6-31g(d).smash.inp (generated)

047131761.b3lyp_6-31g(d).nwchem.inp (generated) 047131761.b3lyp_6-31g(d).log.xz 047131761.td-b3lyp_6-31g+(d).inp 047131761.td-b3lyp_6-31g+(d).log.xz

047131761.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131761.td-b3lyp_6-31+g(d).gjf (generated)

047131761.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131761.mol 047131761.PUBCHEM 047131761.mol (via Jmol)
047131768.b3lyp_6-31g(d).inp

047131768.b3lyp_6-31g(d).qchem.inp (generated)

047131768.b3lyp_6-31g(d).gjf (generated)

047131768.b3lyp_6-31g(d).firefly.inp (generated)

047131768.b3lyp_6-31g(d).smash.inp (generated)

047131768.b3lyp_6-31g(d).nwchem.inp (generated) 047131768.b3lyp_6-31g(d).log.xz 047131768.td-b3lyp_6-31g+(d).inp 047131768.td-b3lyp_6-31g+(d).log.xz

047131768.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131768.td-b3lyp_6-31+g(d).gjf (generated)

047131768.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131768.mol 047131768.PUBCHEM 047131768.mol (via Jmol)
047131898.b3lyp_6-31g(d).inp

047131898.b3lyp_6-31g(d).qchem.inp (generated)

047131898.b3lyp_6-31g(d).gjf (generated)

047131898.b3lyp_6-31g(d).firefly.inp (generated)

047131898.b3lyp_6-31g(d).smash.inp (generated)

047131898.b3lyp_6-31g(d).nwchem.inp (generated) 047131898.b3lyp_6-31g(d).log.xz 047131898.mol 047131898.PUBCHEM 047131898.mol (via Jmol)
047131929.b3lyp_6-31g(d).inp

047131929.b3lyp_6-31g(d).qchem.inp (generated)

047131929.b3lyp_6-31g(d).gjf (generated)

047131929.b3lyp_6-31g(d).firefly.inp (generated)

047131929.b3lyp_6-31g(d).smash.inp (generated)

047131929.b3lyp_6-31g(d).nwchem.inp (generated) 047131929.b3lyp_6-31g(d).log.xz 047131929.td-b3lyp_6-31g+(d).inp 047131929.td-b3lyp_6-31g+(d).log.xz

047131929.td-b3lyp_6-31+g(d).qchem.inp (generated)

047131929.td-b3lyp_6-31+g(d).gjf (generated)

047131929.td-b3lyp_6-31+g(d).firefly.inp (generated)

047131929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047131929.mol 047131929.PUBCHEM 047131929.mol (via Jmol)
047132011.b3lyp_6-31g(d).inp

047132011.b3lyp_6-31g(d).qchem.inp (generated)

047132011.b3lyp_6-31g(d).gjf (generated)

047132011.b3lyp_6-31g(d).firefly.inp (generated)

047132011.b3lyp_6-31g(d).smash.inp (generated)

047132011.b3lyp_6-31g(d).nwchem.inp (generated) 047132011.b3lyp_6-31g(d).log.xz 047132011.td-b3lyp_6-31g+(d).inp 047132011.td-b3lyp_6-31g+(d).log.xz

047132011.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132011.td-b3lyp_6-31+g(d).gjf (generated)

047132011.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132011.mol 047132011.PUBCHEM 047132011.mol (via Jmol)
047132113.b3lyp_6-31g(d).inp

047132113.b3lyp_6-31g(d).qchem.inp (generated)

047132113.b3lyp_6-31g(d).gjf (generated)

047132113.b3lyp_6-31g(d).firefly.inp (generated)

047132113.b3lyp_6-31g(d).smash.inp (generated)

047132113.b3lyp_6-31g(d).nwchem.inp (generated) 047132113.b3lyp_6-31g(d).log.xz 047132113.td-b3lyp_6-31g+(d).inp 047132113.td-b3lyp_6-31g+(d).log.xz

047132113.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132113.td-b3lyp_6-31+g(d).gjf (generated)

047132113.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132113.mol 047132113.PUBCHEM 047132113.mol (via Jmol)
047132126.b3lyp_6-31g(d).inp

047132126.b3lyp_6-31g(d).qchem.inp (generated)

047132126.b3lyp_6-31g(d).gjf (generated)

047132126.b3lyp_6-31g(d).firefly.inp (generated)

047132126.b3lyp_6-31g(d).smash.inp (generated)

047132126.b3lyp_6-31g(d).nwchem.inp (generated) 047132126.b3lyp_6-31g(d).log.xz 047132126.td-b3lyp_6-31g+(d).inp 047132126.td-b3lyp_6-31g+(d).log.xz

047132126.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132126.td-b3lyp_6-31+g(d).gjf (generated)

047132126.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132126.mol 047132126.PUBCHEM 047132126.mol (via Jmol)
047132129.b3lyp_6-31g(d).inp

047132129.b3lyp_6-31g(d).qchem.inp (generated)

047132129.b3lyp_6-31g(d).gjf (generated)

047132129.b3lyp_6-31g(d).firefly.inp (generated)

047132129.b3lyp_6-31g(d).smash.inp (generated)

047132129.b3lyp_6-31g(d).nwchem.inp (generated) 047132129.b3lyp_6-31g(d).log.xz 047132129.td-b3lyp_6-31g+(d).inp 047132129.td-b3lyp_6-31g+(d).log.xz

047132129.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132129.td-b3lyp_6-31+g(d).gjf (generated)

047132129.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132129.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132129.mol 047132129.PUBCHEM 047132129.mol (via Jmol)
047132132.b3lyp_6-31g(d).inp

047132132.b3lyp_6-31g(d).qchem.inp (generated)

047132132.b3lyp_6-31g(d).gjf (generated)

047132132.b3lyp_6-31g(d).firefly.inp (generated)

047132132.b3lyp_6-31g(d).smash.inp (generated)

047132132.b3lyp_6-31g(d).nwchem.inp (generated) 047132132.b3lyp_6-31g(d).log.xz 047132132.td-b3lyp_6-31g+(d).inp 047132132.td-b3lyp_6-31g+(d).log.xz

047132132.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132132.td-b3lyp_6-31+g(d).gjf (generated)

047132132.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132132.mol 047132132.PUBCHEM 047132132.mol (via Jmol)
047132260.b3lyp_6-31g(d).inp

047132260.b3lyp_6-31g(d).qchem.inp (generated)

047132260.b3lyp_6-31g(d).gjf (generated)

047132260.b3lyp_6-31g(d).firefly.inp (generated)

047132260.b3lyp_6-31g(d).smash.inp (generated)

047132260.b3lyp_6-31g(d).nwchem.inp (generated) 047132260.b3lyp_6-31g(d).log.xz 047132260.td-b3lyp_6-31g+(d).inp 047132260.td-b3lyp_6-31g+(d).log.xz

047132260.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132260.td-b3lyp_6-31+g(d).gjf (generated)

047132260.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132260.mol 047132260.PUBCHEM 047132260.mol (via Jmol)
047132293.b3lyp_6-31g(d).inp

047132293.b3lyp_6-31g(d).qchem.inp (generated)

047132293.b3lyp_6-31g(d).gjf (generated)

047132293.b3lyp_6-31g(d).firefly.inp (generated)

047132293.b3lyp_6-31g(d).smash.inp (generated)

047132293.b3lyp_6-31g(d).nwchem.inp (generated) 047132293.b3lyp_6-31g(d).log.xz 047132293.mol 047132293.PUBCHEM 047132293.mol (via Jmol)
047132319.b3lyp_6-31g(d).inp

047132319.b3lyp_6-31g(d).qchem.inp (generated)

047132319.b3lyp_6-31g(d).gjf (generated)

047132319.b3lyp_6-31g(d).firefly.inp (generated)

047132319.b3lyp_6-31g(d).smash.inp (generated)

047132319.b3lyp_6-31g(d).nwchem.inp (generated) 047132319.b3lyp_6-31g(d).log.xz 047132319.mol 047132319.PUBCHEM 047132319.mol (via Jmol)
047132426.b3lyp_6-31g(d).inp

047132426.b3lyp_6-31g(d).qchem.inp (generated)

047132426.b3lyp_6-31g(d).gjf (generated)

047132426.b3lyp_6-31g(d).firefly.inp (generated)

047132426.b3lyp_6-31g(d).smash.inp (generated)

047132426.b3lyp_6-31g(d).nwchem.inp (generated) 047132426.b3lyp_6-31g(d).log.xz 047132426.mol 047132426.PUBCHEM 047132426.mol (via Jmol)
047132438.b3lyp_6-31g(d).inp

047132438.b3lyp_6-31g(d).qchem.inp (generated)

047132438.b3lyp_6-31g(d).gjf (generated)

047132438.b3lyp_6-31g(d).firefly.inp (generated)

047132438.b3lyp_6-31g(d).smash.inp (generated)

047132438.b3lyp_6-31g(d).nwchem.inp (generated) 047132438.b3lyp_6-31g(d).log.xz 047132438.td-b3lyp_6-31g+(d).inp 047132438.td-b3lyp_6-31g+(d).log.xz

047132438.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132438.td-b3lyp_6-31+g(d).gjf (generated)

047132438.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132438.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132438.mol 047132438.PUBCHEM 047132438.mol (via Jmol)
047132639.b3lyp_6-31g(d).inp

047132639.b3lyp_6-31g(d).qchem.inp (generated)

047132639.b3lyp_6-31g(d).gjf (generated)

047132639.b3lyp_6-31g(d).firefly.inp (generated)

047132639.b3lyp_6-31g(d).smash.inp (generated)

047132639.b3lyp_6-31g(d).nwchem.inp (generated) 047132639.b3lyp_6-31g(d).log.xz 047132639.td-b3lyp_6-31g+(d).inp 047132639.td-b3lyp_6-31g+(d).log.xz

047132639.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132639.td-b3lyp_6-31+g(d).gjf (generated)

047132639.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132639.mol 047132639.PUBCHEM 047132639.mol (via Jmol)
047132669.b3lyp_6-31g(d).inp

047132669.b3lyp_6-31g(d).qchem.inp (generated)

047132669.b3lyp_6-31g(d).gjf (generated)

047132669.b3lyp_6-31g(d).firefly.inp (generated)

047132669.b3lyp_6-31g(d).smash.inp (generated)

047132669.b3lyp_6-31g(d).nwchem.inp (generated) 047132669.b3lyp_6-31g(d).log.xz 047132669.td-b3lyp_6-31g+(d).inp 047132669.td-b3lyp_6-31g+(d).log.xz

047132669.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132669.td-b3lyp_6-31+g(d).gjf (generated)

047132669.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132669.mol 047132669.PUBCHEM 047132669.mol (via Jmol)
047132688.b3lyp_6-31g(d).inp

047132688.b3lyp_6-31g(d).qchem.inp (generated)

047132688.b3lyp_6-31g(d).gjf (generated)

047132688.b3lyp_6-31g(d).firefly.inp (generated)

047132688.b3lyp_6-31g(d).smash.inp (generated)

047132688.b3lyp_6-31g(d).nwchem.inp (generated) 047132688.b3lyp_6-31g(d).log.xz 047132688.td-b3lyp_6-31g+(d).inp 047132688.td-b3lyp_6-31g+(d).log.xz

047132688.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132688.td-b3lyp_6-31+g(d).gjf (generated)

047132688.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132688.mol 047132688.PUBCHEM 047132688.mol (via Jmol)
047132818.b3lyp_6-31g(d).inp

047132818.b3lyp_6-31g(d).qchem.inp (generated)

047132818.b3lyp_6-31g(d).gjf (generated)

047132818.b3lyp_6-31g(d).firefly.inp (generated)

047132818.b3lyp_6-31g(d).smash.inp (generated)

047132818.b3lyp_6-31g(d).nwchem.inp (generated) 047132818.b3lyp_6-31g(d).log.xz 047132818.td-b3lyp_6-31g+(d).inp 047132818.td-b3lyp_6-31g+(d).log.xz

047132818.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132818.td-b3lyp_6-31+g(d).gjf (generated)

047132818.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132818.mol 047132818.PUBCHEM 047132818.mol (via Jmol)
047132843.b3lyp_6-31g(d).inp

047132843.b3lyp_6-31g(d).qchem.inp (generated)

047132843.b3lyp_6-31g(d).gjf (generated)

047132843.b3lyp_6-31g(d).firefly.inp (generated)

047132843.b3lyp_6-31g(d).smash.inp (generated)

047132843.b3lyp_6-31g(d).nwchem.inp (generated) 047132843.b3lyp_6-31g(d).log.xz 047132843.td-b3lyp_6-31g+(d).inp 047132843.td-b3lyp_6-31g+(d).log.xz

047132843.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132843.td-b3lyp_6-31+g(d).gjf (generated)

047132843.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132843.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132843.mol 047132843.PUBCHEM 047132843.mol (via Jmol)
047132894.b3lyp_6-31g(d).inp

047132894.b3lyp_6-31g(d).qchem.inp (generated)

047132894.b3lyp_6-31g(d).gjf (generated)

047132894.b3lyp_6-31g(d).firefly.inp (generated)

047132894.b3lyp_6-31g(d).smash.inp (generated)

047132894.b3lyp_6-31g(d).nwchem.inp (generated) 047132894.b3lyp_6-31g(d).log.xz 047132894.td-b3lyp_6-31g+(d).inp 047132894.td-b3lyp_6-31g+(d).log.xz

047132894.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132894.td-b3lyp_6-31+g(d).gjf (generated)

047132894.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132894.mol 047132894.PUBCHEM 047132894.mol (via Jmol)
047132906.b3lyp_6-31g(d).inp

047132906.b3lyp_6-31g(d).qchem.inp (generated)

047132906.b3lyp_6-31g(d).gjf (generated)

047132906.b3lyp_6-31g(d).firefly.inp (generated)

047132906.b3lyp_6-31g(d).smash.inp (generated)

047132906.b3lyp_6-31g(d).nwchem.inp (generated) 047132906.b3lyp_6-31g(d).log.xz 047132906.td-b3lyp_6-31g+(d).inp 047132906.td-b3lyp_6-31g+(d).log.xz

047132906.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132906.td-b3lyp_6-31+g(d).gjf (generated)

047132906.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132906.mol 047132906.PUBCHEM 047132906.mol (via Jmol)
047132907.b3lyp_6-31g(d).inp

047132907.b3lyp_6-31g(d).qchem.inp (generated)

047132907.b3lyp_6-31g(d).gjf (generated)

047132907.b3lyp_6-31g(d).firefly.inp (generated)

047132907.b3lyp_6-31g(d).smash.inp (generated)

047132907.b3lyp_6-31g(d).nwchem.inp (generated) 047132907.b3lyp_6-31g(d).log.xz 047132907.td-b3lyp_6-31g+(d).inp 047132907.td-b3lyp_6-31g+(d).log.xz

047132907.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132907.td-b3lyp_6-31+g(d).gjf (generated)

047132907.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132907.mol 047132907.PUBCHEM 047132907.mol (via Jmol)
047132908.b3lyp_6-31g(d).inp

047132908.b3lyp_6-31g(d).qchem.inp (generated)

047132908.b3lyp_6-31g(d).gjf (generated)

047132908.b3lyp_6-31g(d).firefly.inp (generated)

047132908.b3lyp_6-31g(d).smash.inp (generated)

047132908.b3lyp_6-31g(d).nwchem.inp (generated) 047132908.b3lyp_6-31g(d).log.xz 047132908.mol 047132908.PUBCHEM 047132908.mol (via Jmol)
047132909.b3lyp_6-31g(d).inp

047132909.b3lyp_6-31g(d).qchem.inp (generated)

047132909.b3lyp_6-31g(d).gjf (generated)

047132909.b3lyp_6-31g(d).firefly.inp (generated)

047132909.b3lyp_6-31g(d).smash.inp (generated)

047132909.b3lyp_6-31g(d).nwchem.inp (generated) 047132909.b3lyp_6-31g(d).log.xz 047132909.td-b3lyp_6-31g+(d).inp 047132909.td-b3lyp_6-31g+(d).log.xz

047132909.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132909.td-b3lyp_6-31+g(d).gjf (generated)

047132909.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132909.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132909.mol 047132909.PUBCHEM 047132909.mol (via Jmol)
047132915.b3lyp_6-31g(d).inp

047132915.b3lyp_6-31g(d).qchem.inp (generated)

047132915.b3lyp_6-31g(d).gjf (generated)

047132915.b3lyp_6-31g(d).firefly.inp (generated)

047132915.b3lyp_6-31g(d).smash.inp (generated)

047132915.b3lyp_6-31g(d).nwchem.inp (generated) 047132915.b3lyp_6-31g(d).log.xz 047132915.td-b3lyp_6-31g+(d).inp 047132915.td-b3lyp_6-31g+(d).log.xz

047132915.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132915.td-b3lyp_6-31+g(d).gjf (generated)

047132915.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132915.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132915.mol 047132915.PUBCHEM 047132915.mol (via Jmol)
047132934.b3lyp_6-31g(d).inp

047132934.b3lyp_6-31g(d).qchem.inp (generated)

047132934.b3lyp_6-31g(d).gjf (generated)

047132934.b3lyp_6-31g(d).firefly.inp (generated)

047132934.b3lyp_6-31g(d).smash.inp (generated)

047132934.b3lyp_6-31g(d).nwchem.inp (generated) 047132934.b3lyp_6-31g(d).log.xz 047132934.td-b3lyp_6-31g+(d).inp 047132934.td-b3lyp_6-31g+(d).log.xz

047132934.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132934.td-b3lyp_6-31+g(d).gjf (generated)

047132934.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132934.mol 047132934.PUBCHEM 047132934.mol (via Jmol)
047132961.b3lyp_6-31g(d).inp

047132961.b3lyp_6-31g(d).qchem.inp (generated)

047132961.b3lyp_6-31g(d).gjf (generated)

047132961.b3lyp_6-31g(d).firefly.inp (generated)

047132961.b3lyp_6-31g(d).smash.inp (generated)

047132961.b3lyp_6-31g(d).nwchem.inp (generated) 047132961.b3lyp_6-31g(d).log.xz 047132961.td-b3lyp_6-31g+(d).inp 047132961.td-b3lyp_6-31g+(d).log.xz

047132961.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132961.td-b3lyp_6-31+g(d).gjf (generated)

047132961.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132961.mol 047132961.PUBCHEM 047132961.mol (via Jmol)
047132962.b3lyp_6-31g(d).inp

047132962.b3lyp_6-31g(d).qchem.inp (generated)

047132962.b3lyp_6-31g(d).gjf (generated)

047132962.b3lyp_6-31g(d).firefly.inp (generated)

047132962.b3lyp_6-31g(d).smash.inp (generated)

047132962.b3lyp_6-31g(d).nwchem.inp (generated) 047132962.b3lyp_6-31g(d).log.xz 047132962.td-b3lyp_6-31g+(d).inp 047132962.td-b3lyp_6-31g+(d).log.xz

047132962.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132962.td-b3lyp_6-31+g(d).gjf (generated)

047132962.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132962.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132962.mol 047132962.PUBCHEM 047132962.mol (via Jmol)
047132967.b3lyp_6-31g(d).inp

047132967.b3lyp_6-31g(d).qchem.inp (generated)

047132967.b3lyp_6-31g(d).gjf (generated)

047132967.b3lyp_6-31g(d).firefly.inp (generated)

047132967.b3lyp_6-31g(d).smash.inp (generated)

047132967.b3lyp_6-31g(d).nwchem.inp (generated) 047132967.b3lyp_6-31g(d).log.xz 047132967.mol 047132967.PUBCHEM 047132967.mol (via Jmol)
047132983.b3lyp_6-31g(d).inp

047132983.b3lyp_6-31g(d).qchem.inp (generated)

047132983.b3lyp_6-31g(d).gjf (generated)

047132983.b3lyp_6-31g(d).firefly.inp (generated)

047132983.b3lyp_6-31g(d).smash.inp (generated)

047132983.b3lyp_6-31g(d).nwchem.inp (generated) 047132983.b3lyp_6-31g(d).log.xz 047132983.td-b3lyp_6-31g+(d).inp 047132983.td-b3lyp_6-31g+(d).log.xz

047132983.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132983.td-b3lyp_6-31+g(d).gjf (generated)

047132983.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132983.mol 047132983.PUBCHEM 047132983.mol (via Jmol)
047132986.b3lyp_6-31g(d).inp

047132986.b3lyp_6-31g(d).qchem.inp (generated)

047132986.b3lyp_6-31g(d).gjf (generated)

047132986.b3lyp_6-31g(d).firefly.inp (generated)

047132986.b3lyp_6-31g(d).smash.inp (generated)

047132986.b3lyp_6-31g(d).nwchem.inp (generated) 047132986.b3lyp_6-31g(d).log.xz 047132986.td-b3lyp_6-31g+(d).inp 047132986.td-b3lyp_6-31g+(d).log.xz

047132986.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132986.td-b3lyp_6-31+g(d).gjf (generated)

047132986.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132986.mol 047132986.PUBCHEM 047132986.mol (via Jmol)
047132991.b3lyp_6-31g(d).inp

047132991.b3lyp_6-31g(d).qchem.inp (generated)

047132991.b3lyp_6-31g(d).gjf (generated)

047132991.b3lyp_6-31g(d).firefly.inp (generated)

047132991.b3lyp_6-31g(d).smash.inp (generated)

047132991.b3lyp_6-31g(d).nwchem.inp (generated) 047132991.b3lyp_6-31g(d).log.xz 047132991.td-b3lyp_6-31g+(d).inp 047132991.td-b3lyp_6-31g+(d).log.xz

047132991.td-b3lyp_6-31+g(d).qchem.inp (generated)

047132991.td-b3lyp_6-31+g(d).gjf (generated)

047132991.td-b3lyp_6-31+g(d).firefly.inp (generated)

047132991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047132991.mol 047132991.PUBCHEM 047132991.mol (via Jmol)
047133035.b3lyp_6-31g(d).inp

047133035.b3lyp_6-31g(d).qchem.inp (generated)

047133035.b3lyp_6-31g(d).gjf (generated)

047133035.b3lyp_6-31g(d).firefly.inp (generated)

047133035.b3lyp_6-31g(d).smash.inp (generated)

047133035.b3lyp_6-31g(d).nwchem.inp (generated) 047133035.b3lyp_6-31g(d).log.xz 047133035.td-b3lyp_6-31g+(d).inp 047133035.td-b3lyp_6-31g+(d).log.xz

047133035.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133035.td-b3lyp_6-31+g(d).gjf (generated)

047133035.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133035.mol 047133035.PUBCHEM 047133035.mol (via Jmol)
047133459.b3lyp_6-31g(d).inp

047133459.b3lyp_6-31g(d).qchem.inp (generated)

047133459.b3lyp_6-31g(d).gjf (generated)

047133459.b3lyp_6-31g(d).firefly.inp (generated)

047133459.b3lyp_6-31g(d).smash.inp (generated)

047133459.b3lyp_6-31g(d).nwchem.inp (generated) 047133459.b3lyp_6-31g(d).log.xz 047133459.td-b3lyp_6-31g+(d).inp 047133459.td-b3lyp_6-31g+(d).log.xz

047133459.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133459.td-b3lyp_6-31+g(d).gjf (generated)

047133459.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133459.mol 047133459.PUBCHEM 047133459.mol (via Jmol)
047133577.b3lyp_6-31g(d).inp

047133577.b3lyp_6-31g(d).qchem.inp (generated)

047133577.b3lyp_6-31g(d).gjf (generated)

047133577.b3lyp_6-31g(d).firefly.inp (generated)

047133577.b3lyp_6-31g(d).smash.inp (generated)

047133577.b3lyp_6-31g(d).nwchem.inp (generated) 047133577.b3lyp_6-31g(d).log.xz 047133577.mol 047133577.PUBCHEM 047133577.mol (via Jmol)
047133621.b3lyp_6-31g(d).inp

047133621.b3lyp_6-31g(d).qchem.inp (generated)

047133621.b3lyp_6-31g(d).gjf (generated)

047133621.b3lyp_6-31g(d).firefly.inp (generated)

047133621.b3lyp_6-31g(d).smash.inp (generated)

047133621.b3lyp_6-31g(d).nwchem.inp (generated) 047133621.b3lyp_6-31g(d).log.xz 047133621.mol 047133621.PUBCHEM 047133621.mol (via Jmol)
047133626.b3lyp_6-31g(d).inp

047133626.b3lyp_6-31g(d).qchem.inp (generated)

047133626.b3lyp_6-31g(d).gjf (generated)

047133626.b3lyp_6-31g(d).firefly.inp (generated)

047133626.b3lyp_6-31g(d).smash.inp (generated)

047133626.b3lyp_6-31g(d).nwchem.inp (generated) 047133626.b3lyp_6-31g(d).log.xz 047133626.td-b3lyp_6-31g+(d).inp 047133626.td-b3lyp_6-31g+(d).log.xz

047133626.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133626.td-b3lyp_6-31+g(d).gjf (generated)

047133626.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133626.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133626.mol 047133626.PUBCHEM 047133626.mol (via Jmol)
047133637.b3lyp_6-31g(d).inp

047133637.b3lyp_6-31g(d).qchem.inp (generated)

047133637.b3lyp_6-31g(d).gjf (generated)

047133637.b3lyp_6-31g(d).firefly.inp (generated)

047133637.b3lyp_6-31g(d).smash.inp (generated)

047133637.b3lyp_6-31g(d).nwchem.inp (generated) 047133637.b3lyp_6-31g(d).log.xz 047133637.td-b3lyp_6-31g+(d).inp 047133637.td-b3lyp_6-31g+(d).log.xz

047133637.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133637.td-b3lyp_6-31+g(d).gjf (generated)

047133637.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133637.mol 047133637.PUBCHEM 047133637.mol (via Jmol)
047133638.b3lyp_6-31g(d).inp

047133638.b3lyp_6-31g(d).qchem.inp (generated)

047133638.b3lyp_6-31g(d).gjf (generated)

047133638.b3lyp_6-31g(d).firefly.inp (generated)

047133638.b3lyp_6-31g(d).smash.inp (generated)

047133638.b3lyp_6-31g(d).nwchem.inp (generated) 047133638.b3lyp_6-31g(d).log.xz 047133638.mol 047133638.PUBCHEM 047133638.mol (via Jmol)
047133646.b3lyp_6-31g(d).inp

047133646.b3lyp_6-31g(d).qchem.inp (generated)

047133646.b3lyp_6-31g(d).gjf (generated)

047133646.b3lyp_6-31g(d).firefly.inp (generated)

047133646.b3lyp_6-31g(d).smash.inp (generated)

047133646.b3lyp_6-31g(d).nwchem.inp (generated) 047133646.b3lyp_6-31g(d).log.xz 047133646.td-b3lyp_6-31g+(d).inp 047133646.td-b3lyp_6-31g+(d).log.xz

047133646.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133646.td-b3lyp_6-31+g(d).gjf (generated)

047133646.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133646.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133646.mol 047133646.PUBCHEM 047133646.mol (via Jmol)
047133652.b3lyp_6-31g(d).inp

047133652.b3lyp_6-31g(d).qchem.inp (generated)

047133652.b3lyp_6-31g(d).gjf (generated)

047133652.b3lyp_6-31g(d).firefly.inp (generated)

047133652.b3lyp_6-31g(d).smash.inp (generated)

047133652.b3lyp_6-31g(d).nwchem.inp (generated) 047133652.b3lyp_6-31g(d).log.xz 047133652.td-b3lyp_6-31g+(d).inp 047133652.td-b3lyp_6-31g+(d).log.xz

047133652.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133652.td-b3lyp_6-31+g(d).gjf (generated)

047133652.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133652.mol 047133652.PUBCHEM 047133652.mol (via Jmol)
047133657.b3lyp_6-31g(d).inp

047133657.b3lyp_6-31g(d).qchem.inp (generated)

047133657.b3lyp_6-31g(d).gjf (generated)

047133657.b3lyp_6-31g(d).firefly.inp (generated)

047133657.b3lyp_6-31g(d).smash.inp (generated)

047133657.b3lyp_6-31g(d).nwchem.inp (generated) 047133657.b3lyp_6-31g(d).log.xz 047133657.mol 047133657.PUBCHEM 047133657.mol (via Jmol)
047133661.b3lyp_6-31g(d).inp

047133661.b3lyp_6-31g(d).qchem.inp (generated)

047133661.b3lyp_6-31g(d).gjf (generated)

047133661.b3lyp_6-31g(d).firefly.inp (generated)

047133661.b3lyp_6-31g(d).smash.inp (generated)

047133661.b3lyp_6-31g(d).nwchem.inp (generated) 047133661.b3lyp_6-31g(d).log.xz 047133661.td-b3lyp_6-31g+(d).inp 047133661.td-b3lyp_6-31g+(d).log.xz

047133661.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133661.td-b3lyp_6-31+g(d).gjf (generated)

047133661.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133661.mol 047133661.PUBCHEM 047133661.mol (via Jmol)
047133741.b3lyp_6-31g(d).inp

047133741.b3lyp_6-31g(d).qchem.inp (generated)

047133741.b3lyp_6-31g(d).gjf (generated)

047133741.b3lyp_6-31g(d).firefly.inp (generated)

047133741.b3lyp_6-31g(d).smash.inp (generated)

047133741.b3lyp_6-31g(d).nwchem.inp (generated) 047133741.b3lyp_6-31g(d).log.xz 047133741.td-b3lyp_6-31g+(d).inp 047133741.td-b3lyp_6-31g+(d).log.xz

047133741.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133741.td-b3lyp_6-31+g(d).gjf (generated)

047133741.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133741.mol 047133741.PUBCHEM 047133741.mol (via Jmol)
047133875.b3lyp_6-31g(d).inp

047133875.b3lyp_6-31g(d).qchem.inp (generated)

047133875.b3lyp_6-31g(d).gjf (generated)

047133875.b3lyp_6-31g(d).firefly.inp (generated)

047133875.b3lyp_6-31g(d).smash.inp (generated)

047133875.b3lyp_6-31g(d).nwchem.inp (generated) 047133875.b3lyp_6-31g(d).log.xz 047133875.td-b3lyp_6-31g+(d).inp 047133875.td-b3lyp_6-31g+(d).log.xz

047133875.td-b3lyp_6-31+g(d).qchem.inp (generated)

047133875.td-b3lyp_6-31+g(d).gjf (generated)

047133875.td-b3lyp_6-31+g(d).firefly.inp (generated)

047133875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047133875.mol 047133875.PUBCHEM 047133875.mol (via Jmol)
047133967.b3lyp_6-31g(d).inp

047133967.b3lyp_6-31g(d).qchem.inp (generated)

047133967.b3lyp_6-31g(d).gjf (generated)

047133967.b3lyp_6-31g(d).firefly.inp (generated)

047133967.b3lyp_6-31g(d).smash.inp (generated)

047133967.b3lyp_6-31g(d).nwchem.inp (generated) 047133967.b3lyp_6-31g(d).log.xz 047133967.mol 047133967.PUBCHEM 047133967.mol (via Jmol)
047134068.b3lyp_6-31g(d).inp

047134068.b3lyp_6-31g(d).qchem.inp (generated)

047134068.b3lyp_6-31g(d).gjf (generated)

047134068.b3lyp_6-31g(d).firefly.inp (generated)

047134068.b3lyp_6-31g(d).smash.inp (generated)

047134068.b3lyp_6-31g(d).nwchem.inp (generated) 047134068.b3lyp_6-31g(d).log.xz 047134068.mol 047134068.PUBCHEM 047134068.mol (via Jmol)
047134224.b3lyp_6-31g(d).inp

047134224.b3lyp_6-31g(d).qchem.inp (generated)

047134224.b3lyp_6-31g(d).gjf (generated)

047134224.b3lyp_6-31g(d).firefly.inp (generated)

047134224.b3lyp_6-31g(d).smash.inp (generated)

047134224.b3lyp_6-31g(d).nwchem.inp (generated) 047134224.b3lyp_6-31g(d).log.xz 047134224.mol 047134224.PUBCHEM 047134224.mol (via Jmol)
047134255.b3lyp_6-31g(d).inp

047134255.b3lyp_6-31g(d).qchem.inp (generated)

047134255.b3lyp_6-31g(d).gjf (generated)

047134255.b3lyp_6-31g(d).firefly.inp (generated)

047134255.b3lyp_6-31g(d).smash.inp (generated)

047134255.b3lyp_6-31g(d).nwchem.inp (generated) 047134255.b3lyp_6-31g(d).log.xz 047134255.td-b3lyp_6-31g+(d).inp 047134255.td-b3lyp_6-31g+(d).log.xz

047134255.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134255.td-b3lyp_6-31+g(d).gjf (generated)

047134255.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134255.mol 047134255.PUBCHEM 047134255.mol (via Jmol)
047134380.b3lyp_6-31g(d).inp

047134380.b3lyp_6-31g(d).qchem.inp (generated)

047134380.b3lyp_6-31g(d).gjf (generated)

047134380.b3lyp_6-31g(d).firefly.inp (generated)

047134380.b3lyp_6-31g(d).smash.inp (generated)

047134380.b3lyp_6-31g(d).nwchem.inp (generated) 047134380.b3lyp_6-31g(d).log.xz 047134380.mol 047134380.PUBCHEM 047134380.mol (via Jmol)
047134381.b3lyp_6-31g(d).inp

047134381.b3lyp_6-31g(d).qchem.inp (generated)

047134381.b3lyp_6-31g(d).gjf (generated)

047134381.b3lyp_6-31g(d).firefly.inp (generated)

047134381.b3lyp_6-31g(d).smash.inp (generated)

047134381.b3lyp_6-31g(d).nwchem.inp (generated) 047134381.b3lyp_6-31g(d).log.xz 047134381.td-b3lyp_6-31g+(d).inp 047134381.td-b3lyp_6-31g+(d).log.xz

047134381.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134381.td-b3lyp_6-31+g(d).gjf (generated)

047134381.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134381.mol 047134381.PUBCHEM 047134381.mol (via Jmol)
047134525.b3lyp_6-31g(d).inp

047134525.b3lyp_6-31g(d).qchem.inp (generated)

047134525.b3lyp_6-31g(d).gjf (generated)

047134525.b3lyp_6-31g(d).firefly.inp (generated)

047134525.b3lyp_6-31g(d).smash.inp (generated)

047134525.b3lyp_6-31g(d).nwchem.inp (generated) 047134525.b3lyp_6-31g(d).log.xz 047134525.td-b3lyp_6-31g+(d).inp 047134525.td-b3lyp_6-31g+(d).log.xz

047134525.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134525.td-b3lyp_6-31+g(d).gjf (generated)

047134525.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134525.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134525.mol 047134525.PUBCHEM 047134525.mol (via Jmol)
047134652.b3lyp_6-31g(d).inp

047134652.b3lyp_6-31g(d).qchem.inp (generated)

047134652.b3lyp_6-31g(d).gjf (generated)

047134652.b3lyp_6-31g(d).firefly.inp (generated)

047134652.b3lyp_6-31g(d).smash.inp (generated)

047134652.b3lyp_6-31g(d).nwchem.inp (generated) 047134652.b3lyp_6-31g(d).log.xz 047134652.mol 047134652.PUBCHEM 047134652.mol (via Jmol)
047134670.b3lyp_6-31g(d).inp

047134670.b3lyp_6-31g(d).qchem.inp (generated)

047134670.b3lyp_6-31g(d).gjf (generated)

047134670.b3lyp_6-31g(d).firefly.inp (generated)

047134670.b3lyp_6-31g(d).smash.inp (generated)

047134670.b3lyp_6-31g(d).nwchem.inp (generated) 047134670.b3lyp_6-31g(d).log.xz 047134670.td-b3lyp_6-31g+(d).inp 047134670.td-b3lyp_6-31g+(d).log.xz

047134670.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134670.td-b3lyp_6-31+g(d).gjf (generated)

047134670.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134670.mol 047134670.PUBCHEM 047134670.mol (via Jmol)
047134687.b3lyp_6-31g(d).inp

047134687.b3lyp_6-31g(d).qchem.inp (generated)

047134687.b3lyp_6-31g(d).gjf (generated)

047134687.b3lyp_6-31g(d).firefly.inp (generated)

047134687.b3lyp_6-31g(d).smash.inp (generated)

047134687.b3lyp_6-31g(d).nwchem.inp (generated) 047134687.b3lyp_6-31g(d).log.xz 047134687.td-b3lyp_6-31g+(d).inp 047134687.td-b3lyp_6-31g+(d).log.xz

047134687.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134687.td-b3lyp_6-31+g(d).gjf (generated)

047134687.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134687.mol 047134687.PUBCHEM 047134687.mol (via Jmol)
047134704.b3lyp_6-31g(d).inp

047134704.b3lyp_6-31g(d).qchem.inp (generated)

047134704.b3lyp_6-31g(d).gjf (generated)

047134704.b3lyp_6-31g(d).firefly.inp (generated)

047134704.b3lyp_6-31g(d).smash.inp (generated)

047134704.b3lyp_6-31g(d).nwchem.inp (generated) 047134704.b3lyp_6-31g(d).log.xz 047134704.td-b3lyp_6-31g+(d).inp 047134704.td-b3lyp_6-31g+(d).log.xz

047134704.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134704.td-b3lyp_6-31+g(d).gjf (generated)

047134704.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134704.mol 047134704.PUBCHEM 047134704.mol (via Jmol)
047134741.b3lyp_6-31g(d).inp

047134741.b3lyp_6-31g(d).qchem.inp (generated)

047134741.b3lyp_6-31g(d).gjf (generated)

047134741.b3lyp_6-31g(d).firefly.inp (generated)

047134741.b3lyp_6-31g(d).smash.inp (generated)

047134741.b3lyp_6-31g(d).nwchem.inp (generated) 047134741.b3lyp_6-31g(d).log.xz 047134741.td-b3lyp_6-31g+(d).inp 047134741.td-b3lyp_6-31g+(d).log.xz

047134741.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134741.td-b3lyp_6-31+g(d).gjf (generated)

047134741.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134741.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134741.mol 047134741.PUBCHEM 047134741.mol (via Jmol)
047134744.b3lyp_6-31g(d).inp

047134744.b3lyp_6-31g(d).qchem.inp (generated)

047134744.b3lyp_6-31g(d).gjf (generated)

047134744.b3lyp_6-31g(d).firefly.inp (generated)

047134744.b3lyp_6-31g(d).smash.inp (generated)

047134744.b3lyp_6-31g(d).nwchem.inp (generated) 047134744.b3lyp_6-31g(d).log.xz 047134744.td-b3lyp_6-31g+(d).inp 047134744.td-b3lyp_6-31g+(d).log.xz

047134744.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134744.td-b3lyp_6-31+g(d).gjf (generated)

047134744.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134744.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134744.mol 047134744.PUBCHEM 047134744.mol (via Jmol)
047134842.b3lyp_6-31g(d).inp

047134842.b3lyp_6-31g(d).qchem.inp (generated)

047134842.b3lyp_6-31g(d).gjf (generated)

047134842.b3lyp_6-31g(d).firefly.inp (generated)

047134842.b3lyp_6-31g(d).smash.inp (generated)

047134842.b3lyp_6-31g(d).nwchem.inp (generated) 047134842.b3lyp_6-31g(d).log.xz 047134842.td-b3lyp_6-31g+(d).inp 047134842.td-b3lyp_6-31g+(d).log.xz

047134842.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134842.td-b3lyp_6-31+g(d).gjf (generated)

047134842.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134842.mol 047134842.PUBCHEM 047134842.mol (via Jmol)
047134939.b3lyp_6-31g(d).inp

047134939.b3lyp_6-31g(d).qchem.inp (generated)

047134939.b3lyp_6-31g(d).gjf (generated)

047134939.b3lyp_6-31g(d).firefly.inp (generated)

047134939.b3lyp_6-31g(d).smash.inp (generated)

047134939.b3lyp_6-31g(d).nwchem.inp (generated) 047134939.b3lyp_6-31g(d).log.xz 047134939.td-b3lyp_6-31g+(d).inp 047134939.td-b3lyp_6-31g+(d).log.xz

047134939.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134939.td-b3lyp_6-31+g(d).gjf (generated)

047134939.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134939.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134939.mol 047134939.PUBCHEM 047134939.mol (via Jmol)
047134952.b3lyp_6-31g(d).inp

047134952.b3lyp_6-31g(d).qchem.inp (generated)

047134952.b3lyp_6-31g(d).gjf (generated)

047134952.b3lyp_6-31g(d).firefly.inp (generated)

047134952.b3lyp_6-31g(d).smash.inp (generated)

047134952.b3lyp_6-31g(d).nwchem.inp (generated) 047134952.b3lyp_6-31g(d).log.xz 047134952.td-b3lyp_6-31g+(d).inp 047134952.td-b3lyp_6-31g+(d).log.xz

047134952.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134952.td-b3lyp_6-31+g(d).gjf (generated)

047134952.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134952.mol 047134952.PUBCHEM 047134952.mol (via Jmol)
047134974.b3lyp_6-31g(d).inp

047134974.b3lyp_6-31g(d).qchem.inp (generated)

047134974.b3lyp_6-31g(d).gjf (generated)

047134974.b3lyp_6-31g(d).firefly.inp (generated)

047134974.b3lyp_6-31g(d).smash.inp (generated)

047134974.b3lyp_6-31g(d).nwchem.inp (generated) 047134974.b3lyp_6-31g(d).log.xz 047134974.mol 047134974.PUBCHEM 047134974.mol (via Jmol)
047134977.b3lyp_6-31g(d).inp

047134977.b3lyp_6-31g(d).qchem.inp (generated)

047134977.b3lyp_6-31g(d).gjf (generated)

047134977.b3lyp_6-31g(d).firefly.inp (generated)

047134977.b3lyp_6-31g(d).smash.inp (generated)

047134977.b3lyp_6-31g(d).nwchem.inp (generated) 047134977.b3lyp_6-31g(d).log.xz 047134977.td-b3lyp_6-31g+(d).inp 047134977.td-b3lyp_6-31g+(d).log.xz

047134977.td-b3lyp_6-31+g(d).qchem.inp (generated)

047134977.td-b3lyp_6-31+g(d).gjf (generated)

047134977.td-b3lyp_6-31+g(d).firefly.inp (generated)

047134977.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047134977.mol 047134977.PUBCHEM 047134977.mol (via Jmol)
047135062.b3lyp_6-31g(d).inp

047135062.b3lyp_6-31g(d).qchem.inp (generated)

047135062.b3lyp_6-31g(d).gjf (generated)

047135062.b3lyp_6-31g(d).firefly.inp (generated)

047135062.b3lyp_6-31g(d).smash.inp (generated)

047135062.b3lyp_6-31g(d).nwchem.inp (generated) 047135062.b3lyp_6-31g(d).log.xz 047135062.td-b3lyp_6-31g+(d).inp 047135062.td-b3lyp_6-31g+(d).log.xz

047135062.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135062.td-b3lyp_6-31+g(d).gjf (generated)

047135062.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135062.mol 047135062.PUBCHEM 047135062.mol (via Jmol)
047135149.b3lyp_6-31g(d).inp

047135149.b3lyp_6-31g(d).qchem.inp (generated)

047135149.b3lyp_6-31g(d).gjf (generated)

047135149.b3lyp_6-31g(d).firefly.inp (generated)

047135149.b3lyp_6-31g(d).smash.inp (generated)

047135149.b3lyp_6-31g(d).nwchem.inp (generated) 047135149.b3lyp_6-31g(d).log.xz 047135149.td-b3lyp_6-31g+(d).inp 047135149.td-b3lyp_6-31g+(d).log.xz

047135149.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135149.td-b3lyp_6-31+g(d).gjf (generated)

047135149.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135149.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135149.mol 047135149.PUBCHEM 047135149.mol (via Jmol)
047135167.b3lyp_6-31g(d).inp

047135167.b3lyp_6-31g(d).qchem.inp (generated)

047135167.b3lyp_6-31g(d).gjf (generated)

047135167.b3lyp_6-31g(d).firefly.inp (generated)

047135167.b3lyp_6-31g(d).smash.inp (generated)

047135167.b3lyp_6-31g(d).nwchem.inp (generated) 047135167.b3lyp_6-31g(d).log.xz 047135167.td-b3lyp_6-31g+(d).inp 047135167.td-b3lyp_6-31g+(d).log.xz

047135167.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135167.td-b3lyp_6-31+g(d).gjf (generated)

047135167.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135167.mol 047135167.PUBCHEM 047135167.mol (via Jmol)
047135186.b3lyp_6-31g(d).inp

047135186.b3lyp_6-31g(d).qchem.inp (generated)

047135186.b3lyp_6-31g(d).gjf (generated)

047135186.b3lyp_6-31g(d).firefly.inp (generated)

047135186.b3lyp_6-31g(d).smash.inp (generated)

047135186.b3lyp_6-31g(d).nwchem.inp (generated) 047135186.b3lyp_6-31g(d).log.xz 047135186.td-b3lyp_6-31g+(d).inp 047135186.td-b3lyp_6-31g+(d).log.xz

047135186.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135186.td-b3lyp_6-31+g(d).gjf (generated)

047135186.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135186.mol 047135186.PUBCHEM 047135186.mol (via Jmol)
047135188.b3lyp_6-31g(d).inp

047135188.b3lyp_6-31g(d).qchem.inp (generated)

047135188.b3lyp_6-31g(d).gjf (generated)

047135188.b3lyp_6-31g(d).firefly.inp (generated)

047135188.b3lyp_6-31g(d).smash.inp (generated)

047135188.b3lyp_6-31g(d).nwchem.inp (generated) 047135188.b3lyp_6-31g(d).log.xz 047135188.mol 047135188.PUBCHEM 047135188.mol (via Jmol)
047135190.b3lyp_6-31g(d).inp

047135190.b3lyp_6-31g(d).qchem.inp (generated)

047135190.b3lyp_6-31g(d).gjf (generated)

047135190.b3lyp_6-31g(d).firefly.inp (generated)

047135190.b3lyp_6-31g(d).smash.inp (generated)

047135190.b3lyp_6-31g(d).nwchem.inp (generated) 047135190.b3lyp_6-31g(d).log.xz 047135190.mol 047135190.PUBCHEM 047135190.mol (via Jmol)
047135191.b3lyp_6-31g(d).inp

047135191.b3lyp_6-31g(d).qchem.inp (generated)

047135191.b3lyp_6-31g(d).gjf (generated)

047135191.b3lyp_6-31g(d).firefly.inp (generated)

047135191.b3lyp_6-31g(d).smash.inp (generated)

047135191.b3lyp_6-31g(d).nwchem.inp (generated) 047135191.b3lyp_6-31g(d).log.xz 047135191.td-b3lyp_6-31g+(d).inp 047135191.td-b3lyp_6-31g+(d).log.xz

047135191.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135191.td-b3lyp_6-31+g(d).gjf (generated)

047135191.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135191.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135191.mol 047135191.PUBCHEM 047135191.mol (via Jmol)
047135210.b3lyp_6-31g(d).inp

047135210.b3lyp_6-31g(d).qchem.inp (generated)

047135210.b3lyp_6-31g(d).gjf (generated)

047135210.b3lyp_6-31g(d).firefly.inp (generated)

047135210.b3lyp_6-31g(d).smash.inp (generated)

047135210.b3lyp_6-31g(d).nwchem.inp (generated) 047135210.b3lyp_6-31g(d).log.xz 047135210.mol 047135210.PUBCHEM 047135210.mol (via Jmol)
047135253.b3lyp_6-31g(d).inp

047135253.b3lyp_6-31g(d).qchem.inp (generated)

047135253.b3lyp_6-31g(d).gjf (generated)

047135253.b3lyp_6-31g(d).firefly.inp (generated)

047135253.b3lyp_6-31g(d).smash.inp (generated)

047135253.b3lyp_6-31g(d).nwchem.inp (generated) 047135253.b3lyp_6-31g(d).log.xz 047135253.td-b3lyp_6-31g+(d).inp 047135253.td-b3lyp_6-31g+(d).log.xz

047135253.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135253.td-b3lyp_6-31+g(d).gjf (generated)

047135253.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135253.mol 047135253.PUBCHEM 047135253.mol (via Jmol)
047135263.b3lyp_6-31g(d).inp

047135263.b3lyp_6-31g(d).qchem.inp (generated)

047135263.b3lyp_6-31g(d).gjf (generated)

047135263.b3lyp_6-31g(d).firefly.inp (generated)

047135263.b3lyp_6-31g(d).smash.inp (generated)

047135263.b3lyp_6-31g(d).nwchem.inp (generated) 047135263.b3lyp_6-31g(d).log.xz 047135263.mol 047135263.PUBCHEM 047135263.mol (via Jmol)
047135325.b3lyp_6-31g(d).inp

047135325.b3lyp_6-31g(d).qchem.inp (generated)

047135325.b3lyp_6-31g(d).gjf (generated)

047135325.b3lyp_6-31g(d).firefly.inp (generated)

047135325.b3lyp_6-31g(d).smash.inp (generated)

047135325.b3lyp_6-31g(d).nwchem.inp (generated) 047135325.b3lyp_6-31g(d).log.xz 047135325.mol 047135325.PUBCHEM 047135325.mol (via Jmol)
047135508.b3lyp_6-31g(d).inp

047135508.b3lyp_6-31g(d).qchem.inp (generated)

047135508.b3lyp_6-31g(d).gjf (generated)

047135508.b3lyp_6-31g(d).firefly.inp (generated)

047135508.b3lyp_6-31g(d).smash.inp (generated)

047135508.b3lyp_6-31g(d).nwchem.inp (generated) 047135508.b3lyp_6-31g(d).log.xz 047135508.td-b3lyp_6-31g+(d).inp 047135508.td-b3lyp_6-31g+(d).log.xz

047135508.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135508.td-b3lyp_6-31+g(d).gjf (generated)

047135508.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135508.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135508.mol 047135508.PUBCHEM 047135508.mol (via Jmol)
047135518.b3lyp_6-31g(d).inp

047135518.b3lyp_6-31g(d).qchem.inp (generated)

047135518.b3lyp_6-31g(d).gjf (generated)

047135518.b3lyp_6-31g(d).firefly.inp (generated)

047135518.b3lyp_6-31g(d).smash.inp (generated)

047135518.b3lyp_6-31g(d).nwchem.inp (generated) 047135518.b3lyp_6-31g(d).log.xz 047135518.mol 047135518.PUBCHEM 047135518.mol (via Jmol)
047135565.b3lyp_6-31g(d).inp

047135565.b3lyp_6-31g(d).qchem.inp (generated)

047135565.b3lyp_6-31g(d).gjf (generated)

047135565.b3lyp_6-31g(d).firefly.inp (generated)

047135565.b3lyp_6-31g(d).smash.inp (generated)

047135565.b3lyp_6-31g(d).nwchem.inp (generated) 047135565.b3lyp_6-31g(d).log.xz 047135565.td-b3lyp_6-31g+(d).inp 047135565.td-b3lyp_6-31g+(d).log.xz

047135565.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135565.td-b3lyp_6-31+g(d).gjf (generated)

047135565.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135565.mol 047135565.PUBCHEM 047135565.mol (via Jmol)
047135602.b3lyp_6-31g(d).inp

047135602.b3lyp_6-31g(d).qchem.inp (generated)

047135602.b3lyp_6-31g(d).gjf (generated)

047135602.b3lyp_6-31g(d).firefly.inp (generated)

047135602.b3lyp_6-31g(d).smash.inp (generated)

047135602.b3lyp_6-31g(d).nwchem.inp (generated) 047135602.b3lyp_6-31g(d).log.xz 047135602.td-b3lyp_6-31g+(d).inp 047135602.td-b3lyp_6-31g+(d).log.xz

047135602.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135602.td-b3lyp_6-31+g(d).gjf (generated)

047135602.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135602.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135602.mol 047135602.PUBCHEM 047135602.mol (via Jmol)
047135643.b3lyp_6-31g(d).inp

047135643.b3lyp_6-31g(d).qchem.inp (generated)

047135643.b3lyp_6-31g(d).gjf (generated)

047135643.b3lyp_6-31g(d).firefly.inp (generated)

047135643.b3lyp_6-31g(d).smash.inp (generated)

047135643.b3lyp_6-31g(d).nwchem.inp (generated) 047135643.b3lyp_6-31g(d).log.xz 047135643.mol 047135643.PUBCHEM 047135643.mol (via Jmol)
047135649.b3lyp_6-31g(d).inp

047135649.b3lyp_6-31g(d).qchem.inp (generated)

047135649.b3lyp_6-31g(d).gjf (generated)

047135649.b3lyp_6-31g(d).firefly.inp (generated)

047135649.b3lyp_6-31g(d).smash.inp (generated)

047135649.b3lyp_6-31g(d).nwchem.inp (generated) 047135649.b3lyp_6-31g(d).log.xz 047135649.td-b3lyp_6-31g+(d).inp 047135649.td-b3lyp_6-31g+(d).log.xz

047135649.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135649.td-b3lyp_6-31+g(d).gjf (generated)

047135649.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135649.mol 047135649.PUBCHEM 047135649.mol (via Jmol)
047135653.b3lyp_6-31g(d).inp

047135653.b3lyp_6-31g(d).qchem.inp (generated)

047135653.b3lyp_6-31g(d).gjf (generated)

047135653.b3lyp_6-31g(d).firefly.inp (generated)

047135653.b3lyp_6-31g(d).smash.inp (generated)

047135653.b3lyp_6-31g(d).nwchem.inp (generated) 047135653.b3lyp_6-31g(d).log.xz 047135653.mol 047135653.PUBCHEM 047135653.mol (via Jmol)
047135700.b3lyp_6-31g(d).inp

047135700.b3lyp_6-31g(d).qchem.inp (generated)

047135700.b3lyp_6-31g(d).gjf (generated)

047135700.b3lyp_6-31g(d).firefly.inp (generated)

047135700.b3lyp_6-31g(d).smash.inp (generated)

047135700.b3lyp_6-31g(d).nwchem.inp (generated) 047135700.b3lyp_6-31g(d).log.xz 047135700.td-b3lyp_6-31g+(d).inp 047135700.td-b3lyp_6-31g+(d).log.xz

047135700.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135700.td-b3lyp_6-31+g(d).gjf (generated)

047135700.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135700.mol 047135700.PUBCHEM 047135700.mol (via Jmol)
047135839.b3lyp_6-31g(d).inp

047135839.b3lyp_6-31g(d).qchem.inp (generated)

047135839.b3lyp_6-31g(d).gjf (generated)

047135839.b3lyp_6-31g(d).firefly.inp (generated)

047135839.b3lyp_6-31g(d).smash.inp (generated)

047135839.b3lyp_6-31g(d).nwchem.inp (generated) 047135839.b3lyp_6-31g(d).log.xz 047135839.td-b3lyp_6-31g+(d).inp 047135839.td-b3lyp_6-31g+(d).log.xz

047135839.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135839.td-b3lyp_6-31+g(d).gjf (generated)

047135839.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135839.mol 047135839.PUBCHEM 047135839.mol (via Jmol)
047135842.b3lyp_6-31g(d).inp

047135842.b3lyp_6-31g(d).qchem.inp (generated)

047135842.b3lyp_6-31g(d).gjf (generated)

047135842.b3lyp_6-31g(d).firefly.inp (generated)

047135842.b3lyp_6-31g(d).smash.inp (generated)

047135842.b3lyp_6-31g(d).nwchem.inp (generated) 047135842.b3lyp_6-31g(d).log.xz 047135842.td-b3lyp_6-31g+(d).inp 047135842.td-b3lyp_6-31g+(d).log.xz

047135842.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135842.td-b3lyp_6-31+g(d).gjf (generated)

047135842.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135842.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135842.mol 047135842.PUBCHEM 047135842.mol (via Jmol)
047135911.b3lyp_6-31g(d).inp

047135911.b3lyp_6-31g(d).qchem.inp (generated)

047135911.b3lyp_6-31g(d).gjf (generated)

047135911.b3lyp_6-31g(d).firefly.inp (generated)

047135911.b3lyp_6-31g(d).smash.inp (generated)

047135911.b3lyp_6-31g(d).nwchem.inp (generated) 047135911.b3lyp_6-31g(d).log.xz 047135911.td-b3lyp_6-31g+(d).inp 047135911.td-b3lyp_6-31g+(d).log.xz

047135911.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135911.td-b3lyp_6-31+g(d).gjf (generated)

047135911.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135911.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135911.mol 047135911.PUBCHEM 047135911.mol (via Jmol)
047135937.b3lyp_6-31g(d).inp

047135937.b3lyp_6-31g(d).qchem.inp (generated)

047135937.b3lyp_6-31g(d).gjf (generated)

047135937.b3lyp_6-31g(d).firefly.inp (generated)

047135937.b3lyp_6-31g(d).smash.inp (generated)

047135937.b3lyp_6-31g(d).nwchem.inp (generated) 047135937.b3lyp_6-31g(d).log.xz 047135937.td-b3lyp_6-31g+(d).inp 047135937.td-b3lyp_6-31g+(d).log.xz

047135937.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135937.td-b3lyp_6-31+g(d).gjf (generated)

047135937.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135937.mol 047135937.PUBCHEM 047135937.mol (via Jmol)
047135947.b3lyp_6-31g(d).inp

047135947.b3lyp_6-31g(d).qchem.inp (generated)

047135947.b3lyp_6-31g(d).gjf (generated)

047135947.b3lyp_6-31g(d).firefly.inp (generated)

047135947.b3lyp_6-31g(d).smash.inp (generated)

047135947.b3lyp_6-31g(d).nwchem.inp (generated) 047135947.b3lyp_6-31g(d).log.xz 047135947.mol 047135947.PUBCHEM 047135947.mol (via Jmol)
047135957.b3lyp_6-31g(d).inp

047135957.b3lyp_6-31g(d).qchem.inp (generated)

047135957.b3lyp_6-31g(d).gjf (generated)

047135957.b3lyp_6-31g(d).firefly.inp (generated)

047135957.b3lyp_6-31g(d).smash.inp (generated)

047135957.b3lyp_6-31g(d).nwchem.inp (generated) 047135957.b3lyp_6-31g(d).log.xz 047135957.td-b3lyp_6-31g+(d).inp 047135957.td-b3lyp_6-31g+(d).log.xz

047135957.td-b3lyp_6-31+g(d).qchem.inp (generated)

047135957.td-b3lyp_6-31+g(d).gjf (generated)

047135957.td-b3lyp_6-31+g(d).firefly.inp (generated)

047135957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047135957.mol 047135957.PUBCHEM 047135957.mol (via Jmol)
047135968.b3lyp_6-31g(d).inp

047135968.b3lyp_6-31g(d).qchem.inp (generated)

047135968.b3lyp_6-31g(d).gjf (generated)

047135968.b3lyp_6-31g(d).firefly.inp (generated)

047135968.b3lyp_6-31g(d).smash.inp (generated)

047135968.b3lyp_6-31g(d).nwchem.inp (generated) 047135968.b3lyp_6-31g(d).log.xz 047135968.mol 047135968.PUBCHEM 047135968.mol (via Jmol)
047136015.b3lyp_6-31g(d).inp

047136015.b3lyp_6-31g(d).qchem.inp (generated)

047136015.b3lyp_6-31g(d).gjf (generated)

047136015.b3lyp_6-31g(d).firefly.inp (generated)

047136015.b3lyp_6-31g(d).smash.inp (generated)

047136015.b3lyp_6-31g(d).nwchem.inp (generated) 047136015.b3lyp_6-31g(d).log.xz 047136015.mol 047136015.PUBCHEM 047136015.mol (via Jmol)
047136033.b3lyp_6-31g(d).inp

047136033.b3lyp_6-31g(d).qchem.inp (generated)

047136033.b3lyp_6-31g(d).gjf (generated)

047136033.b3lyp_6-31g(d).firefly.inp (generated)

047136033.b3lyp_6-31g(d).smash.inp (generated)

047136033.b3lyp_6-31g(d).nwchem.inp (generated) 047136033.b3lyp_6-31g(d).log.xz 047136033.td-b3lyp_6-31g+(d).inp 047136033.td-b3lyp_6-31g+(d).log.xz

047136033.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136033.td-b3lyp_6-31+g(d).gjf (generated)

047136033.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136033.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136033.mol 047136033.PUBCHEM 047136033.mol (via Jmol)
047136041.b3lyp_6-31g(d).inp

047136041.b3lyp_6-31g(d).qchem.inp (generated)

047136041.b3lyp_6-31g(d).gjf (generated)

047136041.b3lyp_6-31g(d).firefly.inp (generated)

047136041.b3lyp_6-31g(d).smash.inp (generated)

047136041.b3lyp_6-31g(d).nwchem.inp (generated) 047136041.b3lyp_6-31g(d).log.xz 047136041.td-b3lyp_6-31g+(d).inp 047136041.td-b3lyp_6-31g+(d).log.xz

047136041.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136041.td-b3lyp_6-31+g(d).gjf (generated)

047136041.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136041.mol 047136041.PUBCHEM 047136041.mol (via Jmol)
047136127.b3lyp_6-31g(d).inp

047136127.b3lyp_6-31g(d).qchem.inp (generated)

047136127.b3lyp_6-31g(d).gjf (generated)

047136127.b3lyp_6-31g(d).firefly.inp (generated)

047136127.b3lyp_6-31g(d).smash.inp (generated)

047136127.b3lyp_6-31g(d).nwchem.inp (generated) 047136127.b3lyp_6-31g(d).log.xz 047136127.td-b3lyp_6-31g+(d).inp 047136127.td-b3lyp_6-31g+(d).log.xz

047136127.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136127.td-b3lyp_6-31+g(d).gjf (generated)

047136127.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136127.mol 047136127.PUBCHEM 047136127.mol (via Jmol)
047136159.b3lyp_6-31g(d).inp

047136159.b3lyp_6-31g(d).qchem.inp (generated)

047136159.b3lyp_6-31g(d).gjf (generated)

047136159.b3lyp_6-31g(d).firefly.inp (generated)

047136159.b3lyp_6-31g(d).smash.inp (generated)

047136159.b3lyp_6-31g(d).nwchem.inp (generated) 047136159.b3lyp_6-31g(d).log.xz 047136159.td-b3lyp_6-31g+(d).inp 047136159.td-b3lyp_6-31g+(d).log.xz

047136159.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136159.td-b3lyp_6-31+g(d).gjf (generated)

047136159.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136159.mol 047136159.PUBCHEM 047136159.mol (via Jmol)
047136275.b3lyp_6-31g(d).inp

047136275.b3lyp_6-31g(d).qchem.inp (generated)

047136275.b3lyp_6-31g(d).gjf (generated)

047136275.b3lyp_6-31g(d).firefly.inp (generated)

047136275.b3lyp_6-31g(d).smash.inp (generated)

047136275.b3lyp_6-31g(d).nwchem.inp (generated) 047136275.b3lyp_6-31g(d).log.xz 047136275.td-b3lyp_6-31g+(d).inp 047136275.td-b3lyp_6-31g+(d).log.xz

047136275.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136275.td-b3lyp_6-31+g(d).gjf (generated)

047136275.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136275.mol 047136275.PUBCHEM 047136275.mol (via Jmol)
047136322.b3lyp_6-31g(d).inp

047136322.b3lyp_6-31g(d).qchem.inp (generated)

047136322.b3lyp_6-31g(d).gjf (generated)

047136322.b3lyp_6-31g(d).firefly.inp (generated)

047136322.b3lyp_6-31g(d).smash.inp (generated)

047136322.b3lyp_6-31g(d).nwchem.inp (generated) 047136322.b3lyp_6-31g(d).log.xz 047136322.td-b3lyp_6-31g+(d).inp 047136322.td-b3lyp_6-31g+(d).log.xz

047136322.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136322.td-b3lyp_6-31+g(d).gjf (generated)

047136322.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136322.mol 047136322.PUBCHEM 047136322.mol (via Jmol)
047136346.b3lyp_6-31g(d).inp

047136346.b3lyp_6-31g(d).qchem.inp (generated)

047136346.b3lyp_6-31g(d).gjf (generated)

047136346.b3lyp_6-31g(d).firefly.inp (generated)

047136346.b3lyp_6-31g(d).smash.inp (generated)

047136346.b3lyp_6-31g(d).nwchem.inp (generated) 047136346.b3lyp_6-31g(d).log.xz 047136346.td-b3lyp_6-31g+(d).inp 047136346.td-b3lyp_6-31g+(d).log.xz

047136346.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136346.td-b3lyp_6-31+g(d).gjf (generated)

047136346.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136346.mol 047136346.PUBCHEM 047136346.mol (via Jmol)
047136394.b3lyp_6-31g(d).inp

047136394.b3lyp_6-31g(d).qchem.inp (generated)

047136394.b3lyp_6-31g(d).gjf (generated)

047136394.b3lyp_6-31g(d).firefly.inp (generated)

047136394.b3lyp_6-31g(d).smash.inp (generated)

047136394.b3lyp_6-31g(d).nwchem.inp (generated) 047136394.b3lyp_6-31g(d).log.xz 047136394.td-b3lyp_6-31g+(d).inp 047136394.td-b3lyp_6-31g+(d).log.xz

047136394.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136394.td-b3lyp_6-31+g(d).gjf (generated)

047136394.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136394.mol 047136394.PUBCHEM 047136394.mol (via Jmol)
047136395.b3lyp_6-31g(d).inp

047136395.b3lyp_6-31g(d).qchem.inp (generated)

047136395.b3lyp_6-31g(d).gjf (generated)

047136395.b3lyp_6-31g(d).firefly.inp (generated)

047136395.b3lyp_6-31g(d).smash.inp (generated)

047136395.b3lyp_6-31g(d).nwchem.inp (generated) 047136395.b3lyp_6-31g(d).log.xz 047136395.td-b3lyp_6-31g+(d).inp 047136395.td-b3lyp_6-31g+(d).log.xz

047136395.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136395.td-b3lyp_6-31+g(d).gjf (generated)

047136395.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136395.mol 047136395.PUBCHEM 047136395.mol (via Jmol)
047136423.b3lyp_6-31g(d).inp

047136423.b3lyp_6-31g(d).qchem.inp (generated)

047136423.b3lyp_6-31g(d).gjf (generated)

047136423.b3lyp_6-31g(d).firefly.inp (generated)

047136423.b3lyp_6-31g(d).smash.inp (generated)

047136423.b3lyp_6-31g(d).nwchem.inp (generated) 047136423.b3lyp_6-31g(d).log.xz 047136423.td-b3lyp_6-31g+(d).inp 047136423.td-b3lyp_6-31g+(d).log.xz

047136423.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136423.td-b3lyp_6-31+g(d).gjf (generated)

047136423.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136423.mol 047136423.PUBCHEM 047136423.mol (via Jmol)
047136435.b3lyp_6-31g(d).inp

047136435.b3lyp_6-31g(d).qchem.inp (generated)

047136435.b3lyp_6-31g(d).gjf (generated)

047136435.b3lyp_6-31g(d).firefly.inp (generated)

047136435.b3lyp_6-31g(d).smash.inp (generated)

047136435.b3lyp_6-31g(d).nwchem.inp (generated) 047136435.b3lyp_6-31g(d).log.xz 047136435.mol 047136435.PUBCHEM 047136435.mol (via Jmol)
047136442.b3lyp_6-31g(d).inp

047136442.b3lyp_6-31g(d).qchem.inp (generated)

047136442.b3lyp_6-31g(d).gjf (generated)

047136442.b3lyp_6-31g(d).firefly.inp (generated)

047136442.b3lyp_6-31g(d).smash.inp (generated)

047136442.b3lyp_6-31g(d).nwchem.inp (generated) 047136442.b3lyp_6-31g(d).log.xz 047136442.mol 047136442.PUBCHEM 047136442.mol (via Jmol)
047136481.b3lyp_6-31g(d).inp

047136481.b3lyp_6-31g(d).qchem.inp (generated)

047136481.b3lyp_6-31g(d).gjf (generated)

047136481.b3lyp_6-31g(d).firefly.inp (generated)

047136481.b3lyp_6-31g(d).smash.inp (generated)

047136481.b3lyp_6-31g(d).nwchem.inp (generated) 047136481.b3lyp_6-31g(d).log.xz 047136481.mol 047136481.PUBCHEM 047136481.mol (via Jmol)
047136498.b3lyp_6-31g(d).inp

047136498.b3lyp_6-31g(d).qchem.inp (generated)

047136498.b3lyp_6-31g(d).gjf (generated)

047136498.b3lyp_6-31g(d).firefly.inp (generated)

047136498.b3lyp_6-31g(d).smash.inp (generated)

047136498.b3lyp_6-31g(d).nwchem.inp (generated) 047136498.b3lyp_6-31g(d).log.xz 047136498.td-b3lyp_6-31g+(d).inp 047136498.td-b3lyp_6-31g+(d).log.xz

047136498.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136498.td-b3lyp_6-31+g(d).gjf (generated)

047136498.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136498.mol 047136498.PUBCHEM 047136498.mol (via Jmol)
047136530.b3lyp_6-31g(d).inp

047136530.b3lyp_6-31g(d).qchem.inp (generated)

047136530.b3lyp_6-31g(d).gjf (generated)

047136530.b3lyp_6-31g(d).firefly.inp (generated)

047136530.b3lyp_6-31g(d).smash.inp (generated)

047136530.b3lyp_6-31g(d).nwchem.inp (generated) 047136530.b3lyp_6-31g(d).log.xz 047136530.mol 047136530.PUBCHEM 047136530.mol (via Jmol)
047136534.b3lyp_6-31g(d).inp

047136534.b3lyp_6-31g(d).qchem.inp (generated)

047136534.b3lyp_6-31g(d).gjf (generated)

047136534.b3lyp_6-31g(d).firefly.inp (generated)

047136534.b3lyp_6-31g(d).smash.inp (generated)

047136534.b3lyp_6-31g(d).nwchem.inp (generated) 047136534.b3lyp_6-31g(d).log.xz 047136534.td-b3lyp_6-31g+(d).inp 047136534.td-b3lyp_6-31g+(d).log.xz

047136534.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136534.td-b3lyp_6-31+g(d).gjf (generated)

047136534.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136534.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136534.mol 047136534.PUBCHEM 047136534.mol (via Jmol)
047136589.b3lyp_6-31g(d).inp

047136589.b3lyp_6-31g(d).qchem.inp (generated)

047136589.b3lyp_6-31g(d).gjf (generated)

047136589.b3lyp_6-31g(d).firefly.inp (generated)

047136589.b3lyp_6-31g(d).smash.inp (generated)

047136589.b3lyp_6-31g(d).nwchem.inp (generated) 047136589.b3lyp_6-31g(d).log.xz 047136589.td-b3lyp_6-31g+(d).inp 047136589.td-b3lyp_6-31g+(d).log.xz

047136589.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136589.td-b3lyp_6-31+g(d).gjf (generated)

047136589.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136589.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136589.mol 047136589.PUBCHEM 047136589.mol (via Jmol)
047136590.b3lyp_6-31g(d).inp

047136590.b3lyp_6-31g(d).qchem.inp (generated)

047136590.b3lyp_6-31g(d).gjf (generated)

047136590.b3lyp_6-31g(d).firefly.inp (generated)

047136590.b3lyp_6-31g(d).smash.inp (generated)

047136590.b3lyp_6-31g(d).nwchem.inp (generated) 047136590.b3lyp_6-31g(d).log.xz 047136590.td-b3lyp_6-31g+(d).inp 047136590.td-b3lyp_6-31g+(d).log.xz

047136590.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136590.td-b3lyp_6-31+g(d).gjf (generated)

047136590.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136590.mol 047136590.PUBCHEM 047136590.mol (via Jmol)
047136599.b3lyp_6-31g(d).inp

047136599.b3lyp_6-31g(d).qchem.inp (generated)

047136599.b3lyp_6-31g(d).gjf (generated)

047136599.b3lyp_6-31g(d).firefly.inp (generated)

047136599.b3lyp_6-31g(d).smash.inp (generated)

047136599.b3lyp_6-31g(d).nwchem.inp (generated) 047136599.b3lyp_6-31g(d).log.xz 047136599.mol 047136599.PUBCHEM 047136599.mol (via Jmol)
047136604.b3lyp_6-31g(d).inp

047136604.b3lyp_6-31g(d).qchem.inp (generated)

047136604.b3lyp_6-31g(d).gjf (generated)

047136604.b3lyp_6-31g(d).firefly.inp (generated)

047136604.b3lyp_6-31g(d).smash.inp (generated)

047136604.b3lyp_6-31g(d).nwchem.inp (generated) 047136604.b3lyp_6-31g(d).log.xz 047136604.td-b3lyp_6-31g+(d).inp 047136604.td-b3lyp_6-31g+(d).log.xz

047136604.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136604.td-b3lyp_6-31+g(d).gjf (generated)

047136604.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136604.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136604.mol 047136604.PUBCHEM 047136604.mol (via Jmol)
047136665.b3lyp_6-31g(d).inp

047136665.b3lyp_6-31g(d).qchem.inp (generated)

047136665.b3lyp_6-31g(d).gjf (generated)

047136665.b3lyp_6-31g(d).firefly.inp (generated)

047136665.b3lyp_6-31g(d).smash.inp (generated)

047136665.b3lyp_6-31g(d).nwchem.inp (generated) 047136665.b3lyp_6-31g(d).log.xz 047136665.td-b3lyp_6-31g+(d).inp 047136665.td-b3lyp_6-31g+(d).log.xz

047136665.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136665.td-b3lyp_6-31+g(d).gjf (generated)

047136665.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136665.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136665.mol 047136665.PUBCHEM 047136665.mol (via Jmol)
047136693.b3lyp_6-31g(d).inp

047136693.b3lyp_6-31g(d).qchem.inp (generated)

047136693.b3lyp_6-31g(d).gjf (generated)

047136693.b3lyp_6-31g(d).firefly.inp (generated)

047136693.b3lyp_6-31g(d).smash.inp (generated)

047136693.b3lyp_6-31g(d).nwchem.inp (generated) 047136693.b3lyp_6-31g(d).log.xz 047136693.mol 047136693.PUBCHEM 047136693.mol (via Jmol)
047136961.b3lyp_6-31g(d).inp

047136961.b3lyp_6-31g(d).qchem.inp (generated)

047136961.b3lyp_6-31g(d).gjf (generated)

047136961.b3lyp_6-31g(d).firefly.inp (generated)

047136961.b3lyp_6-31g(d).smash.inp (generated)

047136961.b3lyp_6-31g(d).nwchem.inp (generated) 047136961.b3lyp_6-31g(d).log.xz 047136961.td-b3lyp_6-31g+(d).inp 047136961.td-b3lyp_6-31g+(d).log.xz

047136961.td-b3lyp_6-31+g(d).qchem.inp (generated)

047136961.td-b3lyp_6-31+g(d).gjf (generated)

047136961.td-b3lyp_6-31+g(d).firefly.inp (generated)

047136961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047136961.mol 047136961.PUBCHEM 047136961.mol (via Jmol)
047137052.b3lyp_6-31g(d).inp

047137052.b3lyp_6-31g(d).qchem.inp (generated)

047137052.b3lyp_6-31g(d).gjf (generated)

047137052.b3lyp_6-31g(d).firefly.inp (generated)

047137052.b3lyp_6-31g(d).smash.inp (generated)

047137052.b3lyp_6-31g(d).nwchem.inp (generated) 047137052.b3lyp_6-31g(d).log.xz 047137052.td-b3lyp_6-31g+(d).inp 047137052.td-b3lyp_6-31g+(d).log.xz

047137052.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137052.td-b3lyp_6-31+g(d).gjf (generated)

047137052.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137052.mol 047137052.PUBCHEM 047137052.mol (via Jmol)
047137243.b3lyp_6-31g(d).inp

047137243.b3lyp_6-31g(d).qchem.inp (generated)

047137243.b3lyp_6-31g(d).gjf (generated)

047137243.b3lyp_6-31g(d).firefly.inp (generated)

047137243.b3lyp_6-31g(d).smash.inp (generated)

047137243.b3lyp_6-31g(d).nwchem.inp (generated) 047137243.b3lyp_6-31g(d).log.xz 047137243.mol 047137243.PUBCHEM 047137243.mol (via Jmol)
047137296.b3lyp_6-31g(d).inp

047137296.b3lyp_6-31g(d).qchem.inp (generated)

047137296.b3lyp_6-31g(d).gjf (generated)

047137296.b3lyp_6-31g(d).firefly.inp (generated)

047137296.b3lyp_6-31g(d).smash.inp (generated)

047137296.b3lyp_6-31g(d).nwchem.inp (generated) 047137296.b3lyp_6-31g(d).log.xz 047137296.td-b3lyp_6-31g+(d).inp 047137296.td-b3lyp_6-31g+(d).log.xz

047137296.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137296.td-b3lyp_6-31+g(d).gjf (generated)

047137296.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137296.mol 047137296.PUBCHEM 047137296.mol (via Jmol)
047137302.b3lyp_6-31g(d).inp

047137302.b3lyp_6-31g(d).qchem.inp (generated)

047137302.b3lyp_6-31g(d).gjf (generated)

047137302.b3lyp_6-31g(d).firefly.inp (generated)

047137302.b3lyp_6-31g(d).smash.inp (generated)

047137302.b3lyp_6-31g(d).nwchem.inp (generated) 047137302.b3lyp_6-31g(d).log.xz 047137302.mol 047137302.PUBCHEM 047137302.mol (via Jmol)
047137315.b3lyp_6-31g(d).inp

047137315.b3lyp_6-31g(d).qchem.inp (generated)

047137315.b3lyp_6-31g(d).gjf (generated)

047137315.b3lyp_6-31g(d).firefly.inp (generated)

047137315.b3lyp_6-31g(d).smash.inp (generated)

047137315.b3lyp_6-31g(d).nwchem.inp (generated) 047137315.b3lyp_6-31g(d).log.xz 047137315.td-b3lyp_6-31g+(d).inp 047137315.td-b3lyp_6-31g+(d).log.xz

047137315.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137315.td-b3lyp_6-31+g(d).gjf (generated)

047137315.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137315.mol 047137315.PUBCHEM 047137315.mol (via Jmol)
047137519.b3lyp_6-31g(d).inp

047137519.b3lyp_6-31g(d).qchem.inp (generated)

047137519.b3lyp_6-31g(d).gjf (generated)

047137519.b3lyp_6-31g(d).firefly.inp (generated)

047137519.b3lyp_6-31g(d).smash.inp (generated)

047137519.b3lyp_6-31g(d).nwchem.inp (generated) 047137519.b3lyp_6-31g(d).log.xz 047137519.td-b3lyp_6-31g+(d).inp 047137519.td-b3lyp_6-31g+(d).log.xz

047137519.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137519.td-b3lyp_6-31+g(d).gjf (generated)

047137519.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137519.mol 047137519.PUBCHEM 047137519.mol (via Jmol)
047137590.b3lyp_6-31g(d).inp

047137590.b3lyp_6-31g(d).qchem.inp (generated)

047137590.b3lyp_6-31g(d).gjf (generated)

047137590.b3lyp_6-31g(d).firefly.inp (generated)

047137590.b3lyp_6-31g(d).smash.inp (generated)

047137590.b3lyp_6-31g(d).nwchem.inp (generated) 047137590.b3lyp_6-31g(d).log.xz 047137590.td-b3lyp_6-31g+(d).inp 047137590.td-b3lyp_6-31g+(d).log.xz

047137590.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137590.td-b3lyp_6-31+g(d).gjf (generated)

047137590.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137590.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137590.mol 047137590.PUBCHEM 047137590.mol (via Jmol)
047137622.b3lyp_6-31g(d).inp

047137622.b3lyp_6-31g(d).qchem.inp (generated)

047137622.b3lyp_6-31g(d).gjf (generated)

047137622.b3lyp_6-31g(d).firefly.inp (generated)

047137622.b3lyp_6-31g(d).smash.inp (generated)

047137622.b3lyp_6-31g(d).nwchem.inp (generated) 047137622.b3lyp_6-31g(d).log.xz 047137622.td-b3lyp_6-31g+(d).inp 047137622.td-b3lyp_6-31g+(d).log.xz

047137622.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137622.td-b3lyp_6-31+g(d).gjf (generated)

047137622.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137622.mol 047137622.PUBCHEM 047137622.mol (via Jmol)
047137627.b3lyp_6-31g(d).inp

047137627.b3lyp_6-31g(d).qchem.inp (generated)

047137627.b3lyp_6-31g(d).gjf (generated)

047137627.b3lyp_6-31g(d).firefly.inp (generated)

047137627.b3lyp_6-31g(d).smash.inp (generated)

047137627.b3lyp_6-31g(d).nwchem.inp (generated) 047137627.b3lyp_6-31g(d).log.xz 047137627.td-b3lyp_6-31g+(d).inp 047137627.td-b3lyp_6-31g+(d).log.xz

047137627.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137627.td-b3lyp_6-31+g(d).gjf (generated)

047137627.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137627.mol 047137627.PUBCHEM 047137627.mol (via Jmol)
047137639.b3lyp_6-31g(d).inp

047137639.b3lyp_6-31g(d).qchem.inp (generated)

047137639.b3lyp_6-31g(d).gjf (generated)

047137639.b3lyp_6-31g(d).firefly.inp (generated)

047137639.b3lyp_6-31g(d).smash.inp (generated)

047137639.b3lyp_6-31g(d).nwchem.inp (generated) 047137639.b3lyp_6-31g(d).log.xz 047137639.td-b3lyp_6-31g+(d).inp 047137639.td-b3lyp_6-31g+(d).log.xz

047137639.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137639.td-b3lyp_6-31+g(d).gjf (generated)

047137639.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137639.mol 047137639.PUBCHEM 047137639.mol (via Jmol)
047137884.b3lyp_6-31g(d).inp

047137884.b3lyp_6-31g(d).qchem.inp (generated)

047137884.b3lyp_6-31g(d).gjf (generated)

047137884.b3lyp_6-31g(d).firefly.inp (generated)

047137884.b3lyp_6-31g(d).smash.inp (generated)

047137884.b3lyp_6-31g(d).nwchem.inp (generated) 047137884.b3lyp_6-31g(d).log.xz 047137884.mol 047137884.PUBCHEM 047137884.mol (via Jmol)
047137896.b3lyp_6-31g(d).inp

047137896.b3lyp_6-31g(d).qchem.inp (generated)

047137896.b3lyp_6-31g(d).gjf (generated)

047137896.b3lyp_6-31g(d).firefly.inp (generated)

047137896.b3lyp_6-31g(d).smash.inp (generated)

047137896.b3lyp_6-31g(d).nwchem.inp (generated) 047137896.b3lyp_6-31g(d).log.xz 047137896.td-b3lyp_6-31g+(d).inp 047137896.td-b3lyp_6-31g+(d).log.xz

047137896.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137896.td-b3lyp_6-31+g(d).gjf (generated)

047137896.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137896.mol 047137896.PUBCHEM 047137896.mol (via Jmol)
047137953.b3lyp_6-31g(d).inp

047137953.b3lyp_6-31g(d).qchem.inp (generated)

047137953.b3lyp_6-31g(d).gjf (generated)

047137953.b3lyp_6-31g(d).firefly.inp (generated)

047137953.b3lyp_6-31g(d).smash.inp (generated)

047137953.b3lyp_6-31g(d).nwchem.inp (generated) 047137953.b3lyp_6-31g(d).log.xz 047137953.td-b3lyp_6-31g+(d).inp 047137953.td-b3lyp_6-31g+(d).log.xz

047137953.td-b3lyp_6-31+g(d).qchem.inp (generated)

047137953.td-b3lyp_6-31+g(d).gjf (generated)

047137953.td-b3lyp_6-31+g(d).firefly.inp (generated)

047137953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047137953.mol 047137953.PUBCHEM 047137953.mol (via Jmol)
047137959.b3lyp_6-31g(d).inp

047137959.b3lyp_6-31g(d).qchem.inp (generated)

047137959.b3lyp_6-31g(d).gjf (generated)

047137959.b3lyp_6-31g(d).firefly.inp (generated)

047137959.b3lyp_6-31g(d).smash.inp (generated)

047137959.b3lyp_6-31g(d).nwchem.inp (generated) 047137959.b3lyp_6-31g(d).log.xz 047137959.mol 047137959.PUBCHEM 047137959.mol (via Jmol)
047138012.b3lyp_6-31g(d).inp

047138012.b3lyp_6-31g(d).qchem.inp (generated)

047138012.b3lyp_6-31g(d).gjf (generated)

047138012.b3lyp_6-31g(d).firefly.inp (generated)

047138012.b3lyp_6-31g(d).smash.inp (generated)

047138012.b3lyp_6-31g(d).nwchem.inp (generated) 047138012.b3lyp_6-31g(d).log.xz 047138012.mol 047138012.PUBCHEM 047138012.mol (via Jmol)
047138100.b3lyp_6-31g(d).inp

047138100.b3lyp_6-31g(d).qchem.inp (generated)

047138100.b3lyp_6-31g(d).gjf (generated)

047138100.b3lyp_6-31g(d).firefly.inp (generated)

047138100.b3lyp_6-31g(d).smash.inp (generated)

047138100.b3lyp_6-31g(d).nwchem.inp (generated) 047138100.b3lyp_6-31g(d).log.xz 047138100.td-b3lyp_6-31g+(d).inp 047138100.td-b3lyp_6-31g+(d).log.xz

047138100.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138100.td-b3lyp_6-31+g(d).gjf (generated)

047138100.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138100.mol 047138100.PUBCHEM 047138100.mol (via Jmol)
047138133.b3lyp_6-31g(d).inp

047138133.b3lyp_6-31g(d).qchem.inp (generated)

047138133.b3lyp_6-31g(d).gjf (generated)

047138133.b3lyp_6-31g(d).firefly.inp (generated)

047138133.b3lyp_6-31g(d).smash.inp (generated)

047138133.b3lyp_6-31g(d).nwchem.inp (generated) 047138133.b3lyp_6-31g(d).log.xz 047138133.td-b3lyp_6-31g+(d).inp 047138133.td-b3lyp_6-31g+(d).log.xz

047138133.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138133.td-b3lyp_6-31+g(d).gjf (generated)

047138133.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138133.mol 047138133.PUBCHEM 047138133.mol (via Jmol)
047138156.b3lyp_6-31g(d).inp

047138156.b3lyp_6-31g(d).qchem.inp (generated)

047138156.b3lyp_6-31g(d).gjf (generated)

047138156.b3lyp_6-31g(d).firefly.inp (generated)

047138156.b3lyp_6-31g(d).smash.inp (generated)

047138156.b3lyp_6-31g(d).nwchem.inp (generated) 047138156.b3lyp_6-31g(d).log.xz 047138156.mol 047138156.PUBCHEM 047138156.mol (via Jmol)
047138161.b3lyp_6-31g(d).inp

047138161.b3lyp_6-31g(d).qchem.inp (generated)

047138161.b3lyp_6-31g(d).gjf (generated)

047138161.b3lyp_6-31g(d).firefly.inp (generated)

047138161.b3lyp_6-31g(d).smash.inp (generated)

047138161.b3lyp_6-31g(d).nwchem.inp (generated) 047138161.b3lyp_6-31g(d).log.xz 047138161.td-b3lyp_6-31g+(d).inp 047138161.td-b3lyp_6-31g+(d).log.xz

047138161.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138161.td-b3lyp_6-31+g(d).gjf (generated)

047138161.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138161.mol 047138161.PUBCHEM 047138161.mol (via Jmol)
047138216.b3lyp_6-31g(d).inp

047138216.b3lyp_6-31g(d).qchem.inp (generated)

047138216.b3lyp_6-31g(d).gjf (generated)

047138216.b3lyp_6-31g(d).firefly.inp (generated)

047138216.b3lyp_6-31g(d).smash.inp (generated)

047138216.b3lyp_6-31g(d).nwchem.inp (generated) 047138216.b3lyp_6-31g(d).log.xz 047138216.mol 047138216.PUBCHEM 047138216.mol (via Jmol)
047138268.b3lyp_6-31g(d).inp

047138268.b3lyp_6-31g(d).qchem.inp (generated)

047138268.b3lyp_6-31g(d).gjf (generated)

047138268.b3lyp_6-31g(d).firefly.inp (generated)

047138268.b3lyp_6-31g(d).smash.inp (generated)

047138268.b3lyp_6-31g(d).nwchem.inp (generated) 047138268.b3lyp_6-31g(d).log.xz 047138268.mol 047138268.PUBCHEM 047138268.mol (via Jmol)
047138302.b3lyp_6-31g(d).inp

047138302.b3lyp_6-31g(d).qchem.inp (generated)

047138302.b3lyp_6-31g(d).gjf (generated)

047138302.b3lyp_6-31g(d).firefly.inp (generated)

047138302.b3lyp_6-31g(d).smash.inp (generated)

047138302.b3lyp_6-31g(d).nwchem.inp (generated) 047138302.b3lyp_6-31g(d).log.xz 047138302.mol 047138302.PUBCHEM 047138302.mol (via Jmol)
047138303.b3lyp_6-31g(d).inp

047138303.b3lyp_6-31g(d).qchem.inp (generated)

047138303.b3lyp_6-31g(d).gjf (generated)

047138303.b3lyp_6-31g(d).firefly.inp (generated)

047138303.b3lyp_6-31g(d).smash.inp (generated)

047138303.b3lyp_6-31g(d).nwchem.inp (generated) 047138303.b3lyp_6-31g(d).log.xz 047138303.td-b3lyp_6-31g+(d).inp 047138303.td-b3lyp_6-31g+(d).log.xz

047138303.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138303.td-b3lyp_6-31+g(d).gjf (generated)

047138303.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138303.mol 047138303.PUBCHEM 047138303.mol (via Jmol)
047138374.b3lyp_6-31g(d).inp

047138374.b3lyp_6-31g(d).qchem.inp (generated)

047138374.b3lyp_6-31g(d).gjf (generated)

047138374.b3lyp_6-31g(d).firefly.inp (generated)

047138374.b3lyp_6-31g(d).smash.inp (generated)

047138374.b3lyp_6-31g(d).nwchem.inp (generated) 047138374.b3lyp_6-31g(d).log.xz 047138374.td-b3lyp_6-31g+(d).inp 047138374.td-b3lyp_6-31g+(d).log.xz

047138374.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138374.td-b3lyp_6-31+g(d).gjf (generated)

047138374.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138374.mol 047138374.PUBCHEM 047138374.mol (via Jmol)
047138375.b3lyp_6-31g(d).inp

047138375.b3lyp_6-31g(d).qchem.inp (generated)

047138375.b3lyp_6-31g(d).gjf (generated)

047138375.b3lyp_6-31g(d).firefly.inp (generated)

047138375.b3lyp_6-31g(d).smash.inp (generated)

047138375.b3lyp_6-31g(d).nwchem.inp (generated) 047138375.b3lyp_6-31g(d).log.xz 047138375.td-b3lyp_6-31g+(d).inp 047138375.td-b3lyp_6-31g+(d).log.xz

047138375.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138375.td-b3lyp_6-31+g(d).gjf (generated)

047138375.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138375.mol 047138375.PUBCHEM 047138375.mol (via Jmol)
047138386.b3lyp_6-31g(d).inp

047138386.b3lyp_6-31g(d).qchem.inp (generated)

047138386.b3lyp_6-31g(d).gjf (generated)

047138386.b3lyp_6-31g(d).firefly.inp (generated)

047138386.b3lyp_6-31g(d).smash.inp (generated)

047138386.b3lyp_6-31g(d).nwchem.inp (generated) 047138386.b3lyp_6-31g(d).log.xz 047138386.mol 047138386.PUBCHEM 047138386.mol (via Jmol)
047138404.b3lyp_6-31g(d).inp

047138404.b3lyp_6-31g(d).qchem.inp (generated)

047138404.b3lyp_6-31g(d).gjf (generated)

047138404.b3lyp_6-31g(d).firefly.inp (generated)

047138404.b3lyp_6-31g(d).smash.inp (generated)

047138404.b3lyp_6-31g(d).nwchem.inp (generated) 047138404.b3lyp_6-31g(d).log.xz 047138404.td-b3lyp_6-31g+(d).inp 047138404.td-b3lyp_6-31g+(d).log.xz

047138404.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138404.td-b3lyp_6-31+g(d).gjf (generated)

047138404.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138404.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138404.mol 047138404.PUBCHEM 047138404.mol (via Jmol)
047138542.b3lyp_6-31g(d).inp

047138542.b3lyp_6-31g(d).qchem.inp (generated)

047138542.b3lyp_6-31g(d).gjf (generated)

047138542.b3lyp_6-31g(d).firefly.inp (generated)

047138542.b3lyp_6-31g(d).smash.inp (generated)

047138542.b3lyp_6-31g(d).nwchem.inp (generated) 047138542.b3lyp_6-31g(d).log.xz 047138542.td-b3lyp_6-31g+(d).inp 047138542.td-b3lyp_6-31g+(d).log.xz

047138542.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138542.td-b3lyp_6-31+g(d).gjf (generated)

047138542.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138542.mol 047138542.PUBCHEM 047138542.mol (via Jmol)
047138548.b3lyp_6-31g(d).inp

047138548.b3lyp_6-31g(d).qchem.inp (generated)

047138548.b3lyp_6-31g(d).gjf (generated)

047138548.b3lyp_6-31g(d).firefly.inp (generated)

047138548.b3lyp_6-31g(d).smash.inp (generated)

047138548.b3lyp_6-31g(d).nwchem.inp (generated) 047138548.b3lyp_6-31g(d).log.xz 047138548.td-b3lyp_6-31g+(d).inp 047138548.td-b3lyp_6-31g+(d).log.xz

047138548.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138548.td-b3lyp_6-31+g(d).gjf (generated)

047138548.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138548.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138548.mol 047138548.PUBCHEM 047138548.mol (via Jmol)
047138591.b3lyp_6-31g(d).inp

047138591.b3lyp_6-31g(d).qchem.inp (generated)

047138591.b3lyp_6-31g(d).gjf (generated)

047138591.b3lyp_6-31g(d).firefly.inp (generated)

047138591.b3lyp_6-31g(d).smash.inp (generated)

047138591.b3lyp_6-31g(d).nwchem.inp (generated) 047138591.b3lyp_6-31g(d).log.xz 047138591.td-b3lyp_6-31g+(d).inp 047138591.td-b3lyp_6-31g+(d).log.xz

047138591.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138591.td-b3lyp_6-31+g(d).gjf (generated)

047138591.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138591.mol 047138591.PUBCHEM 047138591.mol (via Jmol)
047138658.b3lyp_6-31g(d).inp

047138658.b3lyp_6-31g(d).qchem.inp (generated)

047138658.b3lyp_6-31g(d).gjf (generated)

047138658.b3lyp_6-31g(d).firefly.inp (generated)

047138658.b3lyp_6-31g(d).smash.inp (generated)

047138658.b3lyp_6-31g(d).nwchem.inp (generated) 047138658.b3lyp_6-31g(d).log.xz 047138658.td-b3lyp_6-31g+(d).inp 047138658.td-b3lyp_6-31g+(d).log.xz

047138658.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138658.td-b3lyp_6-31+g(d).gjf (generated)

047138658.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138658.mol 047138658.PUBCHEM 047138658.mol (via Jmol)
047138761.b3lyp_6-31g(d).inp

047138761.b3lyp_6-31g(d).qchem.inp (generated)

047138761.b3lyp_6-31g(d).gjf (generated)

047138761.b3lyp_6-31g(d).firefly.inp (generated)

047138761.b3lyp_6-31g(d).smash.inp (generated)

047138761.b3lyp_6-31g(d).nwchem.inp (generated) 047138761.b3lyp_6-31g(d).log.xz 047138761.mol 047138761.PUBCHEM 047138761.mol (via Jmol)
047138778.b3lyp_6-31g(d).inp

047138778.b3lyp_6-31g(d).qchem.inp (generated)

047138778.b3lyp_6-31g(d).gjf (generated)

047138778.b3lyp_6-31g(d).firefly.inp (generated)

047138778.b3lyp_6-31g(d).smash.inp (generated)

047138778.b3lyp_6-31g(d).nwchem.inp (generated) 047138778.b3lyp_6-31g(d).log.xz 047138778.td-b3lyp_6-31g+(d).inp 047138778.td-b3lyp_6-31g+(d).log.xz

047138778.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138778.td-b3lyp_6-31+g(d).gjf (generated)

047138778.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138778.mol 047138778.PUBCHEM 047138778.mol (via Jmol)
047138834.b3lyp_6-31g(d).inp

047138834.b3lyp_6-31g(d).qchem.inp (generated)

047138834.b3lyp_6-31g(d).gjf (generated)

047138834.b3lyp_6-31g(d).firefly.inp (generated)

047138834.b3lyp_6-31g(d).smash.inp (generated)

047138834.b3lyp_6-31g(d).nwchem.inp (generated) 047138834.b3lyp_6-31g(d).log.xz 047138834.td-b3lyp_6-31g+(d).inp 047138834.td-b3lyp_6-31g+(d).log.xz

047138834.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138834.td-b3lyp_6-31+g(d).gjf (generated)

047138834.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138834.mol 047138834.PUBCHEM 047138834.mol (via Jmol)
047138836.b3lyp_6-31g(d).inp

047138836.b3lyp_6-31g(d).qchem.inp (generated)

047138836.b3lyp_6-31g(d).gjf (generated)

047138836.b3lyp_6-31g(d).firefly.inp (generated)

047138836.b3lyp_6-31g(d).smash.inp (generated)

047138836.b3lyp_6-31g(d).nwchem.inp (generated) 047138836.b3lyp_6-31g(d).log.xz 047138836.td-b3lyp_6-31g+(d).inp 047138836.td-b3lyp_6-31g+(d).log.xz

047138836.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138836.td-b3lyp_6-31+g(d).gjf (generated)

047138836.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138836.mol 047138836.PUBCHEM 047138836.mol (via Jmol)
047138866.b3lyp_6-31g(d).inp

047138866.b3lyp_6-31g(d).qchem.inp (generated)

047138866.b3lyp_6-31g(d).gjf (generated)

047138866.b3lyp_6-31g(d).firefly.inp (generated)

047138866.b3lyp_6-31g(d).smash.inp (generated)

047138866.b3lyp_6-31g(d).nwchem.inp (generated) 047138866.b3lyp_6-31g(d).log.xz 047138866.td-b3lyp_6-31g+(d).inp 047138866.td-b3lyp_6-31g+(d).log.xz

047138866.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138866.td-b3lyp_6-31+g(d).gjf (generated)

047138866.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138866.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138866.mol 047138866.PUBCHEM 047138866.mol (via Jmol)
047138867.b3lyp_6-31g(d).inp

047138867.b3lyp_6-31g(d).qchem.inp (generated)

047138867.b3lyp_6-31g(d).gjf (generated)

047138867.b3lyp_6-31g(d).firefly.inp (generated)

047138867.b3lyp_6-31g(d).smash.inp (generated)

047138867.b3lyp_6-31g(d).nwchem.inp (generated) 047138867.b3lyp_6-31g(d).log.xz 047138867.td-b3lyp_6-31g+(d).inp 047138867.td-b3lyp_6-31g+(d).log.xz

047138867.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138867.td-b3lyp_6-31+g(d).gjf (generated)

047138867.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138867.mol 047138867.PUBCHEM 047138867.mol (via Jmol)
047138903.b3lyp_6-31g(d).inp

047138903.b3lyp_6-31g(d).qchem.inp (generated)

047138903.b3lyp_6-31g(d).gjf (generated)

047138903.b3lyp_6-31g(d).firefly.inp (generated)

047138903.b3lyp_6-31g(d).smash.inp (generated)

047138903.b3lyp_6-31g(d).nwchem.inp (generated) 047138903.b3lyp_6-31g(d).log.xz 047138903.td-b3lyp_6-31g+(d).inp 047138903.td-b3lyp_6-31g+(d).log.xz

047138903.td-b3lyp_6-31+g(d).qchem.inp (generated)

047138903.td-b3lyp_6-31+g(d).gjf (generated)

047138903.td-b3lyp_6-31+g(d).firefly.inp (generated)

047138903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047138903.mol 047138903.PUBCHEM 047138903.mol (via Jmol)
047138927.b3lyp_6-31g(d).inp

047138927.b3lyp_6-31g(d).qchem.inp (generated)

047138927.b3lyp_6-31g(d).gjf (generated)

047138927.b3lyp_6-31g(d).firefly.inp (generated)

047138927.b3lyp_6-31g(d).smash.inp (generated)

047138927.b3lyp_6-31g(d).nwchem.inp (generated) 047138927.b3lyp_6-31g(d).log.xz 047138927.mol 047138927.PUBCHEM 047138927.mol (via Jmol)
047139116.b3lyp_6-31g(d).inp

047139116.b3lyp_6-31g(d).qchem.inp (generated)

047139116.b3lyp_6-31g(d).gjf (generated)

047139116.b3lyp_6-31g(d).firefly.inp (generated)

047139116.b3lyp_6-31g(d).smash.inp (generated)

047139116.b3lyp_6-31g(d).nwchem.inp (generated) 047139116.b3lyp_6-31g(d).log.xz 047139116.td-b3lyp_6-31g+(d).inp 047139116.td-b3lyp_6-31g+(d).log.xz

047139116.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139116.td-b3lyp_6-31+g(d).gjf (generated)

047139116.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139116.mol 047139116.PUBCHEM 047139116.mol (via Jmol)
047139171.b3lyp_6-31g(d).inp

047139171.b3lyp_6-31g(d).qchem.inp (generated)

047139171.b3lyp_6-31g(d).gjf (generated)

047139171.b3lyp_6-31g(d).firefly.inp (generated)

047139171.b3lyp_6-31g(d).smash.inp (generated)

047139171.b3lyp_6-31g(d).nwchem.inp (generated) 047139171.b3lyp_6-31g(d).log.xz 047139171.td-b3lyp_6-31g+(d).inp 047139171.td-b3lyp_6-31g+(d).log.xz

047139171.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139171.td-b3lyp_6-31+g(d).gjf (generated)

047139171.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139171.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139171.mol 047139171.PUBCHEM 047139171.mol (via Jmol)
047139182.b3lyp_6-31g(d).inp

047139182.b3lyp_6-31g(d).qchem.inp (generated)

047139182.b3lyp_6-31g(d).gjf (generated)

047139182.b3lyp_6-31g(d).firefly.inp (generated)

047139182.b3lyp_6-31g(d).smash.inp (generated)

047139182.b3lyp_6-31g(d).nwchem.inp (generated) 047139182.b3lyp_6-31g(d).log.xz 047139182.td-b3lyp_6-31g+(d).inp 047139182.td-b3lyp_6-31g+(d).log.xz

047139182.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139182.td-b3lyp_6-31+g(d).gjf (generated)

047139182.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139182.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139182.mol 047139182.PUBCHEM 047139182.mol (via Jmol)
047139208.b3lyp_6-31g(d).inp

047139208.b3lyp_6-31g(d).qchem.inp (generated)

047139208.b3lyp_6-31g(d).gjf (generated)

047139208.b3lyp_6-31g(d).firefly.inp (generated)

047139208.b3lyp_6-31g(d).smash.inp (generated)

047139208.b3lyp_6-31g(d).nwchem.inp (generated) 047139208.b3lyp_6-31g(d).log.xz 047139208.td-b3lyp_6-31g+(d).inp 047139208.td-b3lyp_6-31g+(d).log.xz

047139208.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139208.td-b3lyp_6-31+g(d).gjf (generated)

047139208.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139208.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139208.mol 047139208.PUBCHEM 047139208.mol (via Jmol)
047139219.b3lyp_6-31g(d).inp

047139219.b3lyp_6-31g(d).qchem.inp (generated)

047139219.b3lyp_6-31g(d).gjf (generated)

047139219.b3lyp_6-31g(d).firefly.inp (generated)

047139219.b3lyp_6-31g(d).smash.inp (generated)

047139219.b3lyp_6-31g(d).nwchem.inp (generated) 047139219.b3lyp_6-31g(d).log.xz 047139219.mol 047139219.PUBCHEM 047139219.mol (via Jmol)
047139334.b3lyp_6-31g(d).inp

047139334.b3lyp_6-31g(d).qchem.inp (generated)

047139334.b3lyp_6-31g(d).gjf (generated)

047139334.b3lyp_6-31g(d).firefly.inp (generated)

047139334.b3lyp_6-31g(d).smash.inp (generated)

047139334.b3lyp_6-31g(d).nwchem.inp (generated) 047139334.b3lyp_6-31g(d).log.xz 047139334.td-b3lyp_6-31g+(d).inp 047139334.td-b3lyp_6-31g+(d).log.xz

047139334.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139334.td-b3lyp_6-31+g(d).gjf (generated)

047139334.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139334.mol 047139334.PUBCHEM 047139334.mol (via Jmol)
047139341.b3lyp_6-31g(d).inp

047139341.b3lyp_6-31g(d).qchem.inp (generated)

047139341.b3lyp_6-31g(d).gjf (generated)

047139341.b3lyp_6-31g(d).firefly.inp (generated)

047139341.b3lyp_6-31g(d).smash.inp (generated)

047139341.b3lyp_6-31g(d).nwchem.inp (generated) 047139341.b3lyp_6-31g(d).log.xz 047139341.td-b3lyp_6-31g+(d).inp 047139341.td-b3lyp_6-31g+(d).log.xz

047139341.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139341.td-b3lyp_6-31+g(d).gjf (generated)

047139341.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139341.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139341.mol 047139341.PUBCHEM 047139341.mol (via Jmol)
047139375.b3lyp_6-31g(d).inp

047139375.b3lyp_6-31g(d).qchem.inp (generated)

047139375.b3lyp_6-31g(d).gjf (generated)

047139375.b3lyp_6-31g(d).firefly.inp (generated)

047139375.b3lyp_6-31g(d).smash.inp (generated)

047139375.b3lyp_6-31g(d).nwchem.inp (generated) 047139375.b3lyp_6-31g(d).log.xz 047139375.td-b3lyp_6-31g+(d).inp 047139375.td-b3lyp_6-31g+(d).log.xz

047139375.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139375.td-b3lyp_6-31+g(d).gjf (generated)

047139375.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139375.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139375.mol 047139375.PUBCHEM 047139375.mol (via Jmol)
047139380.b3lyp_6-31g(d).inp

047139380.b3lyp_6-31g(d).qchem.inp (generated)

047139380.b3lyp_6-31g(d).gjf (generated)

047139380.b3lyp_6-31g(d).firefly.inp (generated)

047139380.b3lyp_6-31g(d).smash.inp (generated)

047139380.b3lyp_6-31g(d).nwchem.inp (generated) 047139380.b3lyp_6-31g(d).log.xz 047139380.mol 047139380.PUBCHEM 047139380.mol (via Jmol)
047139418.b3lyp_6-31g(d).inp

047139418.b3lyp_6-31g(d).qchem.inp (generated)

047139418.b3lyp_6-31g(d).gjf (generated)

047139418.b3lyp_6-31g(d).firefly.inp (generated)

047139418.b3lyp_6-31g(d).smash.inp (generated)

047139418.b3lyp_6-31g(d).nwchem.inp (generated) 047139418.b3lyp_6-31g(d).log.xz 047139418.td-b3lyp_6-31g+(d).inp 047139418.td-b3lyp_6-31g+(d).log.xz

047139418.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139418.td-b3lyp_6-31+g(d).gjf (generated)

047139418.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139418.mol 047139418.PUBCHEM 047139418.mol (via Jmol)
047139426.b3lyp_6-31g(d).inp

047139426.b3lyp_6-31g(d).qchem.inp (generated)

047139426.b3lyp_6-31g(d).gjf (generated)

047139426.b3lyp_6-31g(d).firefly.inp (generated)

047139426.b3lyp_6-31g(d).smash.inp (generated)

047139426.b3lyp_6-31g(d).nwchem.inp (generated) 047139426.b3lyp_6-31g(d).log.xz 047139426.td-b3lyp_6-31g+(d).inp 047139426.td-b3lyp_6-31g+(d).log.xz

047139426.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139426.td-b3lyp_6-31+g(d).gjf (generated)

047139426.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139426.mol 047139426.PUBCHEM 047139426.mol (via Jmol)
047139428.b3lyp_6-31g(d).inp

047139428.b3lyp_6-31g(d).qchem.inp (generated)

047139428.b3lyp_6-31g(d).gjf (generated)

047139428.b3lyp_6-31g(d).firefly.inp (generated)

047139428.b3lyp_6-31g(d).smash.inp (generated)

047139428.b3lyp_6-31g(d).nwchem.inp (generated) 047139428.b3lyp_6-31g(d).log.xz 047139428.td-b3lyp_6-31g+(d).inp 047139428.td-b3lyp_6-31g+(d).log.xz

047139428.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139428.td-b3lyp_6-31+g(d).gjf (generated)

047139428.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139428.mol 047139428.PUBCHEM 047139428.mol (via Jmol)
047139452.b3lyp_6-31g(d).inp

047139452.b3lyp_6-31g(d).qchem.inp (generated)

047139452.b3lyp_6-31g(d).gjf (generated)

047139452.b3lyp_6-31g(d).firefly.inp (generated)

047139452.b3lyp_6-31g(d).smash.inp (generated)

047139452.b3lyp_6-31g(d).nwchem.inp (generated) 047139452.b3lyp_6-31g(d).log.xz 047139452.td-b3lyp_6-31g+(d).inp 047139452.td-b3lyp_6-31g+(d).log.xz

047139452.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139452.td-b3lyp_6-31+g(d).gjf (generated)

047139452.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139452.mol 047139452.PUBCHEM 047139452.mol (via Jmol)
047139496.b3lyp_6-31g(d).inp

047139496.b3lyp_6-31g(d).qchem.inp (generated)

047139496.b3lyp_6-31g(d).gjf (generated)

047139496.b3lyp_6-31g(d).firefly.inp (generated)

047139496.b3lyp_6-31g(d).smash.inp (generated)

047139496.b3lyp_6-31g(d).nwchem.inp (generated) 047139496.b3lyp_6-31g(d).log.xz 047139496.td-b3lyp_6-31g+(d).inp 047139496.td-b3lyp_6-31g+(d).log.xz

047139496.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139496.td-b3lyp_6-31+g(d).gjf (generated)

047139496.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139496.mol 047139496.PUBCHEM 047139496.mol (via Jmol)
047139501.b3lyp_6-31g(d).inp

047139501.b3lyp_6-31g(d).qchem.inp (generated)

047139501.b3lyp_6-31g(d).gjf (generated)

047139501.b3lyp_6-31g(d).firefly.inp (generated)

047139501.b3lyp_6-31g(d).smash.inp (generated)

047139501.b3lyp_6-31g(d).nwchem.inp (generated) 047139501.b3lyp_6-31g(d).log.xz 047139501.td-b3lyp_6-31g+(d).inp 047139501.td-b3lyp_6-31g+(d).log.xz

047139501.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139501.td-b3lyp_6-31+g(d).gjf (generated)

047139501.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139501.mol 047139501.PUBCHEM 047139501.mol (via Jmol)
047139735.b3lyp_6-31g(d).inp

047139735.b3lyp_6-31g(d).qchem.inp (generated)

047139735.b3lyp_6-31g(d).gjf (generated)

047139735.b3lyp_6-31g(d).firefly.inp (generated)

047139735.b3lyp_6-31g(d).smash.inp (generated)

047139735.b3lyp_6-31g(d).nwchem.inp (generated) 047139735.b3lyp_6-31g(d).log.xz 047139735.td-b3lyp_6-31g+(d).inp 047139735.td-b3lyp_6-31g+(d).log.xz

047139735.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139735.td-b3lyp_6-31+g(d).gjf (generated)

047139735.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139735.mol 047139735.PUBCHEM 047139735.mol (via Jmol)
047139750.b3lyp_6-31g(d).inp

047139750.b3lyp_6-31g(d).qchem.inp (generated)

047139750.b3lyp_6-31g(d).gjf (generated)

047139750.b3lyp_6-31g(d).firefly.inp (generated)

047139750.b3lyp_6-31g(d).smash.inp (generated)

047139750.b3lyp_6-31g(d).nwchem.inp (generated) 047139750.b3lyp_6-31g(d).log.xz 047139750.td-b3lyp_6-31g+(d).inp 047139750.td-b3lyp_6-31g+(d).log.xz

047139750.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139750.td-b3lyp_6-31+g(d).gjf (generated)

047139750.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139750.mol 047139750.PUBCHEM 047139750.mol (via Jmol)
047139782.b3lyp_6-31g(d).inp

047139782.b3lyp_6-31g(d).qchem.inp (generated)

047139782.b3lyp_6-31g(d).gjf (generated)

047139782.b3lyp_6-31g(d).firefly.inp (generated)

047139782.b3lyp_6-31g(d).smash.inp (generated)

047139782.b3lyp_6-31g(d).nwchem.inp (generated) 047139782.b3lyp_6-31g(d).log.xz 047139782.td-b3lyp_6-31g+(d).inp 047139782.td-b3lyp_6-31g+(d).log.xz

047139782.td-b3lyp_6-31+g(d).qchem.inp (generated)

047139782.td-b3lyp_6-31+g(d).gjf (generated)

047139782.td-b3lyp_6-31+g(d).firefly.inp (generated)

047139782.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047139782.mol 047139782.PUBCHEM 047139782.mol (via Jmol)
047140037.b3lyp_6-31g(d).inp

047140037.b3lyp_6-31g(d).qchem.inp (generated)

047140037.b3lyp_6-31g(d).gjf (generated)

047140037.b3lyp_6-31g(d).firefly.inp (generated)

047140037.b3lyp_6-31g(d).smash.inp (generated)

047140037.b3lyp_6-31g(d).nwchem.inp (generated) 047140037.b3lyp_6-31g(d).log.xz 047140037.td-b3lyp_6-31g+(d).inp 047140037.td-b3lyp_6-31g+(d).log.xz

047140037.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140037.td-b3lyp_6-31+g(d).gjf (generated)

047140037.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140037.mol 047140037.PUBCHEM 047140037.mol (via Jmol)
047140381.b3lyp_6-31g(d).inp

047140381.b3lyp_6-31g(d).qchem.inp (generated)

047140381.b3lyp_6-31g(d).gjf (generated)

047140381.b3lyp_6-31g(d).firefly.inp (generated)

047140381.b3lyp_6-31g(d).smash.inp (generated)

047140381.b3lyp_6-31g(d).nwchem.inp (generated) 047140381.b3lyp_6-31g(d).log.xz 047140381.td-b3lyp_6-31g+(d).inp 047140381.td-b3lyp_6-31g+(d).log.xz

047140381.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140381.td-b3lyp_6-31+g(d).gjf (generated)

047140381.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140381.mol 047140381.PUBCHEM 047140381.mol (via Jmol)
047140418.b3lyp_6-31g(d).inp

047140418.b3lyp_6-31g(d).qchem.inp (generated)

047140418.b3lyp_6-31g(d).gjf (generated)

047140418.b3lyp_6-31g(d).firefly.inp (generated)

047140418.b3lyp_6-31g(d).smash.inp (generated)

047140418.b3lyp_6-31g(d).nwchem.inp (generated) 047140418.b3lyp_6-31g(d).log.xz 047140418.td-b3lyp_6-31g+(d).inp 047140418.td-b3lyp_6-31g+(d).log.xz

047140418.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140418.td-b3lyp_6-31+g(d).gjf (generated)

047140418.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140418.mol 047140418.PUBCHEM 047140418.mol (via Jmol)
047140423.b3lyp_6-31g(d).inp

047140423.b3lyp_6-31g(d).qchem.inp (generated)

047140423.b3lyp_6-31g(d).gjf (generated)

047140423.b3lyp_6-31g(d).firefly.inp (generated)

047140423.b3lyp_6-31g(d).smash.inp (generated)

047140423.b3lyp_6-31g(d).nwchem.inp (generated) 047140423.b3lyp_6-31g(d).log.xz 047140423.td-b3lyp_6-31g+(d).inp 047140423.td-b3lyp_6-31g+(d).log.xz

047140423.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140423.td-b3lyp_6-31+g(d).gjf (generated)

047140423.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140423.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140423.mol 047140423.PUBCHEM 047140423.mol (via Jmol)
047140441.b3lyp_6-31g(d).inp

047140441.b3lyp_6-31g(d).qchem.inp (generated)

047140441.b3lyp_6-31g(d).gjf (generated)

047140441.b3lyp_6-31g(d).firefly.inp (generated)

047140441.b3lyp_6-31g(d).smash.inp (generated)

047140441.b3lyp_6-31g(d).nwchem.inp (generated) 047140441.b3lyp_6-31g(d).log.xz 047140441.td-b3lyp_6-31g+(d).inp 047140441.td-b3lyp_6-31g+(d).log.xz

047140441.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140441.td-b3lyp_6-31+g(d).gjf (generated)

047140441.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140441.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140441.mol 047140441.PUBCHEM 047140441.mol (via Jmol)
047140505.b3lyp_6-31g(d).inp

047140505.b3lyp_6-31g(d).qchem.inp (generated)

047140505.b3lyp_6-31g(d).gjf (generated)

047140505.b3lyp_6-31g(d).firefly.inp (generated)

047140505.b3lyp_6-31g(d).smash.inp (generated)

047140505.b3lyp_6-31g(d).nwchem.inp (generated) 047140505.b3lyp_6-31g(d).log.xz 047140505.td-b3lyp_6-31g+(d).inp 047140505.td-b3lyp_6-31g+(d).log.xz

047140505.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140505.td-b3lyp_6-31+g(d).gjf (generated)

047140505.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140505.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140505.mol 047140505.PUBCHEM 047140505.mol (via Jmol)
047140535.b3lyp_6-31g(d).inp

047140535.b3lyp_6-31g(d).qchem.inp (generated)

047140535.b3lyp_6-31g(d).gjf (generated)

047140535.b3lyp_6-31g(d).firefly.inp (generated)

047140535.b3lyp_6-31g(d).smash.inp (generated)

047140535.b3lyp_6-31g(d).nwchem.inp (generated) 047140535.b3lyp_6-31g(d).log.xz 047140535.mol 047140535.PUBCHEM 047140535.mol (via Jmol)
047140546.b3lyp_6-31g(d).inp

047140546.b3lyp_6-31g(d).qchem.inp (generated)

047140546.b3lyp_6-31g(d).gjf (generated)

047140546.b3lyp_6-31g(d).firefly.inp (generated)

047140546.b3lyp_6-31g(d).smash.inp (generated)

047140546.b3lyp_6-31g(d).nwchem.inp (generated) 047140546.b3lyp_6-31g(d).log.xz 047140546.td-b3lyp_6-31g+(d).inp 047140546.td-b3lyp_6-31g+(d).log.xz

047140546.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140546.td-b3lyp_6-31+g(d).gjf (generated)

047140546.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140546.mol 047140546.PUBCHEM 047140546.mol (via Jmol)
047140633.b3lyp_6-31g(d).inp

047140633.b3lyp_6-31g(d).qchem.inp (generated)

047140633.b3lyp_6-31g(d).gjf (generated)

047140633.b3lyp_6-31g(d).firefly.inp (generated)

047140633.b3lyp_6-31g(d).smash.inp (generated)

047140633.b3lyp_6-31g(d).nwchem.inp (generated) 047140633.b3lyp_6-31g(d).log.xz 047140633.td-b3lyp_6-31g+(d).inp 047140633.td-b3lyp_6-31g+(d).log.xz

047140633.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140633.td-b3lyp_6-31+g(d).gjf (generated)

047140633.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140633.mol 047140633.PUBCHEM 047140633.mol (via Jmol)
047140635.b3lyp_6-31g(d).inp

047140635.b3lyp_6-31g(d).qchem.inp (generated)

047140635.b3lyp_6-31g(d).gjf (generated)

047140635.b3lyp_6-31g(d).firefly.inp (generated)

047140635.b3lyp_6-31g(d).smash.inp (generated)

047140635.b3lyp_6-31g(d).nwchem.inp (generated) 047140635.b3lyp_6-31g(d).log.xz 047140635.td-b3lyp_6-31g+(d).inp 047140635.td-b3lyp_6-31g+(d).log.xz

047140635.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140635.td-b3lyp_6-31+g(d).gjf (generated)

047140635.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140635.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140635.mol 047140635.PUBCHEM 047140635.mol (via Jmol)
047140693.b3lyp_6-31g(d).inp

047140693.b3lyp_6-31g(d).qchem.inp (generated)

047140693.b3lyp_6-31g(d).gjf (generated)

047140693.b3lyp_6-31g(d).firefly.inp (generated)

047140693.b3lyp_6-31g(d).smash.inp (generated)

047140693.b3lyp_6-31g(d).nwchem.inp (generated) 047140693.b3lyp_6-31g(d).log.xz 047140693.mol 047140693.PUBCHEM 047140693.mol (via Jmol)
047140701.b3lyp_6-31g(d).inp

047140701.b3lyp_6-31g(d).qchem.inp (generated)

047140701.b3lyp_6-31g(d).gjf (generated)

047140701.b3lyp_6-31g(d).firefly.inp (generated)

047140701.b3lyp_6-31g(d).smash.inp (generated)

047140701.b3lyp_6-31g(d).nwchem.inp (generated) 047140701.b3lyp_6-31g(d).log.xz 047140701.mol 047140701.PUBCHEM 047140701.mol (via Jmol)
047140702.b3lyp_6-31g(d).inp

047140702.b3lyp_6-31g(d).qchem.inp (generated)

047140702.b3lyp_6-31g(d).gjf (generated)

047140702.b3lyp_6-31g(d).firefly.inp (generated)

047140702.b3lyp_6-31g(d).smash.inp (generated)

047140702.b3lyp_6-31g(d).nwchem.inp (generated) 047140702.b3lyp_6-31g(d).log.xz 047140702.td-b3lyp_6-31g+(d).inp 047140702.td-b3lyp_6-31g+(d).log.xz

047140702.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140702.td-b3lyp_6-31+g(d).gjf (generated)

047140702.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140702.mol 047140702.PUBCHEM 047140702.mol (via Jmol)
047140737.b3lyp_6-31g(d).inp

047140737.b3lyp_6-31g(d).qchem.inp (generated)

047140737.b3lyp_6-31g(d).gjf (generated)

047140737.b3lyp_6-31g(d).firefly.inp (generated)

047140737.b3lyp_6-31g(d).smash.inp (generated)

047140737.b3lyp_6-31g(d).nwchem.inp (generated) 047140737.b3lyp_6-31g(d).log.xz 047140737.td-b3lyp_6-31g+(d).inp 047140737.td-b3lyp_6-31g+(d).log.xz

047140737.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140737.td-b3lyp_6-31+g(d).gjf (generated)

047140737.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140737.mol 047140737.PUBCHEM 047140737.mol (via Jmol)
047140823.b3lyp_6-31g(d).inp

047140823.b3lyp_6-31g(d).qchem.inp (generated)

047140823.b3lyp_6-31g(d).gjf (generated)

047140823.b3lyp_6-31g(d).firefly.inp (generated)

047140823.b3lyp_6-31g(d).smash.inp (generated)

047140823.b3lyp_6-31g(d).nwchem.inp (generated) 047140823.b3lyp_6-31g(d).log.xz 047140823.td-b3lyp_6-31g+(d).inp 047140823.td-b3lyp_6-31g+(d).log.xz

047140823.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140823.td-b3lyp_6-31+g(d).gjf (generated)

047140823.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140823.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140823.mol 047140823.PUBCHEM 047140823.mol (via Jmol)
047140872.b3lyp_6-31g(d).inp

047140872.b3lyp_6-31g(d).qchem.inp (generated)

047140872.b3lyp_6-31g(d).gjf (generated)

047140872.b3lyp_6-31g(d).firefly.inp (generated)

047140872.b3lyp_6-31g(d).smash.inp (generated)

047140872.b3lyp_6-31g(d).nwchem.inp (generated) 047140872.b3lyp_6-31g(d).log.xz 047140872.mol 047140872.PUBCHEM 047140872.mol (via Jmol)
047140956.b3lyp_6-31g(d).inp

047140956.b3lyp_6-31g(d).qchem.inp (generated)

047140956.b3lyp_6-31g(d).gjf (generated)

047140956.b3lyp_6-31g(d).firefly.inp (generated)

047140956.b3lyp_6-31g(d).smash.inp (generated)

047140956.b3lyp_6-31g(d).nwchem.inp (generated) 047140956.b3lyp_6-31g(d).log.xz 047140956.mol 047140956.PUBCHEM 047140956.mol (via Jmol)
047140983.b3lyp_6-31g(d).inp

047140983.b3lyp_6-31g(d).qchem.inp (generated)

047140983.b3lyp_6-31g(d).gjf (generated)

047140983.b3lyp_6-31g(d).firefly.inp (generated)

047140983.b3lyp_6-31g(d).smash.inp (generated)

047140983.b3lyp_6-31g(d).nwchem.inp (generated) 047140983.b3lyp_6-31g(d).log.xz 047140983.td-b3lyp_6-31g+(d).inp 047140983.td-b3lyp_6-31g+(d).log.xz

047140983.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140983.td-b3lyp_6-31+g(d).gjf (generated)

047140983.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140983.mol 047140983.PUBCHEM 047140983.mol (via Jmol)
047140989.b3lyp_6-31g(d).inp

047140989.b3lyp_6-31g(d).qchem.inp (generated)

047140989.b3lyp_6-31g(d).gjf (generated)

047140989.b3lyp_6-31g(d).firefly.inp (generated)

047140989.b3lyp_6-31g(d).smash.inp (generated)

047140989.b3lyp_6-31g(d).nwchem.inp (generated) 047140989.b3lyp_6-31g(d).log.xz 047140989.td-b3lyp_6-31g+(d).inp 047140989.td-b3lyp_6-31g+(d).log.xz

047140989.td-b3lyp_6-31+g(d).qchem.inp (generated)

047140989.td-b3lyp_6-31+g(d).gjf (generated)

047140989.td-b3lyp_6-31+g(d).firefly.inp (generated)

047140989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047140989.mol 047140989.PUBCHEM 047140989.mol (via Jmol)
047141015.b3lyp_6-31g(d).inp

047141015.b3lyp_6-31g(d).qchem.inp (generated)

047141015.b3lyp_6-31g(d).gjf (generated)

047141015.b3lyp_6-31g(d).firefly.inp (generated)

047141015.b3lyp_6-31g(d).smash.inp (generated)

047141015.b3lyp_6-31g(d).nwchem.inp (generated) 047141015.b3lyp_6-31g(d).log.xz 047141015.td-b3lyp_6-31g+(d).inp 047141015.td-b3lyp_6-31g+(d).log.xz

047141015.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141015.td-b3lyp_6-31+g(d).gjf (generated)

047141015.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141015.mol 047141015.PUBCHEM 047141015.mol (via Jmol)
047141047.b3lyp_6-31g(d).inp

047141047.b3lyp_6-31g(d).qchem.inp (generated)

047141047.b3lyp_6-31g(d).gjf (generated)

047141047.b3lyp_6-31g(d).firefly.inp (generated)

047141047.b3lyp_6-31g(d).smash.inp (generated)

047141047.b3lyp_6-31g(d).nwchem.inp (generated) 047141047.b3lyp_6-31g(d).log.xz 047141047.mol 047141047.PUBCHEM 047141047.mol (via Jmol)
047141087.b3lyp_6-31g(d).inp

047141087.b3lyp_6-31g(d).qchem.inp (generated)

047141087.b3lyp_6-31g(d).gjf (generated)

047141087.b3lyp_6-31g(d).firefly.inp (generated)

047141087.b3lyp_6-31g(d).smash.inp (generated)

047141087.b3lyp_6-31g(d).nwchem.inp (generated) 047141087.b3lyp_6-31g(d).log.xz 047141087.td-b3lyp_6-31g+(d).inp 047141087.td-b3lyp_6-31g+(d).log.xz

047141087.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141087.td-b3lyp_6-31+g(d).gjf (generated)

047141087.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141087.mol 047141087.PUBCHEM 047141087.mol (via Jmol)
047141091.b3lyp_6-31g(d).inp

047141091.b3lyp_6-31g(d).qchem.inp (generated)

047141091.b3lyp_6-31g(d).gjf (generated)

047141091.b3lyp_6-31g(d).firefly.inp (generated)

047141091.b3lyp_6-31g(d).smash.inp (generated)

047141091.b3lyp_6-31g(d).nwchem.inp (generated) 047141091.b3lyp_6-31g(d).log.xz 047141091.td-b3lyp_6-31g+(d).inp 047141091.td-b3lyp_6-31g+(d).log.xz

047141091.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141091.td-b3lyp_6-31+g(d).gjf (generated)

047141091.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141091.mol 047141091.PUBCHEM 047141091.mol (via Jmol)
047141099.b3lyp_6-31g(d).inp

047141099.b3lyp_6-31g(d).qchem.inp (generated)

047141099.b3lyp_6-31g(d).gjf (generated)

047141099.b3lyp_6-31g(d).firefly.inp (generated)

047141099.b3lyp_6-31g(d).smash.inp (generated)

047141099.b3lyp_6-31g(d).nwchem.inp (generated) 047141099.b3lyp_6-31g(d).log.xz 047141099.td-b3lyp_6-31g+(d).inp 047141099.td-b3lyp_6-31g+(d).log.xz

047141099.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141099.td-b3lyp_6-31+g(d).gjf (generated)

047141099.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141099.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141099.mol 047141099.PUBCHEM 047141099.mol (via Jmol)
047141222.b3lyp_6-31g(d).inp

047141222.b3lyp_6-31g(d).qchem.inp (generated)

047141222.b3lyp_6-31g(d).gjf (generated)

047141222.b3lyp_6-31g(d).firefly.inp (generated)

047141222.b3lyp_6-31g(d).smash.inp (generated)

047141222.b3lyp_6-31g(d).nwchem.inp (generated) 047141222.b3lyp_6-31g(d).log.xz 047141222.td-b3lyp_6-31g+(d).inp 047141222.td-b3lyp_6-31g+(d).log.xz

047141222.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141222.td-b3lyp_6-31+g(d).gjf (generated)

047141222.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141222.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141222.mol 047141222.PUBCHEM 047141222.mol (via Jmol)
047141226.b3lyp_6-31g(d).inp

047141226.b3lyp_6-31g(d).qchem.inp (generated)

047141226.b3lyp_6-31g(d).gjf (generated)

047141226.b3lyp_6-31g(d).firefly.inp (generated)

047141226.b3lyp_6-31g(d).smash.inp (generated)

047141226.b3lyp_6-31g(d).nwchem.inp (generated) 047141226.b3lyp_6-31g(d).log.xz 047141226.td-b3lyp_6-31g+(d).inp 047141226.td-b3lyp_6-31g+(d).log.xz

047141226.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141226.td-b3lyp_6-31+g(d).gjf (generated)

047141226.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141226.mol 047141226.PUBCHEM 047141226.mol (via Jmol)
047141243.b3lyp_6-31g(d).inp

047141243.b3lyp_6-31g(d).qchem.inp (generated)

047141243.b3lyp_6-31g(d).gjf (generated)

047141243.b3lyp_6-31g(d).firefly.inp (generated)

047141243.b3lyp_6-31g(d).smash.inp (generated)

047141243.b3lyp_6-31g(d).nwchem.inp (generated) 047141243.b3lyp_6-31g(d).log.xz 047141243.mol 047141243.PUBCHEM 047141243.mol (via Jmol)
047141288.b3lyp_6-31g(d).inp

047141288.b3lyp_6-31g(d).qchem.inp (generated)

047141288.b3lyp_6-31g(d).gjf (generated)

047141288.b3lyp_6-31g(d).firefly.inp (generated)

047141288.b3lyp_6-31g(d).smash.inp (generated)

047141288.b3lyp_6-31g(d).nwchem.inp (generated) 047141288.b3lyp_6-31g(d).log.xz 047141288.mol 047141288.PUBCHEM 047141288.mol (via Jmol)
047141300.b3lyp_6-31g(d).inp

047141300.b3lyp_6-31g(d).qchem.inp (generated)

047141300.b3lyp_6-31g(d).gjf (generated)

047141300.b3lyp_6-31g(d).firefly.inp (generated)

047141300.b3lyp_6-31g(d).smash.inp (generated)

047141300.b3lyp_6-31g(d).nwchem.inp (generated) 047141300.b3lyp_6-31g(d).log.xz 047141300.td-b3lyp_6-31g+(d).inp 047141300.td-b3lyp_6-31g+(d).log.xz

047141300.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141300.td-b3lyp_6-31+g(d).gjf (generated)

047141300.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141300.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141300.mol 047141300.PUBCHEM 047141300.mol (via Jmol)
047141360.b3lyp_6-31g(d).inp

047141360.b3lyp_6-31g(d).qchem.inp (generated)

047141360.b3lyp_6-31g(d).gjf (generated)

047141360.b3lyp_6-31g(d).firefly.inp (generated)

047141360.b3lyp_6-31g(d).smash.inp (generated)

047141360.b3lyp_6-31g(d).nwchem.inp (generated) 047141360.b3lyp_6-31g(d).log.xz 047141360.td-b3lyp_6-31g+(d).inp 047141360.td-b3lyp_6-31g+(d).log.xz

047141360.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141360.td-b3lyp_6-31+g(d).gjf (generated)

047141360.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141360.mol 047141360.PUBCHEM 047141360.mol (via Jmol)
047141370.b3lyp_6-31g(d).inp

047141370.b3lyp_6-31g(d).qchem.inp (generated)

047141370.b3lyp_6-31g(d).gjf (generated)

047141370.b3lyp_6-31g(d).firefly.inp (generated)

047141370.b3lyp_6-31g(d).smash.inp (generated)

047141370.b3lyp_6-31g(d).nwchem.inp (generated) 047141370.b3lyp_6-31g(d).log.xz 047141370.td-b3lyp_6-31g+(d).inp 047141370.td-b3lyp_6-31g+(d).log.xz

047141370.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141370.td-b3lyp_6-31+g(d).gjf (generated)

047141370.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141370.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141370.mol 047141370.PUBCHEM 047141370.mol (via Jmol)
047141371.b3lyp_6-31g(d).inp

047141371.b3lyp_6-31g(d).qchem.inp (generated)

047141371.b3lyp_6-31g(d).gjf (generated)

047141371.b3lyp_6-31g(d).firefly.inp (generated)

047141371.b3lyp_6-31g(d).smash.inp (generated)

047141371.b3lyp_6-31g(d).nwchem.inp (generated) 047141371.b3lyp_6-31g(d).log.xz 047141371.td-b3lyp_6-31g+(d).inp 047141371.td-b3lyp_6-31g+(d).log.xz

047141371.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141371.td-b3lyp_6-31+g(d).gjf (generated)

047141371.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141371.mol 047141371.PUBCHEM 047141371.mol (via Jmol)
047141390.b3lyp_6-31g(d).inp

047141390.b3lyp_6-31g(d).qchem.inp (generated)

047141390.b3lyp_6-31g(d).gjf (generated)

047141390.b3lyp_6-31g(d).firefly.inp (generated)

047141390.b3lyp_6-31g(d).smash.inp (generated)

047141390.b3lyp_6-31g(d).nwchem.inp (generated) 047141390.b3lyp_6-31g(d).log.xz 047141390.td-b3lyp_6-31g+(d).inp 047141390.td-b3lyp_6-31g+(d).log.xz

047141390.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141390.td-b3lyp_6-31+g(d).gjf (generated)

047141390.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141390.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141390.mol 047141390.PUBCHEM 047141390.mol (via Jmol)
047141409.b3lyp_6-31g(d).inp

047141409.b3lyp_6-31g(d).qchem.inp (generated)

047141409.b3lyp_6-31g(d).gjf (generated)

047141409.b3lyp_6-31g(d).firefly.inp (generated)

047141409.b3lyp_6-31g(d).smash.inp (generated)

047141409.b3lyp_6-31g(d).nwchem.inp (generated) 047141409.b3lyp_6-31g(d).log.xz 047141409.td-b3lyp_6-31g+(d).inp 047141409.td-b3lyp_6-31g+(d).log.xz

047141409.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141409.td-b3lyp_6-31+g(d).gjf (generated)

047141409.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141409.mol 047141409.PUBCHEM 047141409.mol (via Jmol)
047141410.b3lyp_6-31g(d).inp

047141410.b3lyp_6-31g(d).qchem.inp (generated)

047141410.b3lyp_6-31g(d).gjf (generated)

047141410.b3lyp_6-31g(d).firefly.inp (generated)

047141410.b3lyp_6-31g(d).smash.inp (generated)

047141410.b3lyp_6-31g(d).nwchem.inp (generated) 047141410.b3lyp_6-31g(d).log.xz 047141410.td-b3lyp_6-31g+(d).inp 047141410.td-b3lyp_6-31g+(d).log.xz

047141410.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141410.td-b3lyp_6-31+g(d).gjf (generated)

047141410.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141410.mol 047141410.PUBCHEM 047141410.mol (via Jmol)
047141413.b3lyp_6-31g(d).inp

047141413.b3lyp_6-31g(d).qchem.inp (generated)

047141413.b3lyp_6-31g(d).gjf (generated)

047141413.b3lyp_6-31g(d).firefly.inp (generated)

047141413.b3lyp_6-31g(d).smash.inp (generated)

047141413.b3lyp_6-31g(d).nwchem.inp (generated) 047141413.b3lyp_6-31g(d).log.xz 047141413.mol 047141413.PUBCHEM 047141413.mol (via Jmol)
047141480.b3lyp_6-31g(d).inp

047141480.b3lyp_6-31g(d).qchem.inp (generated)

047141480.b3lyp_6-31g(d).gjf (generated)

047141480.b3lyp_6-31g(d).firefly.inp (generated)

047141480.b3lyp_6-31g(d).smash.inp (generated)

047141480.b3lyp_6-31g(d).nwchem.inp (generated) 047141480.b3lyp_6-31g(d).log.xz 047141480.mol 047141480.PUBCHEM 047141480.mol (via Jmol)
047141483.b3lyp_6-31g(d).inp

047141483.b3lyp_6-31g(d).qchem.inp (generated)

047141483.b3lyp_6-31g(d).gjf (generated)

047141483.b3lyp_6-31g(d).firefly.inp (generated)

047141483.b3lyp_6-31g(d).smash.inp (generated)

047141483.b3lyp_6-31g(d).nwchem.inp (generated) 047141483.b3lyp_6-31g(d).log.xz 047141483.td-b3lyp_6-31g+(d).inp 047141483.td-b3lyp_6-31g+(d).log.xz

047141483.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141483.td-b3lyp_6-31+g(d).gjf (generated)

047141483.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141483.mol 047141483.PUBCHEM 047141483.mol (via Jmol)
047141485.b3lyp_6-31g(d).inp

047141485.b3lyp_6-31g(d).qchem.inp (generated)

047141485.b3lyp_6-31g(d).gjf (generated)

047141485.b3lyp_6-31g(d).firefly.inp (generated)

047141485.b3lyp_6-31g(d).smash.inp (generated)

047141485.b3lyp_6-31g(d).nwchem.inp (generated) 047141485.b3lyp_6-31g(d).log.xz 047141485.td-b3lyp_6-31g+(d).inp 047141485.td-b3lyp_6-31g+(d).log.xz

047141485.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141485.td-b3lyp_6-31+g(d).gjf (generated)

047141485.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141485.mol 047141485.PUBCHEM 047141485.mol (via Jmol)
047141512.b3lyp_6-31g(d).inp

047141512.b3lyp_6-31g(d).qchem.inp (generated)

047141512.b3lyp_6-31g(d).gjf (generated)

047141512.b3lyp_6-31g(d).firefly.inp (generated)

047141512.b3lyp_6-31g(d).smash.inp (generated)

047141512.b3lyp_6-31g(d).nwchem.inp (generated) 047141512.b3lyp_6-31g(d).log.xz 047141512.mol 047141512.PUBCHEM 047141512.mol (via Jmol)
047141513.b3lyp_6-31g(d).inp

047141513.b3lyp_6-31g(d).qchem.inp (generated)

047141513.b3lyp_6-31g(d).gjf (generated)

047141513.b3lyp_6-31g(d).firefly.inp (generated)

047141513.b3lyp_6-31g(d).smash.inp (generated)

047141513.b3lyp_6-31g(d).nwchem.inp (generated) 047141513.b3lyp_6-31g(d).log.xz 047141513.td-b3lyp_6-31g+(d).inp 047141513.td-b3lyp_6-31g+(d).log.xz

047141513.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141513.td-b3lyp_6-31+g(d).gjf (generated)

047141513.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141513.mol 047141513.PUBCHEM 047141513.mol (via Jmol)
047141514.b3lyp_6-31g(d).inp

047141514.b3lyp_6-31g(d).qchem.inp (generated)

047141514.b3lyp_6-31g(d).gjf (generated)

047141514.b3lyp_6-31g(d).firefly.inp (generated)

047141514.b3lyp_6-31g(d).smash.inp (generated)

047141514.b3lyp_6-31g(d).nwchem.inp (generated) 047141514.b3lyp_6-31g(d).log.xz 047141514.mol 047141514.PUBCHEM 047141514.mol (via Jmol)
047141532.b3lyp_6-31g(d).inp

047141532.b3lyp_6-31g(d).qchem.inp (generated)

047141532.b3lyp_6-31g(d).gjf (generated)

047141532.b3lyp_6-31g(d).firefly.inp (generated)

047141532.b3lyp_6-31g(d).smash.inp (generated)

047141532.b3lyp_6-31g(d).nwchem.inp (generated) 047141532.b3lyp_6-31g(d).log.xz 047141532.td-b3lyp_6-31g+(d).inp 047141532.td-b3lyp_6-31g+(d).log.xz

047141532.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141532.td-b3lyp_6-31+g(d).gjf (generated)

047141532.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141532.mol 047141532.PUBCHEM 047141532.mol (via Jmol)
047141586.b3lyp_6-31g(d).inp

047141586.b3lyp_6-31g(d).qchem.inp (generated)

047141586.b3lyp_6-31g(d).gjf (generated)

047141586.b3lyp_6-31g(d).firefly.inp (generated)

047141586.b3lyp_6-31g(d).smash.inp (generated)

047141586.b3lyp_6-31g(d).nwchem.inp (generated) 047141586.b3lyp_6-31g(d).log.xz 047141586.td-b3lyp_6-31g+(d).inp 047141586.td-b3lyp_6-31g+(d).log.xz

047141586.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141586.td-b3lyp_6-31+g(d).gjf (generated)

047141586.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141586.mol 047141586.PUBCHEM 047141586.mol (via Jmol)
047141610.b3lyp_6-31g(d).inp

047141610.b3lyp_6-31g(d).qchem.inp (generated)

047141610.b3lyp_6-31g(d).gjf (generated)

047141610.b3lyp_6-31g(d).firefly.inp (generated)

047141610.b3lyp_6-31g(d).smash.inp (generated)

047141610.b3lyp_6-31g(d).nwchem.inp (generated) 047141610.b3lyp_6-31g(d).log.xz 047141610.td-b3lyp_6-31g+(d).inp 047141610.td-b3lyp_6-31g+(d).log.xz

047141610.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141610.td-b3lyp_6-31+g(d).gjf (generated)

047141610.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141610.mol 047141610.PUBCHEM 047141610.mol (via Jmol)
047141659.b3lyp_6-31g(d).inp

047141659.b3lyp_6-31g(d).qchem.inp (generated)

047141659.b3lyp_6-31g(d).gjf (generated)

047141659.b3lyp_6-31g(d).firefly.inp (generated)

047141659.b3lyp_6-31g(d).smash.inp (generated)

047141659.b3lyp_6-31g(d).nwchem.inp (generated) 047141659.b3lyp_6-31g(d).log.xz 047141659.td-b3lyp_6-31g+(d).inp 047141659.td-b3lyp_6-31g+(d).log.xz

047141659.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141659.td-b3lyp_6-31+g(d).gjf (generated)

047141659.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141659.mol 047141659.PUBCHEM 047141659.mol (via Jmol)
047141757.b3lyp_6-31g(d).inp

047141757.b3lyp_6-31g(d).qchem.inp (generated)

047141757.b3lyp_6-31g(d).gjf (generated)

047141757.b3lyp_6-31g(d).firefly.inp (generated)

047141757.b3lyp_6-31g(d).smash.inp (generated)

047141757.b3lyp_6-31g(d).nwchem.inp (generated) 047141757.b3lyp_6-31g(d).log.xz 047141757.mol 047141757.PUBCHEM 047141757.mol (via Jmol)
047141828.b3lyp_6-31g(d).inp

047141828.b3lyp_6-31g(d).qchem.inp (generated)

047141828.b3lyp_6-31g(d).gjf (generated)

047141828.b3lyp_6-31g(d).firefly.inp (generated)

047141828.b3lyp_6-31g(d).smash.inp (generated)

047141828.b3lyp_6-31g(d).nwchem.inp (generated) 047141828.b3lyp_6-31g(d).log.xz 047141828.td-b3lyp_6-31g+(d).inp 047141828.td-b3lyp_6-31g+(d).log.xz

047141828.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141828.td-b3lyp_6-31+g(d).gjf (generated)

047141828.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141828.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141828.mol 047141828.PUBCHEM 047141828.mol (via Jmol)
047141984.b3lyp_6-31g(d).inp

047141984.b3lyp_6-31g(d).qchem.inp (generated)

047141984.b3lyp_6-31g(d).gjf (generated)

047141984.b3lyp_6-31g(d).firefly.inp (generated)

047141984.b3lyp_6-31g(d).smash.inp (generated)

047141984.b3lyp_6-31g(d).nwchem.inp (generated) 047141984.b3lyp_6-31g(d).log.xz 047141984.td-b3lyp_6-31g+(d).inp 047141984.td-b3lyp_6-31g+(d).log.xz

047141984.td-b3lyp_6-31+g(d).qchem.inp (generated)

047141984.td-b3lyp_6-31+g(d).gjf (generated)

047141984.td-b3lyp_6-31+g(d).firefly.inp (generated)

047141984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047141984.mol 047141984.PUBCHEM 047141984.mol (via Jmol)
047142268.b3lyp_6-31g(d).inp

047142268.b3lyp_6-31g(d).qchem.inp (generated)

047142268.b3lyp_6-31g(d).gjf (generated)

047142268.b3lyp_6-31g(d).firefly.inp (generated)

047142268.b3lyp_6-31g(d).smash.inp (generated)

047142268.b3lyp_6-31g(d).nwchem.inp (generated) 047142268.b3lyp_6-31g(d).log.xz 047142268.td-b3lyp_6-31g+(d).inp 047142268.td-b3lyp_6-31g+(d).log.xz

047142268.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142268.td-b3lyp_6-31+g(d).gjf (generated)

047142268.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142268.mol 047142268.PUBCHEM 047142268.mol (via Jmol)
047142270.b3lyp_6-31g(d).inp

047142270.b3lyp_6-31g(d).qchem.inp (generated)

047142270.b3lyp_6-31g(d).gjf (generated)

047142270.b3lyp_6-31g(d).firefly.inp (generated)

047142270.b3lyp_6-31g(d).smash.inp (generated)

047142270.b3lyp_6-31g(d).nwchem.inp (generated) 047142270.b3lyp_6-31g(d).log.xz 047142270.mol 047142270.PUBCHEM 047142270.mol (via Jmol)
047142302.b3lyp_6-31g(d).inp

047142302.b3lyp_6-31g(d).qchem.inp (generated)

047142302.b3lyp_6-31g(d).gjf (generated)

047142302.b3lyp_6-31g(d).firefly.inp (generated)

047142302.b3lyp_6-31g(d).smash.inp (generated)

047142302.b3lyp_6-31g(d).nwchem.inp (generated) 047142302.b3lyp_6-31g(d).log.xz 047142302.td-b3lyp_6-31g+(d).inp 047142302.td-b3lyp_6-31g+(d).log.xz

047142302.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142302.td-b3lyp_6-31+g(d).gjf (generated)

047142302.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142302.mol 047142302.PUBCHEM 047142302.mol (via Jmol)
047142306.b3lyp_6-31g(d).inp

047142306.b3lyp_6-31g(d).qchem.inp (generated)

047142306.b3lyp_6-31g(d).gjf (generated)

047142306.b3lyp_6-31g(d).firefly.inp (generated)

047142306.b3lyp_6-31g(d).smash.inp (generated)

047142306.b3lyp_6-31g(d).nwchem.inp (generated) 047142306.b3lyp_6-31g(d).log.xz 047142306.td-b3lyp_6-31g+(d).inp 047142306.td-b3lyp_6-31g+(d).log.xz

047142306.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142306.td-b3lyp_6-31+g(d).gjf (generated)

047142306.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142306.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142306.mol 047142306.PUBCHEM 047142306.mol (via Jmol)
047142314.b3lyp_6-31g(d).inp

047142314.b3lyp_6-31g(d).qchem.inp (generated)

047142314.b3lyp_6-31g(d).gjf (generated)

047142314.b3lyp_6-31g(d).firefly.inp (generated)

047142314.b3lyp_6-31g(d).smash.inp (generated)

047142314.b3lyp_6-31g(d).nwchem.inp (generated) 047142314.b3lyp_6-31g(d).log.xz 047142314.td-b3lyp_6-31g+(d).inp 047142314.td-b3lyp_6-31g+(d).log.xz

047142314.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142314.td-b3lyp_6-31+g(d).gjf (generated)

047142314.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142314.mol 047142314.PUBCHEM 047142314.mol (via Jmol)
047142396.b3lyp_6-31g(d).inp

047142396.b3lyp_6-31g(d).qchem.inp (generated)

047142396.b3lyp_6-31g(d).gjf (generated)

047142396.b3lyp_6-31g(d).firefly.inp (generated)

047142396.b3lyp_6-31g(d).smash.inp (generated)

047142396.b3lyp_6-31g(d).nwchem.inp (generated) 047142396.b3lyp_6-31g(d).log.xz 047142396.td-b3lyp_6-31g+(d).inp 047142396.td-b3lyp_6-31g+(d).log.xz

047142396.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142396.td-b3lyp_6-31+g(d).gjf (generated)

047142396.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142396.mol 047142396.PUBCHEM 047142396.mol (via Jmol)
047142398.b3lyp_6-31g(d).inp

047142398.b3lyp_6-31g(d).qchem.inp (generated)

047142398.b3lyp_6-31g(d).gjf (generated)

047142398.b3lyp_6-31g(d).firefly.inp (generated)

047142398.b3lyp_6-31g(d).smash.inp (generated)

047142398.b3lyp_6-31g(d).nwchem.inp (generated) 047142398.b3lyp_6-31g(d).log.xz 047142398.mol 047142398.PUBCHEM 047142398.mol (via Jmol)
047142448.b3lyp_6-31g(d).inp

047142448.b3lyp_6-31g(d).qchem.inp (generated)

047142448.b3lyp_6-31g(d).gjf (generated)

047142448.b3lyp_6-31g(d).firefly.inp (generated)

047142448.b3lyp_6-31g(d).smash.inp (generated)

047142448.b3lyp_6-31g(d).nwchem.inp (generated) 047142448.b3lyp_6-31g(d).log.xz 047142448.td-b3lyp_6-31g+(d).inp 047142448.td-b3lyp_6-31g+(d).log.xz

047142448.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142448.td-b3lyp_6-31+g(d).gjf (generated)

047142448.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142448.mol 047142448.PUBCHEM 047142448.mol (via Jmol)
047142487.b3lyp_6-31g(d).inp

047142487.b3lyp_6-31g(d).qchem.inp (generated)

047142487.b3lyp_6-31g(d).gjf (generated)

047142487.b3lyp_6-31g(d).firefly.inp (generated)

047142487.b3lyp_6-31g(d).smash.inp (generated)

047142487.b3lyp_6-31g(d).nwchem.inp (generated) 047142487.b3lyp_6-31g(d).log.xz 047142487.td-b3lyp_6-31g+(d).inp 047142487.td-b3lyp_6-31g+(d).log.xz

047142487.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142487.td-b3lyp_6-31+g(d).gjf (generated)

047142487.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142487.mol 047142487.PUBCHEM 047142487.mol (via Jmol)
047142496.b3lyp_6-31g(d).inp

047142496.b3lyp_6-31g(d).qchem.inp (generated)

047142496.b3lyp_6-31g(d).gjf (generated)

047142496.b3lyp_6-31g(d).firefly.inp (generated)

047142496.b3lyp_6-31g(d).smash.inp (generated)

047142496.b3lyp_6-31g(d).nwchem.inp (generated) 047142496.b3lyp_6-31g(d).log.xz 047142496.td-b3lyp_6-31g+(d).inp 047142496.td-b3lyp_6-31g+(d).log.xz

047142496.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142496.td-b3lyp_6-31+g(d).gjf (generated)

047142496.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142496.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142496.mol 047142496.PUBCHEM 047142496.mol (via Jmol)
047142513.b3lyp_6-31g(d).inp

047142513.b3lyp_6-31g(d).qchem.inp (generated)

047142513.b3lyp_6-31g(d).gjf (generated)

047142513.b3lyp_6-31g(d).firefly.inp (generated)

047142513.b3lyp_6-31g(d).smash.inp (generated)

047142513.b3lyp_6-31g(d).nwchem.inp (generated) 047142513.b3lyp_6-31g(d).log.xz 047142513.td-b3lyp_6-31g+(d).inp 047142513.td-b3lyp_6-31g+(d).log.xz

047142513.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142513.td-b3lyp_6-31+g(d).gjf (generated)

047142513.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142513.mol 047142513.PUBCHEM 047142513.mol (via Jmol)
047142528.b3lyp_6-31g(d).inp

047142528.b3lyp_6-31g(d).qchem.inp (generated)

047142528.b3lyp_6-31g(d).gjf (generated)

047142528.b3lyp_6-31g(d).firefly.inp (generated)

047142528.b3lyp_6-31g(d).smash.inp (generated)

047142528.b3lyp_6-31g(d).nwchem.inp (generated) 047142528.b3lyp_6-31g(d).log.xz 047142528.td-b3lyp_6-31g+(d).inp 047142528.td-b3lyp_6-31g+(d).log.xz

047142528.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142528.td-b3lyp_6-31+g(d).gjf (generated)

047142528.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142528.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142528.mol 047142528.PUBCHEM 047142528.mol (via Jmol)
047142725.b3lyp_6-31g(d).inp

047142725.b3lyp_6-31g(d).qchem.inp (generated)

047142725.b3lyp_6-31g(d).gjf (generated)

047142725.b3lyp_6-31g(d).firefly.inp (generated)

047142725.b3lyp_6-31g(d).smash.inp (generated)

047142725.b3lyp_6-31g(d).nwchem.inp (generated) 047142725.b3lyp_6-31g(d).log.xz 047142725.td-b3lyp_6-31g+(d).inp 047142725.td-b3lyp_6-31g+(d).log.xz

047142725.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142725.td-b3lyp_6-31+g(d).gjf (generated)

047142725.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142725.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142725.mol 047142725.PUBCHEM 047142725.mol (via Jmol)
047142801.b3lyp_6-31g(d).inp

047142801.b3lyp_6-31g(d).qchem.inp (generated)

047142801.b3lyp_6-31g(d).gjf (generated)

047142801.b3lyp_6-31g(d).firefly.inp (generated)

047142801.b3lyp_6-31g(d).smash.inp (generated)

047142801.b3lyp_6-31g(d).nwchem.inp (generated) 047142801.b3lyp_6-31g(d).log.xz 047142801.td-b3lyp_6-31g+(d).inp 047142801.td-b3lyp_6-31g+(d).log.xz

047142801.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142801.td-b3lyp_6-31+g(d).gjf (generated)

047142801.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142801.mol 047142801.PUBCHEM 047142801.mol (via Jmol)
047142802.b3lyp_6-31g(d).inp

047142802.b3lyp_6-31g(d).qchem.inp (generated)

047142802.b3lyp_6-31g(d).gjf (generated)

047142802.b3lyp_6-31g(d).firefly.inp (generated)

047142802.b3lyp_6-31g(d).smash.inp (generated)

047142802.b3lyp_6-31g(d).nwchem.inp (generated) 047142802.b3lyp_6-31g(d).log.xz 047142802.td-b3lyp_6-31g+(d).inp 047142802.td-b3lyp_6-31g+(d).log.xz

047142802.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142802.td-b3lyp_6-31+g(d).gjf (generated)

047142802.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142802.mol 047142802.PUBCHEM 047142802.mol (via Jmol)
047142813.b3lyp_6-31g(d).inp

047142813.b3lyp_6-31g(d).qchem.inp (generated)

047142813.b3lyp_6-31g(d).gjf (generated)

047142813.b3lyp_6-31g(d).firefly.inp (generated)

047142813.b3lyp_6-31g(d).smash.inp (generated)

047142813.b3lyp_6-31g(d).nwchem.inp (generated) 047142813.b3lyp_6-31g(d).log.xz 047142813.td-b3lyp_6-31g+(d).inp 047142813.td-b3lyp_6-31g+(d).log.xz

047142813.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142813.td-b3lyp_6-31+g(d).gjf (generated)

047142813.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142813.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142813.mol 047142813.PUBCHEM 047142813.mol (via Jmol)
047142815.b3lyp_6-31g(d).inp

047142815.b3lyp_6-31g(d).qchem.inp (generated)

047142815.b3lyp_6-31g(d).gjf (generated)

047142815.b3lyp_6-31g(d).firefly.inp (generated)

047142815.b3lyp_6-31g(d).smash.inp (generated)

047142815.b3lyp_6-31g(d).nwchem.inp (generated) 047142815.b3lyp_6-31g(d).log.xz 047142815.td-b3lyp_6-31g+(d).inp 047142815.td-b3lyp_6-31g+(d).log.xz

047142815.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142815.td-b3lyp_6-31+g(d).gjf (generated)

047142815.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142815.mol 047142815.PUBCHEM 047142815.mol (via Jmol)
047142816.b3lyp_6-31g(d).inp

047142816.b3lyp_6-31g(d).qchem.inp (generated)

047142816.b3lyp_6-31g(d).gjf (generated)

047142816.b3lyp_6-31g(d).firefly.inp (generated)

047142816.b3lyp_6-31g(d).smash.inp (generated)

047142816.b3lyp_6-31g(d).nwchem.inp (generated) 047142816.b3lyp_6-31g(d).log.xz 047142816.td-b3lyp_6-31g+(d).inp 047142816.td-b3lyp_6-31g+(d).log.xz

047142816.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142816.td-b3lyp_6-31+g(d).gjf (generated)

047142816.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142816.mol 047142816.PUBCHEM 047142816.mol (via Jmol)
047142838.b3lyp_6-31g(d).inp

047142838.b3lyp_6-31g(d).qchem.inp (generated)

047142838.b3lyp_6-31g(d).gjf (generated)

047142838.b3lyp_6-31g(d).firefly.inp (generated)

047142838.b3lyp_6-31g(d).smash.inp (generated)

047142838.b3lyp_6-31g(d).nwchem.inp (generated) 047142838.b3lyp_6-31g(d).log.xz 047142838.td-b3lyp_6-31g+(d).inp 047142838.td-b3lyp_6-31g+(d).log.xz

047142838.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142838.td-b3lyp_6-31+g(d).gjf (generated)

047142838.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142838.mol 047142838.PUBCHEM 047142838.mol (via Jmol)
047142845.b3lyp_6-31g(d).inp

047142845.b3lyp_6-31g(d).qchem.inp (generated)

047142845.b3lyp_6-31g(d).gjf (generated)

047142845.b3lyp_6-31g(d).firefly.inp (generated)

047142845.b3lyp_6-31g(d).smash.inp (generated)

047142845.b3lyp_6-31g(d).nwchem.inp (generated) 047142845.b3lyp_6-31g(d).log.xz 047142845.td-b3lyp_6-31g+(d).inp 047142845.td-b3lyp_6-31g+(d).log.xz

047142845.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142845.td-b3lyp_6-31+g(d).gjf (generated)

047142845.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142845.mol 047142845.PUBCHEM 047142845.mol (via Jmol)
047142862.b3lyp_6-31g(d).inp

047142862.b3lyp_6-31g(d).qchem.inp (generated)

047142862.b3lyp_6-31g(d).gjf (generated)

047142862.b3lyp_6-31g(d).firefly.inp (generated)

047142862.b3lyp_6-31g(d).smash.inp (generated)

047142862.b3lyp_6-31g(d).nwchem.inp (generated) 047142862.b3lyp_6-31g(d).log.xz 047142862.td-b3lyp_6-31g+(d).inp 047142862.td-b3lyp_6-31g+(d).log.xz

047142862.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142862.td-b3lyp_6-31+g(d).gjf (generated)

047142862.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142862.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142862.mol 047142862.PUBCHEM 047142862.mol (via Jmol)
047142890.b3lyp_6-31g(d).inp

047142890.b3lyp_6-31g(d).qchem.inp (generated)

047142890.b3lyp_6-31g(d).gjf (generated)

047142890.b3lyp_6-31g(d).firefly.inp (generated)

047142890.b3lyp_6-31g(d).smash.inp (generated)

047142890.b3lyp_6-31g(d).nwchem.inp (generated) 047142890.b3lyp_6-31g(d).log.xz 047142890.mol 047142890.PUBCHEM 047142890.mol (via Jmol)
047142893.b3lyp_6-31g(d).inp

047142893.b3lyp_6-31g(d).qchem.inp (generated)

047142893.b3lyp_6-31g(d).gjf (generated)

047142893.b3lyp_6-31g(d).firefly.inp (generated)

047142893.b3lyp_6-31g(d).smash.inp (generated)

047142893.b3lyp_6-31g(d).nwchem.inp (generated) 047142893.b3lyp_6-31g(d).log.xz 047142893.td-b3lyp_6-31g+(d).inp 047142893.td-b3lyp_6-31g+(d).log.xz

047142893.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142893.td-b3lyp_6-31+g(d).gjf (generated)

047142893.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142893.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142893.mol 047142893.PUBCHEM 047142893.mol (via Jmol)
047142894.b3lyp_6-31g(d).inp

047142894.b3lyp_6-31g(d).qchem.inp (generated)

047142894.b3lyp_6-31g(d).gjf (generated)

047142894.b3lyp_6-31g(d).firefly.inp (generated)

047142894.b3lyp_6-31g(d).smash.inp (generated)

047142894.b3lyp_6-31g(d).nwchem.inp (generated) 047142894.b3lyp_6-31g(d).log.xz 047142894.td-b3lyp_6-31g+(d).inp 047142894.td-b3lyp_6-31g+(d).log.xz

047142894.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142894.td-b3lyp_6-31+g(d).gjf (generated)

047142894.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142894.mol 047142894.PUBCHEM 047142894.mol (via Jmol)
047142939.b3lyp_6-31g(d).inp

047142939.b3lyp_6-31g(d).qchem.inp (generated)

047142939.b3lyp_6-31g(d).gjf (generated)

047142939.b3lyp_6-31g(d).firefly.inp (generated)

047142939.b3lyp_6-31g(d).smash.inp (generated)

047142939.b3lyp_6-31g(d).nwchem.inp (generated) 047142939.b3lyp_6-31g(d).log.xz 047142939.mol 047142939.PUBCHEM 047142939.mol (via Jmol)
047142980.b3lyp_6-31g(d).inp

047142980.b3lyp_6-31g(d).qchem.inp (generated)

047142980.b3lyp_6-31g(d).gjf (generated)

047142980.b3lyp_6-31g(d).firefly.inp (generated)

047142980.b3lyp_6-31g(d).smash.inp (generated)

047142980.b3lyp_6-31g(d).nwchem.inp (generated) 047142980.b3lyp_6-31g(d).log.xz 047142980.td-b3lyp_6-31g+(d).inp 047142980.td-b3lyp_6-31g+(d).log.xz

047142980.td-b3lyp_6-31+g(d).qchem.inp (generated)

047142980.td-b3lyp_6-31+g(d).gjf (generated)

047142980.td-b3lyp_6-31+g(d).firefly.inp (generated)

047142980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047142980.mol 047142980.PUBCHEM 047142980.mol (via Jmol)
047143025.b3lyp_6-31g(d).inp

047143025.b3lyp_6-31g(d).qchem.inp (generated)

047143025.b3lyp_6-31g(d).gjf (generated)

047143025.b3lyp_6-31g(d).firefly.inp (generated)

047143025.b3lyp_6-31g(d).smash.inp (generated)

047143025.b3lyp_6-31g(d).nwchem.inp (generated) 047143025.b3lyp_6-31g(d).log.xz 047143025.td-b3lyp_6-31g+(d).inp 047143025.td-b3lyp_6-31g+(d).log.xz

047143025.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143025.td-b3lyp_6-31+g(d).gjf (generated)

047143025.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143025.mol 047143025.PUBCHEM 047143025.mol (via Jmol)
047143097.b3lyp_6-31g(d).inp

047143097.b3lyp_6-31g(d).qchem.inp (generated)

047143097.b3lyp_6-31g(d).gjf (generated)

047143097.b3lyp_6-31g(d).firefly.inp (generated)

047143097.b3lyp_6-31g(d).smash.inp (generated)

047143097.b3lyp_6-31g(d).nwchem.inp (generated) 047143097.b3lyp_6-31g(d).log.xz 047143097.td-b3lyp_6-31g+(d).inp 047143097.td-b3lyp_6-31g+(d).log.xz

047143097.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143097.td-b3lyp_6-31+g(d).gjf (generated)

047143097.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143097.mol 047143097.PUBCHEM 047143097.mol (via Jmol)
047143103.b3lyp_6-31g(d).inp

047143103.b3lyp_6-31g(d).qchem.inp (generated)

047143103.b3lyp_6-31g(d).gjf (generated)

047143103.b3lyp_6-31g(d).firefly.inp (generated)

047143103.b3lyp_6-31g(d).smash.inp (generated)

047143103.b3lyp_6-31g(d).nwchem.inp (generated) 047143103.b3lyp_6-31g(d).log.xz 047143103.mol 047143103.PUBCHEM 047143103.mol (via Jmol)
047143104.b3lyp_6-31g(d).inp

047143104.b3lyp_6-31g(d).qchem.inp (generated)

047143104.b3lyp_6-31g(d).gjf (generated)

047143104.b3lyp_6-31g(d).firefly.inp (generated)

047143104.b3lyp_6-31g(d).smash.inp (generated)

047143104.b3lyp_6-31g(d).nwchem.inp (generated) 047143104.b3lyp_6-31g(d).log.xz 047143104.mol 047143104.PUBCHEM 047143104.mol (via Jmol)
047143112.b3lyp_6-31g(d).inp

047143112.b3lyp_6-31g(d).qchem.inp (generated)

047143112.b3lyp_6-31g(d).gjf (generated)

047143112.b3lyp_6-31g(d).firefly.inp (generated)

047143112.b3lyp_6-31g(d).smash.inp (generated)

047143112.b3lyp_6-31g(d).nwchem.inp (generated) 047143112.b3lyp_6-31g(d).log.xz 047143112.mol 047143112.PUBCHEM 047143112.mol (via Jmol)
047143126.b3lyp_6-31g(d).inp

047143126.b3lyp_6-31g(d).qchem.inp (generated)

047143126.b3lyp_6-31g(d).gjf (generated)

047143126.b3lyp_6-31g(d).firefly.inp (generated)

047143126.b3lyp_6-31g(d).smash.inp (generated)

047143126.b3lyp_6-31g(d).nwchem.inp (generated) 047143126.b3lyp_6-31g(d).log.xz 047143126.mol 047143126.PUBCHEM 047143126.mol (via Jmol)
047143128.b3lyp_6-31g(d).inp

047143128.b3lyp_6-31g(d).qchem.inp (generated)

047143128.b3lyp_6-31g(d).gjf (generated)

047143128.b3lyp_6-31g(d).firefly.inp (generated)

047143128.b3lyp_6-31g(d).smash.inp (generated)

047143128.b3lyp_6-31g(d).nwchem.inp (generated) 047143128.b3lyp_6-31g(d).log.xz 047143128.mol 047143128.PUBCHEM 047143128.mol (via Jmol)
047143158.b3lyp_6-31g(d).inp

047143158.b3lyp_6-31g(d).qchem.inp (generated)

047143158.b3lyp_6-31g(d).gjf (generated)

047143158.b3lyp_6-31g(d).firefly.inp (generated)

047143158.b3lyp_6-31g(d).smash.inp (generated)

047143158.b3lyp_6-31g(d).nwchem.inp (generated) 047143158.b3lyp_6-31g(d).log.xz 047143158.mol 047143158.PUBCHEM 047143158.mol (via Jmol)
047143187.b3lyp_6-31g(d).inp

047143187.b3lyp_6-31g(d).qchem.inp (generated)

047143187.b3lyp_6-31g(d).gjf (generated)

047143187.b3lyp_6-31g(d).firefly.inp (generated)

047143187.b3lyp_6-31g(d).smash.inp (generated)

047143187.b3lyp_6-31g(d).nwchem.inp (generated) 047143187.b3lyp_6-31g(d).log.xz 047143187.td-b3lyp_6-31g+(d).inp 047143187.td-b3lyp_6-31g+(d).log.xz

047143187.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143187.td-b3lyp_6-31+g(d).gjf (generated)

047143187.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143187.mol 047143187.PUBCHEM 047143187.mol (via Jmol)
047143221.b3lyp_6-31g(d).inp

047143221.b3lyp_6-31g(d).qchem.inp (generated)

047143221.b3lyp_6-31g(d).gjf (generated)

047143221.b3lyp_6-31g(d).firefly.inp (generated)

047143221.b3lyp_6-31g(d).smash.inp (generated)

047143221.b3lyp_6-31g(d).nwchem.inp (generated) 047143221.b3lyp_6-31g(d).log.xz 047143221.mol 047143221.PUBCHEM 047143221.mol (via Jmol)
047143235.b3lyp_6-31g(d).inp

047143235.b3lyp_6-31g(d).qchem.inp (generated)

047143235.b3lyp_6-31g(d).gjf (generated)

047143235.b3lyp_6-31g(d).firefly.inp (generated)

047143235.b3lyp_6-31g(d).smash.inp (generated)

047143235.b3lyp_6-31g(d).nwchem.inp (generated) 047143235.b3lyp_6-31g(d).log.xz 047143235.td-b3lyp_6-31g+(d).inp 047143235.td-b3lyp_6-31g+(d).log.xz

047143235.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143235.td-b3lyp_6-31+g(d).gjf (generated)

047143235.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143235.mol 047143235.PUBCHEM 047143235.mol (via Jmol)
047143239.b3lyp_6-31g(d).inp

047143239.b3lyp_6-31g(d).qchem.inp (generated)

047143239.b3lyp_6-31g(d).gjf (generated)

047143239.b3lyp_6-31g(d).firefly.inp (generated)

047143239.b3lyp_6-31g(d).smash.inp (generated)

047143239.b3lyp_6-31g(d).nwchem.inp (generated) 047143239.b3lyp_6-31g(d).log.xz 047143239.td-b3lyp_6-31g+(d).inp 047143239.td-b3lyp_6-31g+(d).log.xz

047143239.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143239.td-b3lyp_6-31+g(d).gjf (generated)

047143239.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143239.mol 047143239.PUBCHEM 047143239.mol (via Jmol)
047143242.b3lyp_6-31g(d).inp

047143242.b3lyp_6-31g(d).qchem.inp (generated)

047143242.b3lyp_6-31g(d).gjf (generated)

047143242.b3lyp_6-31g(d).firefly.inp (generated)

047143242.b3lyp_6-31g(d).smash.inp (generated)

047143242.b3lyp_6-31g(d).nwchem.inp (generated) 047143242.b3lyp_6-31g(d).log.xz 047143242.mol 047143242.PUBCHEM 047143242.mol (via Jmol)
047143246.b3lyp_6-31g(d).inp

047143246.b3lyp_6-31g(d).qchem.inp (generated)

047143246.b3lyp_6-31g(d).gjf (generated)

047143246.b3lyp_6-31g(d).firefly.inp (generated)

047143246.b3lyp_6-31g(d).smash.inp (generated)

047143246.b3lyp_6-31g(d).nwchem.inp (generated) 047143246.b3lyp_6-31g(d).log.xz 047143246.td-b3lyp_6-31g+(d).inp 047143246.td-b3lyp_6-31g+(d).log.xz

047143246.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143246.td-b3lyp_6-31+g(d).gjf (generated)

047143246.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143246.mol 047143246.PUBCHEM 047143246.mol (via Jmol)
047143247.b3lyp_6-31g(d).inp

047143247.b3lyp_6-31g(d).qchem.inp (generated)

047143247.b3lyp_6-31g(d).gjf (generated)

047143247.b3lyp_6-31g(d).firefly.inp (generated)

047143247.b3lyp_6-31g(d).smash.inp (generated)

047143247.b3lyp_6-31g(d).nwchem.inp (generated) 047143247.b3lyp_6-31g(d).log.xz 047143247.mol 047143247.PUBCHEM 047143247.mol (via Jmol)
047143253.b3lyp_6-31g(d).inp

047143253.b3lyp_6-31g(d).qchem.inp (generated)

047143253.b3lyp_6-31g(d).gjf (generated)

047143253.b3lyp_6-31g(d).firefly.inp (generated)

047143253.b3lyp_6-31g(d).smash.inp (generated)

047143253.b3lyp_6-31g(d).nwchem.inp (generated) 047143253.b3lyp_6-31g(d).log.xz 047143253.td-b3lyp_6-31g+(d).inp 047143253.td-b3lyp_6-31g+(d).log.xz

047143253.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143253.td-b3lyp_6-31+g(d).gjf (generated)

047143253.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143253.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143253.mol 047143253.PUBCHEM 047143253.mol (via Jmol)
047143255.b3lyp_6-31g(d).inp

047143255.b3lyp_6-31g(d).qchem.inp (generated)

047143255.b3lyp_6-31g(d).gjf (generated)

047143255.b3lyp_6-31g(d).firefly.inp (generated)

047143255.b3lyp_6-31g(d).smash.inp (generated)

047143255.b3lyp_6-31g(d).nwchem.inp (generated) 047143255.b3lyp_6-31g(d).log.xz 047143255.td-b3lyp_6-31g+(d).inp 047143255.td-b3lyp_6-31g+(d).log.xz

047143255.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143255.td-b3lyp_6-31+g(d).gjf (generated)

047143255.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143255.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143255.mol 047143255.PUBCHEM 047143255.mol (via Jmol)
047143274.b3lyp_6-31g(d).inp

047143274.b3lyp_6-31g(d).qchem.inp (generated)

047143274.b3lyp_6-31g(d).gjf (generated)

047143274.b3lyp_6-31g(d).firefly.inp (generated)

047143274.b3lyp_6-31g(d).smash.inp (generated)

047143274.b3lyp_6-31g(d).nwchem.inp (generated) 047143274.b3lyp_6-31g(d).log.xz 047143274.td-b3lyp_6-31g+(d).inp 047143274.td-b3lyp_6-31g+(d).log.xz

047143274.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143274.td-b3lyp_6-31+g(d).gjf (generated)

047143274.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143274.mol 047143274.PUBCHEM 047143274.mol (via Jmol)
047143298.b3lyp_6-31g(d).inp

047143298.b3lyp_6-31g(d).qchem.inp (generated)

047143298.b3lyp_6-31g(d).gjf (generated)

047143298.b3lyp_6-31g(d).firefly.inp (generated)

047143298.b3lyp_6-31g(d).smash.inp (generated)

047143298.b3lyp_6-31g(d).nwchem.inp (generated) 047143298.b3lyp_6-31g(d).log.xz 047143298.mol 047143298.PUBCHEM 047143298.mol (via Jmol)
047143299.b3lyp_6-31g(d).inp

047143299.b3lyp_6-31g(d).qchem.inp (generated)

047143299.b3lyp_6-31g(d).gjf (generated)

047143299.b3lyp_6-31g(d).firefly.inp (generated)

047143299.b3lyp_6-31g(d).smash.inp (generated)

047143299.b3lyp_6-31g(d).nwchem.inp (generated) 047143299.b3lyp_6-31g(d).log.xz 047143299.td-b3lyp_6-31g+(d).inp 047143299.td-b3lyp_6-31g+(d).log.xz

047143299.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143299.td-b3lyp_6-31+g(d).gjf (generated)

047143299.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143299.mol 047143299.PUBCHEM 047143299.mol (via Jmol)
047143300.b3lyp_6-31g(d).inp

047143300.b3lyp_6-31g(d).qchem.inp (generated)

047143300.b3lyp_6-31g(d).gjf (generated)

047143300.b3lyp_6-31g(d).firefly.inp (generated)

047143300.b3lyp_6-31g(d).smash.inp (generated)

047143300.b3lyp_6-31g(d).nwchem.inp (generated) 047143300.b3lyp_6-31g(d).log.xz 047143300.mol 047143300.PUBCHEM 047143300.mol (via Jmol)
047143301.b3lyp_6-31g(d).inp

047143301.b3lyp_6-31g(d).qchem.inp (generated)

047143301.b3lyp_6-31g(d).gjf (generated)

047143301.b3lyp_6-31g(d).firefly.inp (generated)

047143301.b3lyp_6-31g(d).smash.inp (generated)

047143301.b3lyp_6-31g(d).nwchem.inp (generated) 047143301.b3lyp_6-31g(d).log.xz 047143301.td-b3lyp_6-31g+(d).inp 047143301.td-b3lyp_6-31g+(d).log.xz

047143301.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143301.td-b3lyp_6-31+g(d).gjf (generated)

047143301.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143301.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143301.mol 047143301.PUBCHEM 047143301.mol (via Jmol)
047143303.b3lyp_6-31g(d).inp

047143303.b3lyp_6-31g(d).qchem.inp (generated)

047143303.b3lyp_6-31g(d).gjf (generated)

047143303.b3lyp_6-31g(d).firefly.inp (generated)

047143303.b3lyp_6-31g(d).smash.inp (generated)

047143303.b3lyp_6-31g(d).nwchem.inp (generated) 047143303.b3lyp_6-31g(d).log.xz 047143303.td-b3lyp_6-31g+(d).inp 047143303.td-b3lyp_6-31g+(d).log.xz

047143303.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143303.td-b3lyp_6-31+g(d).gjf (generated)

047143303.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143303.mol 047143303.PUBCHEM 047143303.mol (via Jmol)
047143389.b3lyp_6-31g(d).inp

047143389.b3lyp_6-31g(d).qchem.inp (generated)

047143389.b3lyp_6-31g(d).gjf (generated)

047143389.b3lyp_6-31g(d).firefly.inp (generated)

047143389.b3lyp_6-31g(d).smash.inp (generated)

047143389.b3lyp_6-31g(d).nwchem.inp (generated) 047143389.b3lyp_6-31g(d).log.xz 047143389.td-b3lyp_6-31g+(d).inp 047143389.td-b3lyp_6-31g+(d).log.xz

047143389.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143389.td-b3lyp_6-31+g(d).gjf (generated)

047143389.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143389.mol 047143389.PUBCHEM 047143389.mol (via Jmol)
047143408.b3lyp_6-31g(d).inp

047143408.b3lyp_6-31g(d).qchem.inp (generated)

047143408.b3lyp_6-31g(d).gjf (generated)

047143408.b3lyp_6-31g(d).firefly.inp (generated)

047143408.b3lyp_6-31g(d).smash.inp (generated)

047143408.b3lyp_6-31g(d).nwchem.inp (generated) 047143408.b3lyp_6-31g(d).log.xz 047143408.mol 047143408.PUBCHEM 047143408.mol (via Jmol)
047143513.b3lyp_6-31g(d).inp

047143513.b3lyp_6-31g(d).qchem.inp (generated)

047143513.b3lyp_6-31g(d).gjf (generated)

047143513.b3lyp_6-31g(d).firefly.inp (generated)

047143513.b3lyp_6-31g(d).smash.inp (generated)

047143513.b3lyp_6-31g(d).nwchem.inp (generated) 047143513.b3lyp_6-31g(d).log.xz 047143513.td-b3lyp_6-31g+(d).inp 047143513.td-b3lyp_6-31g+(d).log.xz

047143513.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143513.td-b3lyp_6-31+g(d).gjf (generated)

047143513.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143513.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143513.mol 047143513.PUBCHEM 047143513.mol (via Jmol)
047143527.b3lyp_6-31g(d).inp

047143527.b3lyp_6-31g(d).qchem.inp (generated)

047143527.b3lyp_6-31g(d).gjf (generated)

047143527.b3lyp_6-31g(d).firefly.inp (generated)

047143527.b3lyp_6-31g(d).smash.inp (generated)

047143527.b3lyp_6-31g(d).nwchem.inp (generated) 047143527.b3lyp_6-31g(d).log.xz 047143527.td-b3lyp_6-31g+(d).inp 047143527.td-b3lyp_6-31g+(d).log.xz

047143527.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143527.td-b3lyp_6-31+g(d).gjf (generated)

047143527.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143527.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143527.mol 047143527.PUBCHEM 047143527.mol (via Jmol)
047143568.b3lyp_6-31g(d).inp

047143568.b3lyp_6-31g(d).qchem.inp (generated)

047143568.b3lyp_6-31g(d).gjf (generated)

047143568.b3lyp_6-31g(d).firefly.inp (generated)

047143568.b3lyp_6-31g(d).smash.inp (generated)

047143568.b3lyp_6-31g(d).nwchem.inp (generated) 047143568.b3lyp_6-31g(d).log.xz 047143568.td-b3lyp_6-31g+(d).inp 047143568.td-b3lyp_6-31g+(d).log.xz

047143568.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143568.td-b3lyp_6-31+g(d).gjf (generated)

047143568.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143568.mol 047143568.PUBCHEM 047143568.mol (via Jmol)
047143575.b3lyp_6-31g(d).inp

047143575.b3lyp_6-31g(d).qchem.inp (generated)

047143575.b3lyp_6-31g(d).gjf (generated)

047143575.b3lyp_6-31g(d).firefly.inp (generated)

047143575.b3lyp_6-31g(d).smash.inp (generated)

047143575.b3lyp_6-31g(d).nwchem.inp (generated) 047143575.b3lyp_6-31g(d).log.xz 047143575.td-b3lyp_6-31g+(d).inp 047143575.td-b3lyp_6-31g+(d).log.xz

047143575.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143575.td-b3lyp_6-31+g(d).gjf (generated)

047143575.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143575.mol 047143575.PUBCHEM 047143575.mol (via Jmol)
047143576.b3lyp_6-31g(d).inp

047143576.b3lyp_6-31g(d).qchem.inp (generated)

047143576.b3lyp_6-31g(d).gjf (generated)

047143576.b3lyp_6-31g(d).firefly.inp (generated)

047143576.b3lyp_6-31g(d).smash.inp (generated)

047143576.b3lyp_6-31g(d).nwchem.inp (generated) 047143576.b3lyp_6-31g(d).log.xz 047143576.td-b3lyp_6-31g+(d).inp 047143576.td-b3lyp_6-31g+(d).log.xz

047143576.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143576.td-b3lyp_6-31+g(d).gjf (generated)

047143576.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143576.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143576.mol 047143576.PUBCHEM 047143576.mol (via Jmol)
047143578.b3lyp_6-31g(d).inp

047143578.b3lyp_6-31g(d).qchem.inp (generated)

047143578.b3lyp_6-31g(d).gjf (generated)

047143578.b3lyp_6-31g(d).firefly.inp (generated)

047143578.b3lyp_6-31g(d).smash.inp (generated)

047143578.b3lyp_6-31g(d).nwchem.inp (generated) 047143578.b3lyp_6-31g(d).log.xz 047143578.td-b3lyp_6-31g+(d).inp 047143578.td-b3lyp_6-31g+(d).log.xz

047143578.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143578.td-b3lyp_6-31+g(d).gjf (generated)

047143578.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143578.mol 047143578.PUBCHEM 047143578.mol (via Jmol)
047143584.b3lyp_6-31g(d).inp

047143584.b3lyp_6-31g(d).qchem.inp (generated)

047143584.b3lyp_6-31g(d).gjf (generated)

047143584.b3lyp_6-31g(d).firefly.inp (generated)

047143584.b3lyp_6-31g(d).smash.inp (generated)

047143584.b3lyp_6-31g(d).nwchem.inp (generated) 047143584.b3lyp_6-31g(d).log.xz 047143584.td-b3lyp_6-31g+(d).inp 047143584.td-b3lyp_6-31g+(d).log.xz

047143584.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143584.td-b3lyp_6-31+g(d).gjf (generated)

047143584.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143584.mol 047143584.PUBCHEM 047143584.mol (via Jmol)
047143609.b3lyp_6-31g(d).inp

047143609.b3lyp_6-31g(d).qchem.inp (generated)

047143609.b3lyp_6-31g(d).gjf (generated)

047143609.b3lyp_6-31g(d).firefly.inp (generated)

047143609.b3lyp_6-31g(d).smash.inp (generated)

047143609.b3lyp_6-31g(d).nwchem.inp (generated) 047143609.b3lyp_6-31g(d).log.xz 047143609.td-b3lyp_6-31g+(d).inp 047143609.td-b3lyp_6-31g+(d).log.xz

047143609.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143609.td-b3lyp_6-31+g(d).gjf (generated)

047143609.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143609.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143609.mol 047143609.PUBCHEM 047143609.mol (via Jmol)
047143728.b3lyp_6-31g(d).inp

047143728.b3lyp_6-31g(d).qchem.inp (generated)

047143728.b3lyp_6-31g(d).gjf (generated)

047143728.b3lyp_6-31g(d).firefly.inp (generated)

047143728.b3lyp_6-31g(d).smash.inp (generated)

047143728.b3lyp_6-31g(d).nwchem.inp (generated) 047143728.b3lyp_6-31g(d).log.xz 047143728.td-b3lyp_6-31g+(d).inp 047143728.td-b3lyp_6-31g+(d).log.xz

047143728.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143728.td-b3lyp_6-31+g(d).gjf (generated)

047143728.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143728.mol 047143728.PUBCHEM 047143728.mol (via Jmol)
047143729.b3lyp_6-31g(d).inp

047143729.b3lyp_6-31g(d).qchem.inp (generated)

047143729.b3lyp_6-31g(d).gjf (generated)

047143729.b3lyp_6-31g(d).firefly.inp (generated)

047143729.b3lyp_6-31g(d).smash.inp (generated)

047143729.b3lyp_6-31g(d).nwchem.inp (generated) 047143729.b3lyp_6-31g(d).log.xz 047143729.td-b3lyp_6-31g+(d).inp 047143729.td-b3lyp_6-31g+(d).log.xz

047143729.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143729.td-b3lyp_6-31+g(d).gjf (generated)

047143729.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143729.mol 047143729.PUBCHEM 047143729.mol (via Jmol)
047143732.b3lyp_6-31g(d).inp

047143732.b3lyp_6-31g(d).qchem.inp (generated)

047143732.b3lyp_6-31g(d).gjf (generated)

047143732.b3lyp_6-31g(d).firefly.inp (generated)

047143732.b3lyp_6-31g(d).smash.inp (generated)

047143732.b3lyp_6-31g(d).nwchem.inp (generated) 047143732.b3lyp_6-31g(d).log.xz 047143732.td-b3lyp_6-31g+(d).inp 047143732.td-b3lyp_6-31g+(d).log.xz

047143732.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143732.td-b3lyp_6-31+g(d).gjf (generated)

047143732.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143732.mol 047143732.PUBCHEM 047143732.mol (via Jmol)
047143733.b3lyp_6-31g(d).inp

047143733.b3lyp_6-31g(d).qchem.inp (generated)

047143733.b3lyp_6-31g(d).gjf (generated)

047143733.b3lyp_6-31g(d).firefly.inp (generated)

047143733.b3lyp_6-31g(d).smash.inp (generated)

047143733.b3lyp_6-31g(d).nwchem.inp (generated) 047143733.b3lyp_6-31g(d).log.xz 047143733.mol 047143733.PUBCHEM 047143733.mol (via Jmol)
047143734.b3lyp_6-31g(d).inp

047143734.b3lyp_6-31g(d).qchem.inp (generated)

047143734.b3lyp_6-31g(d).gjf (generated)

047143734.b3lyp_6-31g(d).firefly.inp (generated)

047143734.b3lyp_6-31g(d).smash.inp (generated)

047143734.b3lyp_6-31g(d).nwchem.inp (generated) 047143734.b3lyp_6-31g(d).log.xz 047143734.td-b3lyp_6-31g+(d).inp 047143734.td-b3lyp_6-31g+(d).log.xz

047143734.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143734.td-b3lyp_6-31+g(d).gjf (generated)

047143734.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143734.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143734.mol 047143734.PUBCHEM 047143734.mol (via Jmol)
047143736.b3lyp_6-31g(d).inp

047143736.b3lyp_6-31g(d).qchem.inp (generated)

047143736.b3lyp_6-31g(d).gjf (generated)

047143736.b3lyp_6-31g(d).firefly.inp (generated)

047143736.b3lyp_6-31g(d).smash.inp (generated)

047143736.b3lyp_6-31g(d).nwchem.inp (generated) 047143736.b3lyp_6-31g(d).log.xz 047143736.mol 047143736.PUBCHEM 047143736.mol (via Jmol)
047143737.b3lyp_6-31g(d).inp

047143737.b3lyp_6-31g(d).qchem.inp (generated)

047143737.b3lyp_6-31g(d).gjf (generated)

047143737.b3lyp_6-31g(d).firefly.inp (generated)

047143737.b3lyp_6-31g(d).smash.inp (generated)

047143737.b3lyp_6-31g(d).nwchem.inp (generated) 047143737.b3lyp_6-31g(d).log.xz 047143737.td-b3lyp_6-31g+(d).inp 047143737.td-b3lyp_6-31g+(d).log.xz

047143737.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143737.td-b3lyp_6-31+g(d).gjf (generated)

047143737.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143737.mol 047143737.PUBCHEM 047143737.mol (via Jmol)
047143739.b3lyp_6-31g(d).inp

047143739.b3lyp_6-31g(d).qchem.inp (generated)

047143739.b3lyp_6-31g(d).gjf (generated)

047143739.b3lyp_6-31g(d).firefly.inp (generated)

047143739.b3lyp_6-31g(d).smash.inp (generated)

047143739.b3lyp_6-31g(d).nwchem.inp (generated) 047143739.b3lyp_6-31g(d).log.xz 047143739.mol 047143739.PUBCHEM 047143739.mol (via Jmol)
047143740.b3lyp_6-31g(d).inp

047143740.b3lyp_6-31g(d).qchem.inp (generated)

047143740.b3lyp_6-31g(d).gjf (generated)

047143740.b3lyp_6-31g(d).firefly.inp (generated)

047143740.b3lyp_6-31g(d).smash.inp (generated)

047143740.b3lyp_6-31g(d).nwchem.inp (generated) 047143740.b3lyp_6-31g(d).log.xz 047143740.td-b3lyp_6-31g+(d).inp 047143740.td-b3lyp_6-31g+(d).log.xz

047143740.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143740.td-b3lyp_6-31+g(d).gjf (generated)

047143740.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143740.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143740.mol 047143740.PUBCHEM 047143740.mol (via Jmol)
047143763.b3lyp_6-31g(d).inp

047143763.b3lyp_6-31g(d).qchem.inp (generated)

047143763.b3lyp_6-31g(d).gjf (generated)

047143763.b3lyp_6-31g(d).firefly.inp (generated)

047143763.b3lyp_6-31g(d).smash.inp (generated)

047143763.b3lyp_6-31g(d).nwchem.inp (generated) 047143763.b3lyp_6-31g(d).log.xz 047143763.td-b3lyp_6-31g+(d).inp 047143763.td-b3lyp_6-31g+(d).log.xz

047143763.td-b3lyp_6-31+g(d).qchem.inp (generated)

047143763.td-b3lyp_6-31+g(d).gjf (generated)

047143763.td-b3lyp_6-31+g(d).firefly.inp (generated)

047143763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 047143763.mol 047143763.PUBCHEM 047143763.mol (via Jmol)
047143779.b3lyp_6-31g(d).inp

047143779.b3lyp_6-31g(d).qchem.inp (generated)

047143779.b3lyp_6-31g(d).gjf (generated)

047143779.b3lyp_6-31g(d).firefly.inp (generated)

047143779.b3lyp_6-31g(d)