Index of

Last updated : Thu May 25 01:35:26 JST 2017
Total : 197 (158) in this page
017175035.b3lyp_6-31g(d).inp

017175035.b3lyp_6-31g(d).qchem.inp (generated)

017175035.b3lyp_6-31g(d).gjf (generated)

017175035.b3lyp_6-31g(d).firefly.inp (generated)

017175035.b3lyp_6-31g(d).smash.inp (generated)

017175035.b3lyp_6-31g(d).nwchem.inp (generated) 017175035.b3lyp_6-31g(d).log.xz 017175035.td-b3lyp_6-31g+(d).inp 017175035.td-b3lyp_6-31g+(d).log.xz

017175035.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175035.td-b3lyp_6-31+g(d).gjf (generated)

017175035.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175035.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175035.mol 017175035.PUBCHEM 017175035.mol (via Jmol)
017175126.b3lyp_6-31g(d).inp

017175126.b3lyp_6-31g(d).qchem.inp (generated)

017175126.b3lyp_6-31g(d).gjf (generated)

017175126.b3lyp_6-31g(d).firefly.inp (generated)

017175126.b3lyp_6-31g(d).smash.inp (generated)

017175126.b3lyp_6-31g(d).nwchem.inp (generated) 017175126.b3lyp_6-31g(d).log.xz 017175126.td-b3lyp_6-31g+(d).inp 017175126.td-b3lyp_6-31g+(d).log.xz

017175126.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175126.td-b3lyp_6-31+g(d).gjf (generated)

017175126.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175126.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175126.mol 017175126.PUBCHEM 017175126.mol (via Jmol)
017175136.b3lyp_6-31g(d).inp

017175136.b3lyp_6-31g(d).qchem.inp (generated)

017175136.b3lyp_6-31g(d).gjf (generated)

017175136.b3lyp_6-31g(d).firefly.inp (generated)

017175136.b3lyp_6-31g(d).smash.inp (generated)

017175136.b3lyp_6-31g(d).nwchem.inp (generated) 017175136.b3lyp_6-31g(d).log.xz 017175136.td-b3lyp_6-31g+(d).inp 017175136.td-b3lyp_6-31g+(d).log.xz

017175136.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175136.td-b3lyp_6-31+g(d).gjf (generated)

017175136.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175136.mol 017175136.PUBCHEM 017175136.mol (via Jmol)
017175142.b3lyp_6-31g(d).inp

017175142.b3lyp_6-31g(d).qchem.inp (generated)

017175142.b3lyp_6-31g(d).gjf (generated)

017175142.b3lyp_6-31g(d).firefly.inp (generated)

017175142.b3lyp_6-31g(d).smash.inp (generated)

017175142.b3lyp_6-31g(d).nwchem.inp (generated) 017175142.b3lyp_6-31g(d).log.xz 017175142.td-b3lyp_6-31g+(d).inp 017175142.td-b3lyp_6-31g+(d).log.xz

017175142.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175142.td-b3lyp_6-31+g(d).gjf (generated)

017175142.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175142.mol 017175142.PUBCHEM 017175142.mol (via Jmol)
017175207.b3lyp_6-31g(d).inp

017175207.b3lyp_6-31g(d).qchem.inp (generated)

017175207.b3lyp_6-31g(d).gjf (generated)

017175207.b3lyp_6-31g(d).firefly.inp (generated)

017175207.b3lyp_6-31g(d).smash.inp (generated)

017175207.b3lyp_6-31g(d).nwchem.inp (generated) 017175207.b3lyp_6-31g(d).log.xz 017175207.td-b3lyp_6-31g+(d).inp 017175207.td-b3lyp_6-31g+(d).log.xz

017175207.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175207.td-b3lyp_6-31+g(d).gjf (generated)

017175207.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175207.mol 017175207.PUBCHEM 017175207.mol (via Jmol)
017175224.b3lyp_6-31g(d).inp

017175224.b3lyp_6-31g(d).qchem.inp (generated)

017175224.b3lyp_6-31g(d).gjf (generated)

017175224.b3lyp_6-31g(d).firefly.inp (generated)

017175224.b3lyp_6-31g(d).smash.inp (generated)

017175224.b3lyp_6-31g(d).nwchem.inp (generated) 017175224.b3lyp_6-31g(d).log.xz 017175224.td-b3lyp_6-31g+(d).inp 017175224.td-b3lyp_6-31g+(d).log.xz

017175224.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175224.td-b3lyp_6-31+g(d).gjf (generated)

017175224.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175224.mol 017175224.PUBCHEM 017175224.mol (via Jmol)
017175249.b3lyp_6-31g(d).inp

017175249.b3lyp_6-31g(d).qchem.inp (generated)

017175249.b3lyp_6-31g(d).gjf (generated)

017175249.b3lyp_6-31g(d).firefly.inp (generated)

017175249.b3lyp_6-31g(d).smash.inp (generated)

017175249.b3lyp_6-31g(d).nwchem.inp (generated) 017175249.b3lyp_6-31g(d).log.xz 017175249.mol 017175249.PUBCHEM 017175249.mol (via Jmol)
017175263.b3lyp_6-31g(d).inp

017175263.b3lyp_6-31g(d).qchem.inp (generated)

017175263.b3lyp_6-31g(d).gjf (generated)

017175263.b3lyp_6-31g(d).firefly.inp (generated)

017175263.b3lyp_6-31g(d).smash.inp (generated)

017175263.b3lyp_6-31g(d).nwchem.inp (generated) 017175263.b3lyp_6-31g(d).log.xz 017175263.mol 017175263.PUBCHEM 017175263.mol (via Jmol)
017175267.b3lyp_6-31g(d).inp

017175267.b3lyp_6-31g(d).qchem.inp (generated)

017175267.b3lyp_6-31g(d).gjf (generated)

017175267.b3lyp_6-31g(d).firefly.inp (generated)

017175267.b3lyp_6-31g(d).smash.inp (generated)

017175267.b3lyp_6-31g(d).nwchem.inp (generated) 017175267.b3lyp_6-31g(d).log.xz 017175267.mol 017175267.PUBCHEM 017175267.mol (via Jmol)
017175268.b3lyp_6-31g(d).inp

017175268.b3lyp_6-31g(d).qchem.inp (generated)

017175268.b3lyp_6-31g(d).gjf (generated)

017175268.b3lyp_6-31g(d).firefly.inp (generated)

017175268.b3lyp_6-31g(d).smash.inp (generated)

017175268.b3lyp_6-31g(d).nwchem.inp (generated) 017175268.b3lyp_6-31g(d).log.xz 017175268.td-b3lyp_6-31g+(d).inp 017175268.td-b3lyp_6-31g+(d).log.xz

017175268.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175268.td-b3lyp_6-31+g(d).gjf (generated)

017175268.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175268.mol 017175268.PUBCHEM 017175268.mol (via Jmol)
017175352.b3lyp_6-31g(d).inp

017175352.b3lyp_6-31g(d).qchem.inp (generated)

017175352.b3lyp_6-31g(d).gjf (generated)

017175352.b3lyp_6-31g(d).firefly.inp (generated)

017175352.b3lyp_6-31g(d).smash.inp (generated)

017175352.b3lyp_6-31g(d).nwchem.inp (generated) 017175352.b3lyp_6-31g(d).log.xz 017175352.td-b3lyp_6-31g+(d).inp 017175352.td-b3lyp_6-31g+(d).log.xz

017175352.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175352.td-b3lyp_6-31+g(d).gjf (generated)

017175352.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175352.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175352.mol 017175352.PUBCHEM 017175352.mol (via Jmol)
017175359.b3lyp_6-31g(d).inp

017175359.b3lyp_6-31g(d).qchem.inp (generated)

017175359.b3lyp_6-31g(d).gjf (generated)

017175359.b3lyp_6-31g(d).firefly.inp (generated)

017175359.b3lyp_6-31g(d).smash.inp (generated)

017175359.b3lyp_6-31g(d).nwchem.inp (generated) 017175359.b3lyp_6-31g(d).log.xz 017175359.td-b3lyp_6-31g+(d).inp 017175359.td-b3lyp_6-31g+(d).log.xz

017175359.td-b3lyp_6-31+g(d).qchem.inp (generated)

017175359.td-b3lyp_6-31+g(d).gjf (generated)

017175359.td-b3lyp_6-31+g(d).firefly.inp (generated)

017175359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017175359.mol 017175359.PUBCHEM 017175359.mol (via Jmol)
017176781.b3lyp_6-31g(d).inp

017176781.b3lyp_6-31g(d).qchem.inp (generated)

017176781.b3lyp_6-31g(d).gjf (generated)

017176781.b3lyp_6-31g(d).firefly.inp (generated)

017176781.b3lyp_6-31g(d).smash.inp (generated)

017176781.b3lyp_6-31g(d).nwchem.inp (generated) 017176781.b3lyp_6-31g(d).log.xz 017176781.td-b3lyp_6-31g+(d).inp 017176781.td-b3lyp_6-31g+(d).log.xz

017176781.td-b3lyp_6-31+g(d).qchem.inp (generated)

017176781.td-b3lyp_6-31+g(d).gjf (generated)

017176781.td-b3lyp_6-31+g(d).firefly.inp (generated)

017176781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017176781.mol 017176781.PUBCHEM 017176781.mol (via Jmol)
017177292.b3lyp_6-31g(d).inp

017177292.b3lyp_6-31g(d).qchem.inp (generated)

017177292.b3lyp_6-31g(d).gjf (generated)

017177292.b3lyp_6-31g(d).firefly.inp (generated)

017177292.b3lyp_6-31g(d).smash.inp (generated)

017177292.b3lyp_6-31g(d).nwchem.inp (generated) 017177292.b3lyp_6-31g(d).log.xz 017177292.td-b3lyp_6-31g+(d).inp 017177292.td-b3lyp_6-31g+(d).log.xz

017177292.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177292.td-b3lyp_6-31+g(d).gjf (generated)

017177292.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177292.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177292.mol 017177292.PUBCHEM 017177292.mol (via Jmol)
017177293.b3lyp_6-31g(d).inp

017177293.b3lyp_6-31g(d).qchem.inp (generated)

017177293.b3lyp_6-31g(d).gjf (generated)

017177293.b3lyp_6-31g(d).firefly.inp (generated)

017177293.b3lyp_6-31g(d).smash.inp (generated)

017177293.b3lyp_6-31g(d).nwchem.inp (generated) 017177293.b3lyp_6-31g(d).log.xz 017177293.td-b3lyp_6-31g+(d).inp 017177293.td-b3lyp_6-31g+(d).log.xz

017177293.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177293.td-b3lyp_6-31+g(d).gjf (generated)

017177293.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177293.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177293.mol 017177293.PUBCHEM 017177293.mol (via Jmol)
017177294.b3lyp_6-31g(d).inp

017177294.b3lyp_6-31g(d).qchem.inp (generated)

017177294.b3lyp_6-31g(d).gjf (generated)

017177294.b3lyp_6-31g(d).firefly.inp (generated)

017177294.b3lyp_6-31g(d).smash.inp (generated)

017177294.b3lyp_6-31g(d).nwchem.inp (generated) 017177294.b3lyp_6-31g(d).log.xz 017177294.td-b3lyp_6-31g+(d).inp 017177294.td-b3lyp_6-31g+(d).log.xz

017177294.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177294.td-b3lyp_6-31+g(d).gjf (generated)

017177294.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177294.mol 017177294.PUBCHEM 017177294.mol (via Jmol)
017177295.b3lyp_6-31g(d).inp

017177295.b3lyp_6-31g(d).qchem.inp (generated)

017177295.b3lyp_6-31g(d).gjf (generated)

017177295.b3lyp_6-31g(d).firefly.inp (generated)

017177295.b3lyp_6-31g(d).smash.inp (generated)

017177295.b3lyp_6-31g(d).nwchem.inp (generated) 017177295.b3lyp_6-31g(d).log.xz 017177295.mol 017177295.PUBCHEM 017177295.mol (via Jmol)
017177296.b3lyp_6-31g(d).inp

017177296.b3lyp_6-31g(d).qchem.inp (generated)

017177296.b3lyp_6-31g(d).gjf (generated)

017177296.b3lyp_6-31g(d).firefly.inp (generated)

017177296.b3lyp_6-31g(d).smash.inp (generated)

017177296.b3lyp_6-31g(d).nwchem.inp (generated) 017177296.b3lyp_6-31g(d).log.xz 017177296.td-b3lyp_6-31g+(d).inp 017177296.td-b3lyp_6-31g+(d).log.xz

017177296.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177296.td-b3lyp_6-31+g(d).gjf (generated)

017177296.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177296.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177296.mol 017177296.PUBCHEM 017177296.mol (via Jmol)
017177297.b3lyp_6-31g(d).inp

017177297.b3lyp_6-31g(d).qchem.inp (generated)

017177297.b3lyp_6-31g(d).gjf (generated)

017177297.b3lyp_6-31g(d).firefly.inp (generated)

017177297.b3lyp_6-31g(d).smash.inp (generated)

017177297.b3lyp_6-31g(d).nwchem.inp (generated) 017177297.b3lyp_6-31g(d).log.xz 017177297.td-b3lyp_6-31g+(d).inp 017177297.td-b3lyp_6-31g+(d).log.xz

017177297.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177297.td-b3lyp_6-31+g(d).gjf (generated)

017177297.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177297.mol 017177297.PUBCHEM 017177297.mol (via Jmol)
017177298.b3lyp_6-31g(d).inp

017177298.b3lyp_6-31g(d).qchem.inp (generated)

017177298.b3lyp_6-31g(d).gjf (generated)

017177298.b3lyp_6-31g(d).firefly.inp (generated)

017177298.b3lyp_6-31g(d).smash.inp (generated)

017177298.b3lyp_6-31g(d).nwchem.inp (generated) 017177298.b3lyp_6-31g(d).log.xz 017177298.td-b3lyp_6-31g+(d).inp 017177298.td-b3lyp_6-31g+(d).log.xz

017177298.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177298.td-b3lyp_6-31+g(d).gjf (generated)

017177298.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177298.mol 017177298.PUBCHEM 017177298.mol (via Jmol)
017177299.b3lyp_6-31g(d).inp

017177299.b3lyp_6-31g(d).qchem.inp (generated)

017177299.b3lyp_6-31g(d).gjf (generated)

017177299.b3lyp_6-31g(d).firefly.inp (generated)

017177299.b3lyp_6-31g(d).smash.inp (generated)

017177299.b3lyp_6-31g(d).nwchem.inp (generated) 017177299.b3lyp_6-31g(d).log.xz 017177299.mol 017177299.PUBCHEM 017177299.mol (via Jmol)
017177310.b3lyp_6-31g(d).inp

017177310.b3lyp_6-31g(d).qchem.inp (generated)

017177310.b3lyp_6-31g(d).gjf (generated)

017177310.b3lyp_6-31g(d).firefly.inp (generated)

017177310.b3lyp_6-31g(d).smash.inp (generated)

017177310.b3lyp_6-31g(d).nwchem.inp (generated) 017177310.b3lyp_6-31g(d).log.xz 017177310.mol 017177310.PUBCHEM 017177310.mol (via Jmol)
017177314.b3lyp_6-31g(d).inp

017177314.b3lyp_6-31g(d).qchem.inp (generated)

017177314.b3lyp_6-31g(d).gjf (generated)

017177314.b3lyp_6-31g(d).firefly.inp (generated)

017177314.b3lyp_6-31g(d).smash.inp (generated)

017177314.b3lyp_6-31g(d).nwchem.inp (generated) 017177314.b3lyp_6-31g(d).log.xz 017177314.td-b3lyp_6-31g+(d).inp 017177314.td-b3lyp_6-31g+(d).log.xz

017177314.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177314.td-b3lyp_6-31+g(d).gjf (generated)

017177314.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177314.mol 017177314.PUBCHEM 017177314.mol (via Jmol)
017177735.b3lyp_6-31g(d).inp

017177735.b3lyp_6-31g(d).qchem.inp (generated)

017177735.b3lyp_6-31g(d).gjf (generated)

017177735.b3lyp_6-31g(d).firefly.inp (generated)

017177735.b3lyp_6-31g(d).smash.inp (generated)

017177735.b3lyp_6-31g(d).nwchem.inp (generated) 017177735.b3lyp_6-31g(d).log.xz 017177735.td-b3lyp_6-31g+(d).inp 017177735.td-b3lyp_6-31g+(d).log.xz

017177735.td-b3lyp_6-31+g(d).qchem.inp (generated)

017177735.td-b3lyp_6-31+g(d).gjf (generated)

017177735.td-b3lyp_6-31+g(d).firefly.inp (generated)

017177735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017177735.mol 017177735.PUBCHEM 017177735.mol (via Jmol)
017178006.b3lyp_6-31g(d).inp

017178006.b3lyp_6-31g(d).qchem.inp (generated)

017178006.b3lyp_6-31g(d).gjf (generated)

017178006.b3lyp_6-31g(d).firefly.inp (generated)

017178006.b3lyp_6-31g(d).smash.inp (generated)

017178006.b3lyp_6-31g(d).nwchem.inp (generated) 017178006.b3lyp_6-31g(d).log.xz 017178006.td-b3lyp_6-31g+(d).inp 017178006.td-b3lyp_6-31g+(d).log.xz

017178006.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178006.td-b3lyp_6-31+g(d).gjf (generated)

017178006.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178006.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178006.mol 017178006.PUBCHEM 017178006.mol (via Jmol)
017178008.b3lyp_6-31g(d).inp

017178008.b3lyp_6-31g(d).qchem.inp (generated)

017178008.b3lyp_6-31g(d).gjf (generated)

017178008.b3lyp_6-31g(d).firefly.inp (generated)

017178008.b3lyp_6-31g(d).smash.inp (generated)

017178008.b3lyp_6-31g(d).nwchem.inp (generated) 017178008.b3lyp_6-31g(d).log.xz 017178008.td-b3lyp_6-31g+(d).inp 017178008.td-b3lyp_6-31g+(d).log.xz

017178008.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178008.td-b3lyp_6-31+g(d).gjf (generated)

017178008.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178008.mol 017178008.PUBCHEM 017178008.mol (via Jmol)
017178010.b3lyp_6-31g(d).inp

017178010.b3lyp_6-31g(d).qchem.inp (generated)

017178010.b3lyp_6-31g(d).gjf (generated)

017178010.b3lyp_6-31g(d).firefly.inp (generated)

017178010.b3lyp_6-31g(d).smash.inp (generated)

017178010.b3lyp_6-31g(d).nwchem.inp (generated) 017178010.b3lyp_6-31g(d).log.xz 017178010.td-b3lyp_6-31g+(d).inp 017178010.td-b3lyp_6-31g+(d).log.xz

017178010.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178010.td-b3lyp_6-31+g(d).gjf (generated)

017178010.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178010.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178010.mol 017178010.PUBCHEM 017178010.mol (via Jmol)
017178011.b3lyp_6-31g(d).inp

017178011.b3lyp_6-31g(d).qchem.inp (generated)

017178011.b3lyp_6-31g(d).gjf (generated)

017178011.b3lyp_6-31g(d).firefly.inp (generated)

017178011.b3lyp_6-31g(d).smash.inp (generated)

017178011.b3lyp_6-31g(d).nwchem.inp (generated) 017178011.b3lyp_6-31g(d).log.xz 017178011.td-b3lyp_6-31g+(d).inp 017178011.td-b3lyp_6-31g+(d).log.xz

017178011.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178011.td-b3lyp_6-31+g(d).gjf (generated)

017178011.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178011.mol 017178011.PUBCHEM 017178011.mol (via Jmol)
017178013.b3lyp_6-31g(d).inp

017178013.b3lyp_6-31g(d).qchem.inp (generated)

017178013.b3lyp_6-31g(d).gjf (generated)

017178013.b3lyp_6-31g(d).firefly.inp (generated)

017178013.b3lyp_6-31g(d).smash.inp (generated)

017178013.b3lyp_6-31g(d).nwchem.inp (generated) 017178013.b3lyp_6-31g(d).log.xz 017178013.mol 017178013.PUBCHEM 017178013.mol (via Jmol)
017178016.b3lyp_6-31g(d).inp

017178016.b3lyp_6-31g(d).qchem.inp (generated)

017178016.b3lyp_6-31g(d).gjf (generated)

017178016.b3lyp_6-31g(d).firefly.inp (generated)

017178016.b3lyp_6-31g(d).smash.inp (generated)

017178016.b3lyp_6-31g(d).nwchem.inp (generated) 017178016.b3lyp_6-31g(d).log.xz 017178016.td-b3lyp_6-31g+(d).inp 017178016.td-b3lyp_6-31g+(d).log.xz

017178016.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178016.td-b3lyp_6-31+g(d).gjf (generated)

017178016.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178016.mol 017178016.PUBCHEM 017178016.mol (via Jmol)
017178029.b3lyp_6-31g(d).inp

017178029.b3lyp_6-31g(d).qchem.inp (generated)

017178029.b3lyp_6-31g(d).gjf (generated)

017178029.b3lyp_6-31g(d).firefly.inp (generated)

017178029.b3lyp_6-31g(d).smash.inp (generated)

017178029.b3lyp_6-31g(d).nwchem.inp (generated) 017178029.b3lyp_6-31g(d).log.xz 017178029.td-b3lyp_6-31g+(d).inp 017178029.td-b3lyp_6-31g+(d).log.xz

017178029.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178029.td-b3lyp_6-31+g(d).gjf (generated)

017178029.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178029.mol 017178029.PUBCHEM 017178029.mol (via Jmol)
017178037.b3lyp_6-31g(d).inp

017178037.b3lyp_6-31g(d).qchem.inp (generated)

017178037.b3lyp_6-31g(d).gjf (generated)

017178037.b3lyp_6-31g(d).firefly.inp (generated)

017178037.b3lyp_6-31g(d).smash.inp (generated)

017178037.b3lyp_6-31g(d).nwchem.inp (generated) 017178037.b3lyp_6-31g(d).log.xz 017178037.td-b3lyp_6-31g+(d).inp 017178037.td-b3lyp_6-31g+(d).log.xz

017178037.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178037.td-b3lyp_6-31+g(d).gjf (generated)

017178037.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178037.mol 017178037.PUBCHEM 017178037.mol (via Jmol)
017178041.b3lyp_6-31g(d).inp

017178041.b3lyp_6-31g(d).qchem.inp (generated)

017178041.b3lyp_6-31g(d).gjf (generated)

017178041.b3lyp_6-31g(d).firefly.inp (generated)

017178041.b3lyp_6-31g(d).smash.inp (generated)

017178041.b3lyp_6-31g(d).nwchem.inp (generated) 017178041.b3lyp_6-31g(d).log.xz 017178041.td-b3lyp_6-31g+(d).inp 017178041.td-b3lyp_6-31g+(d).log.xz

017178041.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178041.td-b3lyp_6-31+g(d).gjf (generated)

017178041.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178041.mol 017178041.PUBCHEM 017178041.mol (via Jmol)
017178043.b3lyp_6-31g(d).inp

017178043.b3lyp_6-31g(d).qchem.inp (generated)

017178043.b3lyp_6-31g(d).gjf (generated)

017178043.b3lyp_6-31g(d).firefly.inp (generated)

017178043.b3lyp_6-31g(d).smash.inp (generated)

017178043.b3lyp_6-31g(d).nwchem.inp (generated) 017178043.b3lyp_6-31g(d).log.xz 017178043.mol 017178043.PUBCHEM 017178043.mol (via Jmol)
017178045.b3lyp_6-31g(d).inp

017178045.b3lyp_6-31g(d).qchem.inp (generated)

017178045.b3lyp_6-31g(d).gjf (generated)

017178045.b3lyp_6-31g(d).firefly.inp (generated)

017178045.b3lyp_6-31g(d).smash.inp (generated)

017178045.b3lyp_6-31g(d).nwchem.inp (generated) 017178045.b3lyp_6-31g(d).log.xz 017178045.td-b3lyp_6-31g+(d).inp 017178045.td-b3lyp_6-31g+(d).log.xz

017178045.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178045.td-b3lyp_6-31+g(d).gjf (generated)

017178045.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178045.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178045.mol 017178045.PUBCHEM 017178045.mol (via Jmol)
017178049.b3lyp_6-31g(d).inp

017178049.b3lyp_6-31g(d).qchem.inp (generated)

017178049.b3lyp_6-31g(d).gjf (generated)

017178049.b3lyp_6-31g(d).firefly.inp (generated)

017178049.b3lyp_6-31g(d).smash.inp (generated)

017178049.b3lyp_6-31g(d).nwchem.inp (generated) 017178049.b3lyp_6-31g(d).log.xz 017178049.td-b3lyp_6-31g+(d).inp 017178049.td-b3lyp_6-31g+(d).log.xz

017178049.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178049.td-b3lyp_6-31+g(d).gjf (generated)

017178049.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178049.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178049.mol 017178049.PUBCHEM 017178049.mol (via Jmol)
017178051.b3lyp_6-31g(d).inp

017178051.b3lyp_6-31g(d).qchem.inp (generated)

017178051.b3lyp_6-31g(d).gjf (generated)

017178051.b3lyp_6-31g(d).firefly.inp (generated)

017178051.b3lyp_6-31g(d).smash.inp (generated)

017178051.b3lyp_6-31g(d).nwchem.inp (generated) 017178051.b3lyp_6-31g(d).log.xz 017178051.td-b3lyp_6-31g+(d).inp 017178051.td-b3lyp_6-31g+(d).log.xz

017178051.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178051.td-b3lyp_6-31+g(d).gjf (generated)

017178051.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178051.mol 017178051.PUBCHEM 017178051.mol (via Jmol)
017178053.b3lyp_6-31g(d).inp

017178053.b3lyp_6-31g(d).qchem.inp (generated)

017178053.b3lyp_6-31g(d).gjf (generated)

017178053.b3lyp_6-31g(d).firefly.inp (generated)

017178053.b3lyp_6-31g(d).smash.inp (generated)

017178053.b3lyp_6-31g(d).nwchem.inp (generated) 017178053.b3lyp_6-31g(d).log.xz 017178053.td-b3lyp_6-31g+(d).inp 017178053.td-b3lyp_6-31g+(d).log.xz

017178053.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178053.td-b3lyp_6-31+g(d).gjf (generated)

017178053.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178053.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178053.mol 017178053.PUBCHEM 017178053.mol (via Jmol)
017178055.b3lyp_6-31g(d).inp

017178055.b3lyp_6-31g(d).qchem.inp (generated)

017178055.b3lyp_6-31g(d).gjf (generated)

017178055.b3lyp_6-31g(d).firefly.inp (generated)

017178055.b3lyp_6-31g(d).smash.inp (generated)

017178055.b3lyp_6-31g(d).nwchem.inp (generated) 017178055.b3lyp_6-31g(d).log.xz 017178055.mol 017178055.PUBCHEM 017178055.mol (via Jmol)
017178060.b3lyp_6-31g(d).inp

017178060.b3lyp_6-31g(d).qchem.inp (generated)

017178060.b3lyp_6-31g(d).gjf (generated)

017178060.b3lyp_6-31g(d).firefly.inp (generated)

017178060.b3lyp_6-31g(d).smash.inp (generated)

017178060.b3lyp_6-31g(d).nwchem.inp (generated) 017178060.b3lyp_6-31g(d).log.xz 017178060.td-b3lyp_6-31g+(d).inp 017178060.td-b3lyp_6-31g+(d).log.xz

017178060.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178060.td-b3lyp_6-31+g(d).gjf (generated)

017178060.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178060.mol 017178060.PUBCHEM 017178060.mol (via Jmol)
017178063.b3lyp_6-31g(d).inp

017178063.b3lyp_6-31g(d).qchem.inp (generated)

017178063.b3lyp_6-31g(d).gjf (generated)

017178063.b3lyp_6-31g(d).firefly.inp (generated)

017178063.b3lyp_6-31g(d).smash.inp (generated)

017178063.b3lyp_6-31g(d).nwchem.inp (generated) 017178063.b3lyp_6-31g(d).log.xz 017178063.td-b3lyp_6-31g+(d).inp 017178063.td-b3lyp_6-31g+(d).log.xz

017178063.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178063.td-b3lyp_6-31+g(d).gjf (generated)

017178063.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178063.mol 017178063.PUBCHEM 017178063.mol (via Jmol)
017178065.b3lyp_6-31g(d).inp

017178065.b3lyp_6-31g(d).qchem.inp (generated)

017178065.b3lyp_6-31g(d).gjf (generated)

017178065.b3lyp_6-31g(d).firefly.inp (generated)

017178065.b3lyp_6-31g(d).smash.inp (generated)

017178065.b3lyp_6-31g(d).nwchem.inp (generated) 017178065.b3lyp_6-31g(d).log.xz 017178065.td-b3lyp_6-31g+(d).inp 017178065.td-b3lyp_6-31g+(d).log.xz

017178065.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178065.td-b3lyp_6-31+g(d).gjf (generated)

017178065.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178065.mol 017178065.PUBCHEM 017178065.mol (via Jmol)
017178072.b3lyp_6-31g(d).inp

017178072.b3lyp_6-31g(d).qchem.inp (generated)

017178072.b3lyp_6-31g(d).gjf (generated)

017178072.b3lyp_6-31g(d).firefly.inp (generated)

017178072.b3lyp_6-31g(d).smash.inp (generated)

017178072.b3lyp_6-31g(d).nwchem.inp (generated) 017178072.b3lyp_6-31g(d).log.xz 017178072.td-b3lyp_6-31g+(d).inp 017178072.td-b3lyp_6-31g+(d).log.xz

017178072.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178072.td-b3lyp_6-31+g(d).gjf (generated)

017178072.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178072.mol 017178072.PUBCHEM 017178072.mol (via Jmol)
017178078.b3lyp_6-31g(d).inp

017178078.b3lyp_6-31g(d).qchem.inp (generated)

017178078.b3lyp_6-31g(d).gjf (generated)

017178078.b3lyp_6-31g(d).firefly.inp (generated)

017178078.b3lyp_6-31g(d).smash.inp (generated)

017178078.b3lyp_6-31g(d).nwchem.inp (generated) 017178078.b3lyp_6-31g(d).log.xz 017178078.td-b3lyp_6-31g+(d).inp 017178078.td-b3lyp_6-31g+(d).log.xz

017178078.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178078.td-b3lyp_6-31+g(d).gjf (generated)

017178078.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178078.mol 017178078.PUBCHEM 017178078.mol (via Jmol)
017178128.b3lyp_6-31g(d).inp

017178128.b3lyp_6-31g(d).qchem.inp (generated)

017178128.b3lyp_6-31g(d).gjf (generated)

017178128.b3lyp_6-31g(d).firefly.inp (generated)

017178128.b3lyp_6-31g(d).smash.inp (generated)

017178128.b3lyp_6-31g(d).nwchem.inp (generated) 017178128.b3lyp_6-31g(d).log.xz 017178128.td-b3lyp_6-31g+(d).inp 017178128.td-b3lyp_6-31g+(d).log.xz

017178128.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178128.td-b3lyp_6-31+g(d).gjf (generated)

017178128.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178128.mol 017178128.PUBCHEM 017178128.mol (via Jmol)
017178167.b3lyp_6-31g(d).inp

017178167.b3lyp_6-31g(d).qchem.inp (generated)

017178167.b3lyp_6-31g(d).gjf (generated)

017178167.b3lyp_6-31g(d).firefly.inp (generated)

017178167.b3lyp_6-31g(d).smash.inp (generated)

017178167.b3lyp_6-31g(d).nwchem.inp (generated) 017178167.b3lyp_6-31g(d).log.xz 017178167.mol 017178167.PUBCHEM 017178167.mol (via Jmol)
017178210.b3lyp_6-31g(d).inp

017178210.b3lyp_6-31g(d).qchem.inp (generated)

017178210.b3lyp_6-31g(d).gjf (generated)

017178210.b3lyp_6-31g(d).firefly.inp (generated)

017178210.b3lyp_6-31g(d).smash.inp (generated)

017178210.b3lyp_6-31g(d).nwchem.inp (generated) 017178210.b3lyp_6-31g(d).log.xz 017178210.td-b3lyp_6-31g+(d).inp 017178210.td-b3lyp_6-31g+(d).log.xz

017178210.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178210.td-b3lyp_6-31+g(d).gjf (generated)

017178210.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178210.mol 017178210.PUBCHEM 017178210.mol (via Jmol)
017178224.b3lyp_6-31g(d).inp

017178224.b3lyp_6-31g(d).qchem.inp (generated)

017178224.b3lyp_6-31g(d).gjf (generated)

017178224.b3lyp_6-31g(d).firefly.inp (generated)

017178224.b3lyp_6-31g(d).smash.inp (generated)

017178224.b3lyp_6-31g(d).nwchem.inp (generated) 017178224.b3lyp_6-31g(d).log.xz 017178224.mol 017178224.PUBCHEM 017178224.mol (via Jmol)
017178233.b3lyp_6-31g(d).inp

017178233.b3lyp_6-31g(d).qchem.inp (generated)

017178233.b3lyp_6-31g(d).gjf (generated)

017178233.b3lyp_6-31g(d).firefly.inp (generated)

017178233.b3lyp_6-31g(d).smash.inp (generated)

017178233.b3lyp_6-31g(d).nwchem.inp (generated) 017178233.b3lyp_6-31g(d).log.xz 017178233.mol 017178233.PUBCHEM 017178233.mol (via Jmol)
017178234.b3lyp_6-31g(d).inp

017178234.b3lyp_6-31g(d).qchem.inp (generated)

017178234.b3lyp_6-31g(d).gjf (generated)

017178234.b3lyp_6-31g(d).firefly.inp (generated)

017178234.b3lyp_6-31g(d).smash.inp (generated)

017178234.b3lyp_6-31g(d).nwchem.inp (generated) 017178234.b3lyp_6-31g(d).log.xz 017178234.td-b3lyp_6-31g+(d).inp 017178234.td-b3lyp_6-31g+(d).log.xz

017178234.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178234.td-b3lyp_6-31+g(d).gjf (generated)

017178234.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178234.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178234.mol 017178234.PUBCHEM 017178234.mol (via Jmol)
017178266.b3lyp_6-31g(d).inp

017178266.b3lyp_6-31g(d).qchem.inp (generated)

017178266.b3lyp_6-31g(d).gjf (generated)

017178266.b3lyp_6-31g(d).firefly.inp (generated)

017178266.b3lyp_6-31g(d).smash.inp (generated)

017178266.b3lyp_6-31g(d).nwchem.inp (generated) 017178266.b3lyp_6-31g(d).log.xz 017178266.td-b3lyp_6-31g+(d).inp 017178266.td-b3lyp_6-31g+(d).log.xz

017178266.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178266.td-b3lyp_6-31+g(d).gjf (generated)

017178266.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178266.mol 017178266.PUBCHEM 017178266.mol (via Jmol)
017178312.b3lyp_6-31g(d).inp

017178312.b3lyp_6-31g(d).qchem.inp (generated)

017178312.b3lyp_6-31g(d).gjf (generated)

017178312.b3lyp_6-31g(d).firefly.inp (generated)

017178312.b3lyp_6-31g(d).smash.inp (generated)

017178312.b3lyp_6-31g(d).nwchem.inp (generated) 017178312.b3lyp_6-31g(d).log.xz 017178312.td-b3lyp_6-31g+(d).inp 017178312.td-b3lyp_6-31g+(d).log.xz

017178312.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178312.td-b3lyp_6-31+g(d).gjf (generated)

017178312.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178312.mol 017178312.PUBCHEM 017178312.mol (via Jmol)
017178319.b3lyp_6-31g(d).inp

017178319.b3lyp_6-31g(d).qchem.inp (generated)

017178319.b3lyp_6-31g(d).gjf (generated)

017178319.b3lyp_6-31g(d).firefly.inp (generated)

017178319.b3lyp_6-31g(d).smash.inp (generated)

017178319.b3lyp_6-31g(d).nwchem.inp (generated) 017178319.b3lyp_6-31g(d).log.xz 017178319.td-b3lyp_6-31g+(d).inp 017178319.td-b3lyp_6-31g+(d).log.xz

017178319.td-b3lyp_6-31+g(d).qchem.inp (generated)

017178319.td-b3lyp_6-31+g(d).gjf (generated)

017178319.td-b3lyp_6-31+g(d).firefly.inp (generated)

017178319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017178319.mol 017178319.PUBCHEM 017178319.mol (via Jmol)
017178993.b3lyp_6-31g(d).inp

017178993.b3lyp_6-31g(d).qchem.inp (generated)

017178993.b3lyp_6-31g(d).gjf (generated)

017178993.b3lyp_6-31g(d).firefly.inp (generated)

017178993.b3lyp_6-31g(d).smash.inp (generated)

017178993.b3lyp_6-31g(d).nwchem.inp (generated) 017178993.b3lyp_6-31g(d).log.xz 017178993.mol 017178993.PUBCHEM 017178993.mol (via Jmol)
017179078.b3lyp_6-31g(d).inp

017179078.b3lyp_6-31g(d).qchem.inp (generated)

017179078.b3lyp_6-31g(d).gjf (generated)

017179078.b3lyp_6-31g(d).firefly.inp (generated)

017179078.b3lyp_6-31g(d).smash.inp (generated)

017179078.b3lyp_6-31g(d).nwchem.inp (generated) 017179078.b3lyp_6-31g(d).log.xz 017179078.td-b3lyp_6-31g+(d).inp 017179078.td-b3lyp_6-31g+(d).log.xz

017179078.td-b3lyp_6-31+g(d).qchem.inp (generated)

017179078.td-b3lyp_6-31+g(d).gjf (generated)

017179078.td-b3lyp_6-31+g(d).firefly.inp (generated)

017179078.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017179078.mol 017179078.PUBCHEM 017179078.mol (via Jmol)
017180187.b3lyp_6-31g(d).inp

017180187.b3lyp_6-31g(d).qchem.inp (generated)

017180187.b3lyp_6-31g(d).gjf (generated)

017180187.b3lyp_6-31g(d).firefly.inp (generated)

017180187.b3lyp_6-31g(d).smash.inp (generated)

017180187.b3lyp_6-31g(d).nwchem.inp (generated) 017180187.b3lyp_6-31g(d).log.xz 017180187.td-b3lyp_6-31g+(d).inp 017180187.td-b3lyp_6-31g+(d).log.xz

017180187.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180187.td-b3lyp_6-31+g(d).gjf (generated)

017180187.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180187.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180187.mol 017180187.PUBCHEM 017180187.mol (via Jmol)
017180202.b3lyp_6-31g(d).inp

017180202.b3lyp_6-31g(d).qchem.inp (generated)

017180202.b3lyp_6-31g(d).gjf (generated)

017180202.b3lyp_6-31g(d).firefly.inp (generated)

017180202.b3lyp_6-31g(d).smash.inp (generated)

017180202.b3lyp_6-31g(d).nwchem.inp (generated) 017180202.b3lyp_6-31g(d).log.xz 017180202.td-b3lyp_6-31g+(d).inp 017180202.td-b3lyp_6-31g+(d).log.xz

017180202.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180202.td-b3lyp_6-31+g(d).gjf (generated)

017180202.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180202.mol 017180202.PUBCHEM 017180202.mol (via Jmol)
017180206.b3lyp_6-31g(d).inp

017180206.b3lyp_6-31g(d).qchem.inp (generated)

017180206.b3lyp_6-31g(d).gjf (generated)

017180206.b3lyp_6-31g(d).firefly.inp (generated)

017180206.b3lyp_6-31g(d).smash.inp (generated)

017180206.b3lyp_6-31g(d).nwchem.inp (generated) 017180206.b3lyp_6-31g(d).log.xz 017180206.td-b3lyp_6-31g+(d).inp 017180206.td-b3lyp_6-31g+(d).log.xz

017180206.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180206.td-b3lyp_6-31+g(d).gjf (generated)

017180206.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180206.mol 017180206.PUBCHEM 017180206.mol (via Jmol)
017180207.b3lyp_6-31g(d).inp

017180207.b3lyp_6-31g(d).qchem.inp (generated)

017180207.b3lyp_6-31g(d).gjf (generated)

017180207.b3lyp_6-31g(d).firefly.inp (generated)

017180207.b3lyp_6-31g(d).smash.inp (generated)

017180207.b3lyp_6-31g(d).nwchem.inp (generated) 017180207.b3lyp_6-31g(d).log.xz 017180207.td-b3lyp_6-31g+(d).inp 017180207.td-b3lyp_6-31g+(d).log.xz

017180207.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180207.td-b3lyp_6-31+g(d).gjf (generated)

017180207.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180207.mol 017180207.PUBCHEM 017180207.mol (via Jmol)
017180257.b3lyp_6-31g(d).inp

017180257.b3lyp_6-31g(d).qchem.inp (generated)

017180257.b3lyp_6-31g(d).gjf (generated)

017180257.b3lyp_6-31g(d).firefly.inp (generated)

017180257.b3lyp_6-31g(d).smash.inp (generated)

017180257.b3lyp_6-31g(d).nwchem.inp (generated) 017180257.b3lyp_6-31g(d).log.xz 017180257.td-b3lyp_6-31g+(d).inp 017180257.td-b3lyp_6-31g+(d).log.xz

017180257.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180257.td-b3lyp_6-31+g(d).gjf (generated)

017180257.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180257.mol 017180257.PUBCHEM 017180257.mol (via Jmol)
017180278.b3lyp_6-31g(d).inp

017180278.b3lyp_6-31g(d).qchem.inp (generated)

017180278.b3lyp_6-31g(d).gjf (generated)

017180278.b3lyp_6-31g(d).firefly.inp (generated)

017180278.b3lyp_6-31g(d).smash.inp (generated)

017180278.b3lyp_6-31g(d).nwchem.inp (generated) 017180278.b3lyp_6-31g(d).log.xz 017180278.td-b3lyp_6-31g+(d).inp 017180278.td-b3lyp_6-31g+(d).log.xz

017180278.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180278.td-b3lyp_6-31+g(d).gjf (generated)

017180278.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180278.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180278.mol 017180278.PUBCHEM 017180278.mol (via Jmol)
017180342.b3lyp_6-31g(d).inp

017180342.b3lyp_6-31g(d).qchem.inp (generated)

017180342.b3lyp_6-31g(d).gjf (generated)

017180342.b3lyp_6-31g(d).firefly.inp (generated)

017180342.b3lyp_6-31g(d).smash.inp (generated)

017180342.b3lyp_6-31g(d).nwchem.inp (generated) 017180342.b3lyp_6-31g(d).log.xz 017180342.mol 017180342.PUBCHEM 017180342.mol (via Jmol)
017180397.b3lyp_6-31g(d).inp

017180397.b3lyp_6-31g(d).qchem.inp (generated)

017180397.b3lyp_6-31g(d).gjf (generated)

017180397.b3lyp_6-31g(d).firefly.inp (generated)

017180397.b3lyp_6-31g(d).smash.inp (generated)

017180397.b3lyp_6-31g(d).nwchem.inp (generated) 017180397.b3lyp_6-31g(d).log.xz 017180397.td-b3lyp_6-31g+(d).inp 017180397.td-b3lyp_6-31g+(d).log.xz

017180397.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180397.td-b3lyp_6-31+g(d).gjf (generated)

017180397.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180397.mol 017180397.PUBCHEM 017180397.mol (via Jmol)
017180398.b3lyp_6-31g(d).inp

017180398.b3lyp_6-31g(d).qchem.inp (generated)

017180398.b3lyp_6-31g(d).gjf (generated)

017180398.b3lyp_6-31g(d).firefly.inp (generated)

017180398.b3lyp_6-31g(d).smash.inp (generated)

017180398.b3lyp_6-31g(d).nwchem.inp (generated) 017180398.b3lyp_6-31g(d).log.xz 017180398.td-b3lyp_6-31g+(d).inp 017180398.td-b3lyp_6-31g+(d).log.xz

017180398.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180398.td-b3lyp_6-31+g(d).gjf (generated)

017180398.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180398.mol 017180398.PUBCHEM 017180398.mol (via Jmol)
017180418.b3lyp_6-31g(d).inp

017180418.b3lyp_6-31g(d).qchem.inp (generated)

017180418.b3lyp_6-31g(d).gjf (generated)

017180418.b3lyp_6-31g(d).firefly.inp (generated)

017180418.b3lyp_6-31g(d).smash.inp (generated)

017180418.b3lyp_6-31g(d).nwchem.inp (generated) 017180418.b3lyp_6-31g(d).log.xz 017180418.td-b3lyp_6-31g+(d).inp 017180418.td-b3lyp_6-31g+(d).log.xz

017180418.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180418.td-b3lyp_6-31+g(d).gjf (generated)

017180418.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180418.mol 017180418.PUBCHEM 017180418.mol (via Jmol)
017180419.b3lyp_6-31g(d).inp

017180419.b3lyp_6-31g(d).qchem.inp (generated)

017180419.b3lyp_6-31g(d).gjf (generated)

017180419.b3lyp_6-31g(d).firefly.inp (generated)

017180419.b3lyp_6-31g(d).smash.inp (generated)

017180419.b3lyp_6-31g(d).nwchem.inp (generated) 017180419.b3lyp_6-31g(d).log.xz 017180419.td-b3lyp_6-31g+(d).inp 017180419.td-b3lyp_6-31g+(d).log.xz

017180419.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180419.td-b3lyp_6-31+g(d).gjf (generated)

017180419.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180419.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180419.mol 017180419.PUBCHEM 017180419.mol (via Jmol)
017180864.b3lyp_6-31g(d).inp

017180864.b3lyp_6-31g(d).qchem.inp (generated)

017180864.b3lyp_6-31g(d).gjf (generated)

017180864.b3lyp_6-31g(d).firefly.inp (generated)

017180864.b3lyp_6-31g(d).smash.inp (generated)

017180864.b3lyp_6-31g(d).nwchem.inp (generated) 017180864.b3lyp_6-31g(d).log.xz 017180864.td-b3lyp_6-31g+(d).inp 017180864.td-b3lyp_6-31g+(d).log.xz

017180864.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180864.td-b3lyp_6-31+g(d).gjf (generated)

017180864.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180864.mol 017180864.PUBCHEM 017180864.mol (via Jmol)
017180865.b3lyp_6-31g(d).inp

017180865.b3lyp_6-31g(d).qchem.inp (generated)

017180865.b3lyp_6-31g(d).gjf (generated)

017180865.b3lyp_6-31g(d).firefly.inp (generated)

017180865.b3lyp_6-31g(d).smash.inp (generated)

017180865.b3lyp_6-31g(d).nwchem.inp (generated) 017180865.b3lyp_6-31g(d).log.xz 017180865.td-b3lyp_6-31g+(d).inp 017180865.td-b3lyp_6-31g+(d).log.xz

017180865.td-b3lyp_6-31+g(d).qchem.inp (generated)

017180865.td-b3lyp_6-31+g(d).gjf (generated)

017180865.td-b3lyp_6-31+g(d).firefly.inp (generated)

017180865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017180865.mol 017180865.PUBCHEM 017180865.mol (via Jmol)
017181052.b3lyp_6-31g(d).inp

017181052.b3lyp_6-31g(d).qchem.inp (generated)

017181052.b3lyp_6-31g(d).gjf (generated)

017181052.b3lyp_6-31g(d).firefly.inp (generated)

017181052.b3lyp_6-31g(d).smash.inp (generated)

017181052.b3lyp_6-31g(d).nwchem.inp (generated) 017181052.b3lyp_6-31g(d).log.xz 017181052.td-b3lyp_6-31g+(d).inp 017181052.td-b3lyp_6-31g+(d).log.xz

017181052.td-b3lyp_6-31+g(d).qchem.inp (generated)

017181052.td-b3lyp_6-31+g(d).gjf (generated)

017181052.td-b3lyp_6-31+g(d).firefly.inp (generated)

017181052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017181052.mol 017181052.PUBCHEM 017181052.mol (via Jmol)
017181072.b3lyp_6-31g(d).inp

017181072.b3lyp_6-31g(d).qchem.inp (generated)

017181072.b3lyp_6-31g(d).gjf (generated)

017181072.b3lyp_6-31g(d).firefly.inp (generated)

017181072.b3lyp_6-31g(d).smash.inp (generated)

017181072.b3lyp_6-31g(d).nwchem.inp (generated) 017181072.b3lyp_6-31g(d).log.xz 017181072.td-b3lyp_6-31g+(d).inp 017181072.td-b3lyp_6-31g+(d).log.xz

017181072.td-b3lyp_6-31+g(d).qchem.inp (generated)

017181072.td-b3lyp_6-31+g(d).gjf (generated)

017181072.td-b3lyp_6-31+g(d).firefly.inp (generated)

017181072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017181072.mol 017181072.PUBCHEM 017181072.mol (via Jmol)
017181657.b3lyp_6-31g(d).inp

017181657.b3lyp_6-31g(d).qchem.inp (generated)

017181657.b3lyp_6-31g(d).gjf (generated)

017181657.b3lyp_6-31g(d).firefly.inp (generated)

017181657.b3lyp_6-31g(d).smash.inp (generated)

017181657.b3lyp_6-31g(d).nwchem.inp (generated) 017181657.b3lyp_6-31g(d).log.xz 017181657.td-b3lyp_6-31g+(d).inp 017181657.td-b3lyp_6-31g+(d).log.xz

017181657.td-b3lyp_6-31+g(d).qchem.inp (generated)

017181657.td-b3lyp_6-31+g(d).gjf (generated)

017181657.td-b3lyp_6-31+g(d).firefly.inp (generated)

017181657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017181657.mol 017181657.PUBCHEM 017181657.mol (via Jmol)
017181658.b3lyp_6-31g(d).inp

017181658.b3lyp_6-31g(d).qchem.inp (generated)

017181658.b3lyp_6-31g(d).gjf (generated)

017181658.b3lyp_6-31g(d).firefly.inp (generated)

017181658.b3lyp_6-31g(d).smash.inp (generated)

017181658.b3lyp_6-31g(d).nwchem.inp (generated) 017181658.b3lyp_6-31g(d).log.xz 017181658.td-b3lyp_6-31g+(d).inp 017181658.td-b3lyp_6-31g+(d).log.xz

017181658.td-b3lyp_6-31+g(d).qchem.inp (generated)

017181658.td-b3lyp_6-31+g(d).gjf (generated)

017181658.td-b3lyp_6-31+g(d).firefly.inp (generated)

017181658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017181658.mol 017181658.PUBCHEM 017181658.mol (via Jmol)
017182373.b3lyp_6-31g(d).inp

017182373.b3lyp_6-31g(d).qchem.inp (generated)

017182373.b3lyp_6-31g(d).gjf (generated)

017182373.b3lyp_6-31g(d).firefly.inp (generated)

017182373.b3lyp_6-31g(d).smash.inp (generated)

017182373.b3lyp_6-31g(d).nwchem.inp (generated) 017182373.b3lyp_6-31g(d).log.xz 017182373.td-b3lyp_6-31g+(d).inp 017182373.td-b3lyp_6-31g+(d).log.xz

017182373.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182373.td-b3lyp_6-31+g(d).gjf (generated)

017182373.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182373.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182373.mol 017182373.PUBCHEM 017182373.mol (via Jmol)
017182393.b3lyp_6-31g(d).inp

017182393.b3lyp_6-31g(d).qchem.inp (generated)

017182393.b3lyp_6-31g(d).gjf (generated)

017182393.b3lyp_6-31g(d).firefly.inp (generated)

017182393.b3lyp_6-31g(d).smash.inp (generated)

017182393.b3lyp_6-31g(d).nwchem.inp (generated) 017182393.b3lyp_6-31g(d).log.xz 017182393.mol 017182393.PUBCHEM 017182393.mol (via Jmol)
017182394.b3lyp_6-31g(d).inp

017182394.b3lyp_6-31g(d).qchem.inp (generated)

017182394.b3lyp_6-31g(d).gjf (generated)

017182394.b3lyp_6-31g(d).firefly.inp (generated)

017182394.b3lyp_6-31g(d).smash.inp (generated)

017182394.b3lyp_6-31g(d).nwchem.inp (generated) 017182394.b3lyp_6-31g(d).log.xz 017182394.mol 017182394.PUBCHEM 017182394.mol (via Jmol)
017182468.b3lyp_6-31g(d).inp

017182468.b3lyp_6-31g(d).qchem.inp (generated)

017182468.b3lyp_6-31g(d).gjf (generated)

017182468.b3lyp_6-31g(d).firefly.inp (generated)

017182468.b3lyp_6-31g(d).smash.inp (generated)

017182468.b3lyp_6-31g(d).nwchem.inp (generated) 017182468.b3lyp_6-31g(d).log.xz 017182468.td-b3lyp_6-31g+(d).inp 017182468.td-b3lyp_6-31g+(d).log.xz

017182468.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182468.td-b3lyp_6-31+g(d).gjf (generated)

017182468.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182468.mol 017182468.PUBCHEM 017182468.mol (via Jmol)
017182469.b3lyp_6-31g(d).inp

017182469.b3lyp_6-31g(d).qchem.inp (generated)

017182469.b3lyp_6-31g(d).gjf (generated)

017182469.b3lyp_6-31g(d).firefly.inp (generated)

017182469.b3lyp_6-31g(d).smash.inp (generated)

017182469.b3lyp_6-31g(d).nwchem.inp (generated) 017182469.b3lyp_6-31g(d).log.xz 017182469.td-b3lyp_6-31g+(d).inp 017182469.td-b3lyp_6-31g+(d).log.xz

017182469.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182469.td-b3lyp_6-31+g(d).gjf (generated)

017182469.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182469.mol 017182469.PUBCHEM 017182469.mol (via Jmol)
017182543.b3lyp_6-31g(d).inp

017182543.b3lyp_6-31g(d).qchem.inp (generated)

017182543.b3lyp_6-31g(d).gjf (generated)

017182543.b3lyp_6-31g(d).firefly.inp (generated)

017182543.b3lyp_6-31g(d).smash.inp (generated)

017182543.b3lyp_6-31g(d).nwchem.inp (generated) 017182543.b3lyp_6-31g(d).log.xz 017182543.td-b3lyp_6-31g+(d).inp 017182543.td-b3lyp_6-31g+(d).log.xz

017182543.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182543.td-b3lyp_6-31+g(d).gjf (generated)

017182543.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182543.mol 017182543.PUBCHEM 017182543.mol (via Jmol)
017182544.b3lyp_6-31g(d).inp

017182544.b3lyp_6-31g(d).qchem.inp (generated)

017182544.b3lyp_6-31g(d).gjf (generated)

017182544.b3lyp_6-31g(d).firefly.inp (generated)

017182544.b3lyp_6-31g(d).smash.inp (generated)

017182544.b3lyp_6-31g(d).nwchem.inp (generated) 017182544.b3lyp_6-31g(d).log.xz 017182544.td-b3lyp_6-31g+(d).inp 017182544.td-b3lyp_6-31g+(d).log.xz

017182544.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182544.td-b3lyp_6-31+g(d).gjf (generated)

017182544.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182544.mol 017182544.PUBCHEM 017182544.mol (via Jmol)
017182591.b3lyp_6-31g(d).inp

017182591.b3lyp_6-31g(d).qchem.inp (generated)

017182591.b3lyp_6-31g(d).gjf (generated)

017182591.b3lyp_6-31g(d).firefly.inp (generated)

017182591.b3lyp_6-31g(d).smash.inp (generated)

017182591.b3lyp_6-31g(d).nwchem.inp (generated) 017182591.b3lyp_6-31g(d).log.xz 017182591.td-b3lyp_6-31g+(d).inp 017182591.td-b3lyp_6-31g+(d).log.xz

017182591.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182591.td-b3lyp_6-31+g(d).gjf (generated)

017182591.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182591.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182591.mol 017182591.PUBCHEM 017182591.mol (via Jmol)
017182592.b3lyp_6-31g(d).inp

017182592.b3lyp_6-31g(d).qchem.inp (generated)

017182592.b3lyp_6-31g(d).gjf (generated)

017182592.b3lyp_6-31g(d).firefly.inp (generated)

017182592.b3lyp_6-31g(d).smash.inp (generated)

017182592.b3lyp_6-31g(d).nwchem.inp (generated) 017182592.b3lyp_6-31g(d).log.xz 017182592.mol 017182592.PUBCHEM 017182592.mol (via Jmol)
017182606.b3lyp_6-31g(d).inp

017182606.b3lyp_6-31g(d).qchem.inp (generated)

017182606.b3lyp_6-31g(d).gjf (generated)

017182606.b3lyp_6-31g(d).firefly.inp (generated)

017182606.b3lyp_6-31g(d).smash.inp (generated)

017182606.b3lyp_6-31g(d).nwchem.inp (generated) 017182606.b3lyp_6-31g(d).log.xz 017182606.td-b3lyp_6-31g+(d).inp 017182606.td-b3lyp_6-31g+(d).log.xz

017182606.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182606.td-b3lyp_6-31+g(d).gjf (generated)

017182606.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182606.mol 017182606.PUBCHEM 017182606.mol (via Jmol)
017182608.b3lyp_6-31g(d).inp

017182608.b3lyp_6-31g(d).qchem.inp (generated)

017182608.b3lyp_6-31g(d).gjf (generated)

017182608.b3lyp_6-31g(d).firefly.inp (generated)

017182608.b3lyp_6-31g(d).smash.inp (generated)

017182608.b3lyp_6-31g(d).nwchem.inp (generated) 017182608.b3lyp_6-31g(d).log.xz 017182608.td-b3lyp_6-31g+(d).inp 017182608.td-b3lyp_6-31g+(d).log.xz

017182608.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182608.td-b3lyp_6-31+g(d).gjf (generated)

017182608.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182608.mol 017182608.PUBCHEM 017182608.mol (via Jmol)
017182666.b3lyp_6-31g(d).inp

017182666.b3lyp_6-31g(d).qchem.inp (generated)

017182666.b3lyp_6-31g(d).gjf (generated)

017182666.b3lyp_6-31g(d).firefly.inp (generated)

017182666.b3lyp_6-31g(d).smash.inp (generated)

017182666.b3lyp_6-31g(d).nwchem.inp (generated) 017182666.b3lyp_6-31g(d).log.xz 017182666.td-b3lyp_6-31g+(d).inp 017182666.td-b3lyp_6-31g+(d).log.xz

017182666.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182666.td-b3lyp_6-31+g(d).gjf (generated)

017182666.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182666.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182666.mol 017182666.PUBCHEM 017182666.mol (via Jmol)
017182667.b3lyp_6-31g(d).inp

017182667.b3lyp_6-31g(d).qchem.inp (generated)

017182667.b3lyp_6-31g(d).gjf (generated)

017182667.b3lyp_6-31g(d).firefly.inp (generated)

017182667.b3lyp_6-31g(d).smash.inp (generated)

017182667.b3lyp_6-31g(d).nwchem.inp (generated) 017182667.b3lyp_6-31g(d).log.xz 017182667.mol 017182667.PUBCHEM 017182667.mol (via Jmol)
017182681.b3lyp_6-31g(d).inp

017182681.b3lyp_6-31g(d).qchem.inp (generated)

017182681.b3lyp_6-31g(d).gjf (generated)

017182681.b3lyp_6-31g(d).firefly.inp (generated)

017182681.b3lyp_6-31g(d).smash.inp (generated)

017182681.b3lyp_6-31g(d).nwchem.inp (generated) 017182681.b3lyp_6-31g(d).log.xz 017182681.td-b3lyp_6-31g+(d).inp 017182681.td-b3lyp_6-31g+(d).log.xz

017182681.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182681.td-b3lyp_6-31+g(d).gjf (generated)

017182681.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182681.mol 017182681.PUBCHEM 017182681.mol (via Jmol)
017182683.b3lyp_6-31g(d).inp

017182683.b3lyp_6-31g(d).qchem.inp (generated)

017182683.b3lyp_6-31g(d).gjf (generated)

017182683.b3lyp_6-31g(d).firefly.inp (generated)

017182683.b3lyp_6-31g(d).smash.inp (generated)

017182683.b3lyp_6-31g(d).nwchem.inp (generated) 017182683.b3lyp_6-31g(d).log.xz 017182683.td-b3lyp_6-31g+(d).inp 017182683.td-b3lyp_6-31g+(d).log.xz

017182683.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182683.td-b3lyp_6-31+g(d).gjf (generated)

017182683.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182683.mol 017182683.PUBCHEM 017182683.mol (via Jmol)
017182687.b3lyp_6-31g(d).inp

017182687.b3lyp_6-31g(d).qchem.inp (generated)

017182687.b3lyp_6-31g(d).gjf (generated)

017182687.b3lyp_6-31g(d).firefly.inp (generated)

017182687.b3lyp_6-31g(d).smash.inp (generated)

017182687.b3lyp_6-31g(d).nwchem.inp (generated) 017182687.b3lyp_6-31g(d).log.xz 017182687.td-b3lyp_6-31g+(d).inp 017182687.td-b3lyp_6-31g+(d).log.xz

017182687.td-b3lyp_6-31+g(d).qchem.inp (generated)

017182687.td-b3lyp_6-31+g(d).gjf (generated)

017182687.td-b3lyp_6-31+g(d).firefly.inp (generated)

017182687.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017182687.mol 017182687.PUBCHEM 017182687.mol (via Jmol)
017183111.b3lyp_6-31g(d).inp

017183111.b3lyp_6-31g(d).qchem.inp (generated)

017183111.b3lyp_6-31g(d).gjf (generated)

017183111.b3lyp_6-31g(d).firefly.inp (generated)

017183111.b3lyp_6-31g(d).smash.inp (generated)

017183111.b3lyp_6-31g(d).nwchem.inp (generated) 017183111.b3lyp_6-31g(d).log.xz 017183111.td-b3lyp_6-31g+(d).inp 017183111.td-b3lyp_6-31g+(d).log.xz

017183111.td-b3lyp_6-31+g(d).qchem.inp (generated)

017183111.td-b3lyp_6-31+g(d).gjf (generated)

017183111.td-b3lyp_6-31+g(d).firefly.inp (generated)

017183111.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017183111.mol 017183111.PUBCHEM 017183111.mol (via Jmol)
017185500.b3lyp_6-31g(d).inp

017185500.b3lyp_6-31g(d).qchem.inp (generated)

017185500.b3lyp_6-31g(d).gjf (generated)

017185500.b3lyp_6-31g(d).firefly.inp (generated)

017185500.b3lyp_6-31g(d).smash.inp (generated)

017185500.b3lyp_6-31g(d).nwchem.inp (generated) 017185500.b3lyp_6-31g(d).log.xz 017185500.td-b3lyp_6-31g+(d).inp 017185500.td-b3lyp_6-31g+(d).log.xz

017185500.td-b3lyp_6-31+g(d).qchem.inp (generated)

017185500.td-b3lyp_6-31+g(d).gjf (generated)

017185500.td-b3lyp_6-31+g(d).firefly.inp (generated)

017185500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017185500.mol 017185500.PUBCHEM 017185500.mol (via Jmol)
017186007.b3lyp_6-31g(d).inp

017186007.b3lyp_6-31g(d).qchem.inp (generated)

017186007.b3lyp_6-31g(d).gjf (generated)

017186007.b3lyp_6-31g(d).firefly.inp (generated)

017186007.b3lyp_6-31g(d).smash.inp (generated)

017186007.b3lyp_6-31g(d).nwchem.inp (generated) 017186007.b3lyp_6-31g(d).log.xz 017186007.td-b3lyp_6-31g+(d).inp 017186007.td-b3lyp_6-31g+(d).log.xz

017186007.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186007.td-b3lyp_6-31+g(d).gjf (generated)

017186007.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186007.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186007.mol 017186007.PUBCHEM 017186007.mol (via Jmol)
017186008.b3lyp_6-31g(d).inp

017186008.b3lyp_6-31g(d).qchem.inp (generated)

017186008.b3lyp_6-31g(d).gjf (generated)

017186008.b3lyp_6-31g(d).firefly.inp (generated)

017186008.b3lyp_6-31g(d).smash.inp (generated)

017186008.b3lyp_6-31g(d).nwchem.inp (generated) 017186008.b3lyp_6-31g(d).log.xz 017186008.td-b3lyp_6-31g+(d).inp 017186008.td-b3lyp_6-31g+(d).log.xz

017186008.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186008.td-b3lyp_6-31+g(d).gjf (generated)

017186008.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186008.mol 017186008.PUBCHEM 017186008.mol (via Jmol)
017186016.b3lyp_6-31g(d).inp

017186016.b3lyp_6-31g(d).qchem.inp (generated)

017186016.b3lyp_6-31g(d).gjf (generated)

017186016.b3lyp_6-31g(d).firefly.inp (generated)

017186016.b3lyp_6-31g(d).smash.inp (generated)

017186016.b3lyp_6-31g(d).nwchem.inp (generated) 017186016.b3lyp_6-31g(d).log.xz 017186016.td-b3lyp_6-31g+(d).inp 017186016.td-b3lyp_6-31g+(d).log.xz

017186016.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186016.td-b3lyp_6-31+g(d).gjf (generated)

017186016.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186016.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186016.mol 017186016.PUBCHEM 017186016.mol (via Jmol)
017186039.b3lyp_6-31g(d).inp

017186039.b3lyp_6-31g(d).qchem.inp (generated)

017186039.b3lyp_6-31g(d).gjf (generated)

017186039.b3lyp_6-31g(d).firefly.inp (generated)

017186039.b3lyp_6-31g(d).smash.inp (generated)

017186039.b3lyp_6-31g(d).nwchem.inp (generated) 017186039.b3lyp_6-31g(d).log.xz 017186039.td-b3lyp_6-31g+(d).inp 017186039.td-b3lyp_6-31g+(d).log.xz

017186039.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186039.td-b3lyp_6-31+g(d).gjf (generated)

017186039.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186039.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186039.mol 017186039.PUBCHEM 017186039.mol (via Jmol)
017186040.b3lyp_6-31g(d).inp

017186040.b3lyp_6-31g(d).qchem.inp (generated)

017186040.b3lyp_6-31g(d).gjf (generated)

017186040.b3lyp_6-31g(d).firefly.inp (generated)

017186040.b3lyp_6-31g(d).smash.inp (generated)

017186040.b3lyp_6-31g(d).nwchem.inp (generated) 017186040.b3lyp_6-31g(d).log.xz 017186040.td-b3lyp_6-31g+(d).inp 017186040.td-b3lyp_6-31g+(d).log.xz

017186040.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186040.td-b3lyp_6-31+g(d).gjf (generated)

017186040.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186040.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186040.mol 017186040.PUBCHEM 017186040.mol (via Jmol)
017186043.b3lyp_6-31g(d).inp

017186043.b3lyp_6-31g(d).qchem.inp (generated)

017186043.b3lyp_6-31g(d).gjf (generated)

017186043.b3lyp_6-31g(d).firefly.inp (generated)

017186043.b3lyp_6-31g(d).smash.inp (generated)

017186043.b3lyp_6-31g(d).nwchem.inp (generated) 017186043.b3lyp_6-31g(d).log.xz 017186043.mol 017186043.PUBCHEM 017186043.mol (via Jmol)
017186052.b3lyp_6-31g(d).inp

017186052.b3lyp_6-31g(d).qchem.inp (generated)

017186052.b3lyp_6-31g(d).gjf (generated)

017186052.b3lyp_6-31g(d).firefly.inp (generated)

017186052.b3lyp_6-31g(d).smash.inp (generated)

017186052.b3lyp_6-31g(d).nwchem.inp (generated) 017186052.b3lyp_6-31g(d).log.xz 017186052.td-b3lyp_6-31g+(d).inp 017186052.td-b3lyp_6-31g+(d).log.xz

017186052.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186052.td-b3lyp_6-31+g(d).gjf (generated)

017186052.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186052.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186052.mol 017186052.PUBCHEM 017186052.mol (via Jmol)
017186056.b3lyp_6-31g(d).inp

017186056.b3lyp_6-31g(d).qchem.inp (generated)

017186056.b3lyp_6-31g(d).gjf (generated)

017186056.b3lyp_6-31g(d).firefly.inp (generated)

017186056.b3lyp_6-31g(d).smash.inp (generated)

017186056.b3lyp_6-31g(d).nwchem.inp (generated) 017186056.b3lyp_6-31g(d).log.xz 017186056.td-b3lyp_6-31g+(d).inp 017186056.td-b3lyp_6-31g+(d).log.xz

017186056.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186056.td-b3lyp_6-31+g(d).gjf (generated)

017186056.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186056.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186056.mol 017186056.PUBCHEM 017186056.mol (via Jmol)
017186391.b3lyp_6-31g(d).inp

017186391.b3lyp_6-31g(d).qchem.inp (generated)

017186391.b3lyp_6-31g(d).gjf (generated)

017186391.b3lyp_6-31g(d).firefly.inp (generated)

017186391.b3lyp_6-31g(d).smash.inp (generated)

017186391.b3lyp_6-31g(d).nwchem.inp (generated) 017186391.b3lyp_6-31g(d).log.xz 017186391.td-b3lyp_6-31g+(d).inp 017186391.td-b3lyp_6-31g+(d).log.xz

017186391.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186391.td-b3lyp_6-31+g(d).gjf (generated)

017186391.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186391.mol 017186391.PUBCHEM 017186391.mol (via Jmol)
017186460.b3lyp_6-31g(d).inp

017186460.b3lyp_6-31g(d).qchem.inp (generated)

017186460.b3lyp_6-31g(d).gjf (generated)

017186460.b3lyp_6-31g(d).firefly.inp (generated)

017186460.b3lyp_6-31g(d).smash.inp (generated)

017186460.b3lyp_6-31g(d).nwchem.inp (generated) 017186460.b3lyp_6-31g(d).log.xz 017186460.mol 017186460.PUBCHEM 017186460.mol (via Jmol)
017186501.b3lyp_6-31g(d).inp

017186501.b3lyp_6-31g(d).qchem.inp (generated)

017186501.b3lyp_6-31g(d).gjf (generated)

017186501.b3lyp_6-31g(d).firefly.inp (generated)

017186501.b3lyp_6-31g(d).smash.inp (generated)

017186501.b3lyp_6-31g(d).nwchem.inp (generated) 017186501.b3lyp_6-31g(d).log.xz 017186501.td-b3lyp_6-31g+(d).inp 017186501.td-b3lyp_6-31g+(d).log.xz

017186501.td-b3lyp_6-31+g(d).qchem.inp (generated)

017186501.td-b3lyp_6-31+g(d).gjf (generated)

017186501.td-b3lyp_6-31+g(d).firefly.inp (generated)

017186501.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017186501.mol 017186501.PUBCHEM 017186501.mol (via Jmol)
017187538.b3lyp_6-31g(d).inp

017187538.b3lyp_6-31g(d).qchem.inp (generated)

017187538.b3lyp_6-31g(d).gjf (generated)

017187538.b3lyp_6-31g(d).firefly.inp (generated)

017187538.b3lyp_6-31g(d).smash.inp (generated)

017187538.b3lyp_6-31g(d).nwchem.inp (generated) 017187538.b3lyp_6-31g(d).log.xz 017187538.td-b3lyp_6-31g+(d).inp 017187538.td-b3lyp_6-31g+(d).log.xz

017187538.td-b3lyp_6-31+g(d).qchem.inp (generated)

017187538.td-b3lyp_6-31+g(d).gjf (generated)

017187538.td-b3lyp_6-31+g(d).firefly.inp (generated)

017187538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017187538.mol 017187538.PUBCHEM 017187538.mol (via Jmol)
017187874.b3lyp_6-31g(d).inp

017187874.b3lyp_6-31g(d).qchem.inp (generated)

017187874.b3lyp_6-31g(d).gjf (generated)

017187874.b3lyp_6-31g(d).firefly.inp (generated)

017187874.b3lyp_6-31g(d).smash.inp (generated)

017187874.b3lyp_6-31g(d).nwchem.inp (generated) 017187874.b3lyp_6-31g(d).log.xz 017187874.td-b3lyp_6-31g+(d).inp 017187874.td-b3lyp_6-31g+(d).log.xz

017187874.td-b3lyp_6-31+g(d).qchem.inp (generated)

017187874.td-b3lyp_6-31+g(d).gjf (generated)

017187874.td-b3lyp_6-31+g(d).firefly.inp (generated)

017187874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017187874.mol 017187874.PUBCHEM 017187874.mol (via Jmol)
017187876.b3lyp_6-31g(d).inp

017187876.b3lyp_6-31g(d).qchem.inp (generated)

017187876.b3lyp_6-31g(d).gjf (generated)

017187876.b3lyp_6-31g(d).firefly.inp (generated)

017187876.b3lyp_6-31g(d).smash.inp (generated)

017187876.b3lyp_6-31g(d).nwchem.inp (generated) 017187876.b3lyp_6-31g(d).log.xz 017187876.td-b3lyp_6-31g+(d).inp 017187876.td-b3lyp_6-31g+(d).log.xz

017187876.td-b3lyp_6-31+g(d).qchem.inp (generated)

017187876.td-b3lyp_6-31+g(d).gjf (generated)

017187876.td-b3lyp_6-31+g(d).firefly.inp (generated)

017187876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017187876.mol 017187876.PUBCHEM 017187876.mol (via Jmol)
017187894.b3lyp_6-31g(d).inp

017187894.b3lyp_6-31g(d).qchem.inp (generated)

017187894.b3lyp_6-31g(d).gjf (generated)

017187894.b3lyp_6-31g(d).firefly.inp (generated)

017187894.b3lyp_6-31g(d).smash.inp (generated)

017187894.b3lyp_6-31g(d).nwchem.inp (generated) 017187894.b3lyp_6-31g(d).log.xz 017187894.td-b3lyp_6-31g+(d).inp 017187894.td-b3lyp_6-31g+(d).log.xz

017187894.td-b3lyp_6-31+g(d).qchem.inp (generated)

017187894.td-b3lyp_6-31+g(d).gjf (generated)

017187894.td-b3lyp_6-31+g(d).firefly.inp (generated)

017187894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017187894.mol 017187894.PUBCHEM 017187894.mol (via Jmol)
017188249.b3lyp_6-31g(d).inp

017188249.b3lyp_6-31g(d).qchem.inp (generated)

017188249.b3lyp_6-31g(d).gjf (generated)

017188249.b3lyp_6-31g(d).firefly.inp (generated)

017188249.b3lyp_6-31g(d).smash.inp (generated)

017188249.b3lyp_6-31g(d).nwchem.inp (generated) 017188249.b3lyp_6-31g(d).log.xz 017188249.mol 017188249.PUBCHEM 017188249.mol (via Jmol)
017188364.b3lyp_6-31g(d).inp

017188364.b3lyp_6-31g(d).qchem.inp (generated)

017188364.b3lyp_6-31g(d).gjf (generated)

017188364.b3lyp_6-31g(d).firefly.inp (generated)

017188364.b3lyp_6-31g(d).smash.inp (generated)

017188364.b3lyp_6-31g(d).nwchem.inp (generated) 017188364.b3lyp_6-31g(d).log.xz 017188364.td-b3lyp_6-31g+(d).inp 017188364.td-b3lyp_6-31g+(d).log.xz

017188364.td-b3lyp_6-31+g(d).qchem.inp (generated)

017188364.td-b3lyp_6-31+g(d).gjf (generated)

017188364.td-b3lyp_6-31+g(d).firefly.inp (generated)

017188364.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017188364.mol 017188364.PUBCHEM 017188364.mol (via Jmol)
017190092.b3lyp_6-31g(d).inp

017190092.b3lyp_6-31g(d).qchem.inp (generated)

017190092.b3lyp_6-31g(d).gjf (generated)

017190092.b3lyp_6-31g(d).firefly.inp (generated)

017190092.b3lyp_6-31g(d).smash.inp (generated)

017190092.b3lyp_6-31g(d).nwchem.inp (generated) 017190092.b3lyp_6-31g(d).log.xz 017190092.td-b3lyp_6-31g+(d).inp 017190092.td-b3lyp_6-31g+(d).log.xz

017190092.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190092.td-b3lyp_6-31+g(d).gjf (generated)

017190092.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190092.mol 017190092.PUBCHEM 017190092.mol (via Jmol)
017190093.b3lyp_6-31g(d).inp

017190093.b3lyp_6-31g(d).qchem.inp (generated)

017190093.b3lyp_6-31g(d).gjf (generated)

017190093.b3lyp_6-31g(d).firefly.inp (generated)

017190093.b3lyp_6-31g(d).smash.inp (generated)

017190093.b3lyp_6-31g(d).nwchem.inp (generated) 017190093.b3lyp_6-31g(d).log.xz 017190093.td-b3lyp_6-31g+(d).inp 017190093.td-b3lyp_6-31g+(d).log.xz

017190093.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190093.td-b3lyp_6-31+g(d).gjf (generated)

017190093.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190093.mol 017190093.PUBCHEM 017190093.mol (via Jmol)
017190098.b3lyp_6-31g(d).inp

017190098.b3lyp_6-31g(d).qchem.inp (generated)

017190098.b3lyp_6-31g(d).gjf (generated)

017190098.b3lyp_6-31g(d).firefly.inp (generated)

017190098.b3lyp_6-31g(d).smash.inp (generated)

017190098.b3lyp_6-31g(d).nwchem.inp (generated) 017190098.b3lyp_6-31g(d).log.xz 017190098.td-b3lyp_6-31g+(d).inp 017190098.td-b3lyp_6-31g+(d).log.xz

017190098.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190098.td-b3lyp_6-31+g(d).gjf (generated)

017190098.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190098.mol 017190098.PUBCHEM 017190098.mol (via Jmol)
017190107.b3lyp_6-31g(d).inp

017190107.b3lyp_6-31g(d).qchem.inp (generated)

017190107.b3lyp_6-31g(d).gjf (generated)

017190107.b3lyp_6-31g(d).firefly.inp (generated)

017190107.b3lyp_6-31g(d).smash.inp (generated)

017190107.b3lyp_6-31g(d).nwchem.inp (generated) 017190107.b3lyp_6-31g(d).log.xz 017190107.td-b3lyp_6-31g+(d).inp 017190107.td-b3lyp_6-31g+(d).log.xz

017190107.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190107.td-b3lyp_6-31+g(d).gjf (generated)

017190107.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190107.mol 017190107.PUBCHEM 017190107.mol (via Jmol)
017190140.b3lyp_6-31g(d).inp

017190140.b3lyp_6-31g(d).qchem.inp (generated)

017190140.b3lyp_6-31g(d).gjf (generated)

017190140.b3lyp_6-31g(d).firefly.inp (generated)

017190140.b3lyp_6-31g(d).smash.inp (generated)

017190140.b3lyp_6-31g(d).nwchem.inp (generated) 017190140.b3lyp_6-31g(d).log.xz 017190140.td-b3lyp_6-31g+(d).inp 017190140.td-b3lyp_6-31g+(d).log.xz

017190140.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190140.td-b3lyp_6-31+g(d).gjf (generated)

017190140.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190140.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190140.mol 017190140.PUBCHEM 017190140.mol (via Jmol)
017190142.b3lyp_6-31g(d).inp

017190142.b3lyp_6-31g(d).qchem.inp (generated)

017190142.b3lyp_6-31g(d).gjf (generated)

017190142.b3lyp_6-31g(d).firefly.inp (generated)

017190142.b3lyp_6-31g(d).smash.inp (generated)

017190142.b3lyp_6-31g(d).nwchem.inp (generated) 017190142.b3lyp_6-31g(d).log.xz 017190142.td-b3lyp_6-31g+(d).inp 017190142.td-b3lyp_6-31g+(d).log.xz

017190142.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190142.td-b3lyp_6-31+g(d).gjf (generated)

017190142.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190142.mol 017190142.PUBCHEM 017190142.mol (via Jmol)
017190145.b3lyp_6-31g(d).inp

017190145.b3lyp_6-31g(d).qchem.inp (generated)

017190145.b3lyp_6-31g(d).gjf (generated)

017190145.b3lyp_6-31g(d).firefly.inp (generated)

017190145.b3lyp_6-31g(d).smash.inp (generated)

017190145.b3lyp_6-31g(d).nwchem.inp (generated) 017190145.b3lyp_6-31g(d).log.xz 017190145.td-b3lyp_6-31g+(d).inp 017190145.td-b3lyp_6-31g+(d).log.xz

017190145.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190145.td-b3lyp_6-31+g(d).gjf (generated)

017190145.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190145.mol 017190145.PUBCHEM 017190145.mol (via Jmol)
017190155.b3lyp_6-31g(d).inp

017190155.b3lyp_6-31g(d).qchem.inp (generated)

017190155.b3lyp_6-31g(d).gjf (generated)

017190155.b3lyp_6-31g(d).firefly.inp (generated)

017190155.b3lyp_6-31g(d).smash.inp (generated)

017190155.b3lyp_6-31g(d).nwchem.inp (generated) 017190155.b3lyp_6-31g(d).log.xz 017190155.td-b3lyp_6-31g+(d).inp 017190155.td-b3lyp_6-31g+(d).log.xz

017190155.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190155.td-b3lyp_6-31+g(d).gjf (generated)

017190155.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190155.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190155.mol 017190155.PUBCHEM 017190155.mol (via Jmol)
017190157.b3lyp_6-31g(d).inp

017190157.b3lyp_6-31g(d).qchem.inp (generated)

017190157.b3lyp_6-31g(d).gjf (generated)

017190157.b3lyp_6-31g(d).firefly.inp (generated)

017190157.b3lyp_6-31g(d).smash.inp (generated)

017190157.b3lyp_6-31g(d).nwchem.inp (generated) 017190157.b3lyp_6-31g(d).log.xz 017190157.td-b3lyp_6-31g+(d).inp 017190157.td-b3lyp_6-31g+(d).log.xz

017190157.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190157.td-b3lyp_6-31+g(d).gjf (generated)

017190157.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190157.mol 017190157.PUBCHEM 017190157.mol (via Jmol)
017190159.b3lyp_6-31g(d).inp

017190159.b3lyp_6-31g(d).qchem.inp (generated)

017190159.b3lyp_6-31g(d).gjf (generated)

017190159.b3lyp_6-31g(d).firefly.inp (generated)

017190159.b3lyp_6-31g(d).smash.inp (generated)

017190159.b3lyp_6-31g(d).nwchem.inp (generated) 017190159.b3lyp_6-31g(d).log.xz 017190159.td-b3lyp_6-31g+(d).inp 017190159.td-b3lyp_6-31g+(d).log.xz

017190159.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190159.td-b3lyp_6-31+g(d).gjf (generated)

017190159.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190159.mol 017190159.PUBCHEM 017190159.mol (via Jmol)
017190164.b3lyp_6-31g(d).inp

017190164.b3lyp_6-31g(d).qchem.inp (generated)

017190164.b3lyp_6-31g(d).gjf (generated)

017190164.b3lyp_6-31g(d).firefly.inp (generated)

017190164.b3lyp_6-31g(d).smash.inp (generated)

017190164.b3lyp_6-31g(d).nwchem.inp (generated) 017190164.b3lyp_6-31g(d).log.xz 017190164.td-b3lyp_6-31g+(d).inp 017190164.td-b3lyp_6-31g+(d).log.xz

017190164.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190164.td-b3lyp_6-31+g(d).gjf (generated)

017190164.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190164.mol 017190164.PUBCHEM 017190164.mol (via Jmol)
017190166.b3lyp_6-31g(d).inp

017190166.b3lyp_6-31g(d).qchem.inp (generated)

017190166.b3lyp_6-31g(d).gjf (generated)

017190166.b3lyp_6-31g(d).firefly.inp (generated)

017190166.b3lyp_6-31g(d).smash.inp (generated)

017190166.b3lyp_6-31g(d).nwchem.inp (generated) 017190166.b3lyp_6-31g(d).log.xz 017190166.td-b3lyp_6-31g+(d).inp 017190166.td-b3lyp_6-31g+(d).log.xz

017190166.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190166.td-b3lyp_6-31+g(d).gjf (generated)

017190166.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190166.mol 017190166.PUBCHEM 017190166.mol (via Jmol)
017190168.b3lyp_6-31g(d).inp

017190168.b3lyp_6-31g(d).qchem.inp (generated)

017190168.b3lyp_6-31g(d).gjf (generated)

017190168.b3lyp_6-31g(d).firefly.inp (generated)

017190168.b3lyp_6-31g(d).smash.inp (generated)

017190168.b3lyp_6-31g(d).nwchem.inp (generated) 017190168.b3lyp_6-31g(d).log.xz 017190168.td-b3lyp_6-31g+(d).inp 017190168.td-b3lyp_6-31g+(d).log.xz

017190168.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190168.td-b3lyp_6-31+g(d).gjf (generated)

017190168.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190168.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190168.mol 017190168.PUBCHEM 017190168.mol (via Jmol)
017190173.b3lyp_6-31g(d).inp

017190173.b3lyp_6-31g(d).qchem.inp (generated)

017190173.b3lyp_6-31g(d).gjf (generated)

017190173.b3lyp_6-31g(d).firefly.inp (generated)

017190173.b3lyp_6-31g(d).smash.inp (generated)

017190173.b3lyp_6-31g(d).nwchem.inp (generated) 017190173.b3lyp_6-31g(d).log.xz 017190173.td-b3lyp_6-31g+(d).inp 017190173.td-b3lyp_6-31g+(d).log.xz

017190173.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190173.td-b3lyp_6-31+g(d).gjf (generated)

017190173.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190173.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190173.mol 017190173.PUBCHEM 017190173.mol (via Jmol)
017190330.b3lyp_6-31g(d).inp

017190330.b3lyp_6-31g(d).qchem.inp (generated)

017190330.b3lyp_6-31g(d).gjf (generated)

017190330.b3lyp_6-31g(d).firefly.inp (generated)

017190330.b3lyp_6-31g(d).smash.inp (generated)

017190330.b3lyp_6-31g(d).nwchem.inp (generated) 017190330.b3lyp_6-31g(d).log.xz 017190330.td-b3lyp_6-31g+(d).inp 017190330.td-b3lyp_6-31g+(d).log.xz

017190330.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190330.td-b3lyp_6-31+g(d).gjf (generated)

017190330.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190330.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190330.mol 017190330.PUBCHEM 017190330.mol (via Jmol)
017190432.b3lyp_6-31g(d).inp

017190432.b3lyp_6-31g(d).qchem.inp (generated)

017190432.b3lyp_6-31g(d).gjf (generated)

017190432.b3lyp_6-31g(d).firefly.inp (generated)

017190432.b3lyp_6-31g(d).smash.inp (generated)

017190432.b3lyp_6-31g(d).nwchem.inp (generated) 017190432.b3lyp_6-31g(d).log.xz 017190432.td-b3lyp_6-31g+(d).inp 017190432.td-b3lyp_6-31g+(d).log.xz

017190432.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190432.td-b3lyp_6-31+g(d).gjf (generated)

017190432.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190432.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190432.mol 017190432.PUBCHEM 017190432.mol (via Jmol)
017190481.b3lyp_6-31g(d).inp

017190481.b3lyp_6-31g(d).qchem.inp (generated)

017190481.b3lyp_6-31g(d).gjf (generated)

017190481.b3lyp_6-31g(d).firefly.inp (generated)

017190481.b3lyp_6-31g(d).smash.inp (generated)

017190481.b3lyp_6-31g(d).nwchem.inp (generated) 017190481.b3lyp_6-31g(d).log.xz 017190481.td-b3lyp_6-31g+(d).inp 017190481.td-b3lyp_6-31g+(d).log.xz

017190481.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190481.td-b3lyp_6-31+g(d).gjf (generated)

017190481.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190481.mol 017190481.PUBCHEM 017190481.mol (via Jmol)
017190641.b3lyp_6-31g(d).inp

017190641.b3lyp_6-31g(d).qchem.inp (generated)

017190641.b3lyp_6-31g(d).gjf (generated)

017190641.b3lyp_6-31g(d).firefly.inp (generated)

017190641.b3lyp_6-31g(d).smash.inp (generated)

017190641.b3lyp_6-31g(d).nwchem.inp (generated) 017190641.b3lyp_6-31g(d).log.xz 017190641.mol 017190641.PUBCHEM 017190641.mol (via Jmol)
017190663.b3lyp_6-31g(d).inp

017190663.b3lyp_6-31g(d).qchem.inp (generated)

017190663.b3lyp_6-31g(d).gjf (generated)

017190663.b3lyp_6-31g(d).firefly.inp (generated)

017190663.b3lyp_6-31g(d).smash.inp (generated)

017190663.b3lyp_6-31g(d).nwchem.inp (generated) 017190663.b3lyp_6-31g(d).log.xz 017190663.td-b3lyp_6-31g+(d).inp 017190663.td-b3lyp_6-31g+(d).log.xz

017190663.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190663.td-b3lyp_6-31+g(d).gjf (generated)

017190663.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190663.mol 017190663.PUBCHEM 017190663.mol (via Jmol)
017190669.b3lyp_6-31g(d).inp

017190669.b3lyp_6-31g(d).qchem.inp (generated)

017190669.b3lyp_6-31g(d).gjf (generated)

017190669.b3lyp_6-31g(d).firefly.inp (generated)

017190669.b3lyp_6-31g(d).smash.inp (generated)

017190669.b3lyp_6-31g(d).nwchem.inp (generated) 017190669.b3lyp_6-31g(d).log.xz 017190669.td-b3lyp_6-31g+(d).inp 017190669.td-b3lyp_6-31g+(d).log.xz

017190669.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190669.td-b3lyp_6-31+g(d).gjf (generated)

017190669.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190669.mol 017190669.PUBCHEM 017190669.mol (via Jmol)
017190759.b3lyp_6-31g(d).inp

017190759.b3lyp_6-31g(d).qchem.inp (generated)

017190759.b3lyp_6-31g(d).gjf (generated)

017190759.b3lyp_6-31g(d).firefly.inp (generated)

017190759.b3lyp_6-31g(d).smash.inp (generated)

017190759.b3lyp_6-31g(d).nwchem.inp (generated) 017190759.b3lyp_6-31g(d).log.xz 017190759.td-b3lyp_6-31g+(d).inp 017190759.td-b3lyp_6-31g+(d).log.xz

017190759.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190759.td-b3lyp_6-31+g(d).gjf (generated)

017190759.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190759.mol 017190759.PUBCHEM 017190759.mol (via Jmol)
017190840.b3lyp_6-31g(d).inp

017190840.b3lyp_6-31g(d).qchem.inp (generated)

017190840.b3lyp_6-31g(d).gjf (generated)

017190840.b3lyp_6-31g(d).firefly.inp (generated)

017190840.b3lyp_6-31g(d).smash.inp (generated)

017190840.b3lyp_6-31g(d).nwchem.inp (generated) 017190840.b3lyp_6-31g(d).log.xz 017190840.td-b3lyp_6-31g+(d).inp 017190840.td-b3lyp_6-31g+(d).log.xz

017190840.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190840.td-b3lyp_6-31+g(d).gjf (generated)

017190840.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190840.mol 017190840.PUBCHEM 017190840.mol (via Jmol)
017190844.b3lyp_6-31g(d).inp

017190844.b3lyp_6-31g(d).qchem.inp (generated)

017190844.b3lyp_6-31g(d).gjf (generated)

017190844.b3lyp_6-31g(d).firefly.inp (generated)

017190844.b3lyp_6-31g(d).smash.inp (generated)

017190844.b3lyp_6-31g(d).nwchem.inp (generated) 017190844.b3lyp_6-31g(d).log.xz 017190844.mol 017190844.PUBCHEM 017190844.mol (via Jmol)
017190847.b3lyp_6-31g(d).inp

017190847.b3lyp_6-31g(d).qchem.inp (generated)

017190847.b3lyp_6-31g(d).gjf (generated)

017190847.b3lyp_6-31g(d).firefly.inp (generated)

017190847.b3lyp_6-31g(d).smash.inp (generated)

017190847.b3lyp_6-31g(d).nwchem.inp (generated) 017190847.b3lyp_6-31g(d).log.xz 017190847.td-b3lyp_6-31g+(d).inp 017190847.td-b3lyp_6-31g+(d).log.xz

017190847.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190847.td-b3lyp_6-31+g(d).gjf (generated)

017190847.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190847.mol 017190847.PUBCHEM 017190847.mol (via Jmol)
017190848.b3lyp_6-31g(d).inp

017190848.b3lyp_6-31g(d).qchem.inp (generated)

017190848.b3lyp_6-31g(d).gjf (generated)

017190848.b3lyp_6-31g(d).firefly.inp (generated)

017190848.b3lyp_6-31g(d).smash.inp (generated)

017190848.b3lyp_6-31g(d).nwchem.inp (generated) 017190848.b3lyp_6-31g(d).log.xz 017190848.td-b3lyp_6-31g+(d).inp 017190848.td-b3lyp_6-31g+(d).log.xz

017190848.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190848.td-b3lyp_6-31+g(d).gjf (generated)

017190848.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190848.mol 017190848.PUBCHEM 017190848.mol (via Jmol)
017190876.b3lyp_6-31g(d).inp

017190876.b3lyp_6-31g(d).qchem.inp (generated)

017190876.b3lyp_6-31g(d).gjf (generated)

017190876.b3lyp_6-31g(d).firefly.inp (generated)

017190876.b3lyp_6-31g(d).smash.inp (generated)

017190876.b3lyp_6-31g(d).nwchem.inp (generated) 017190876.b3lyp_6-31g(d).log.xz 017190876.td-b3lyp_6-31g+(d).inp 017190876.td-b3lyp_6-31g+(d).log.xz

017190876.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190876.td-b3lyp_6-31+g(d).gjf (generated)

017190876.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190876.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190876.mol 017190876.PUBCHEM 017190876.mol (via Jmol)
017190885.b3lyp_6-31g(d).inp

017190885.b3lyp_6-31g(d).qchem.inp (generated)

017190885.b3lyp_6-31g(d).gjf (generated)

017190885.b3lyp_6-31g(d).firefly.inp (generated)

017190885.b3lyp_6-31g(d).smash.inp (generated)

017190885.b3lyp_6-31g(d).nwchem.inp (generated) 017190885.b3lyp_6-31g(d).log.xz 017190885.td-b3lyp_6-31g+(d).inp 017190885.td-b3lyp_6-31g+(d).log.xz

017190885.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190885.td-b3lyp_6-31+g(d).gjf (generated)

017190885.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190885.mol 017190885.PUBCHEM 017190885.mol (via Jmol)
017190888.b3lyp_6-31g(d).inp

017190888.b3lyp_6-31g(d).qchem.inp (generated)

017190888.b3lyp_6-31g(d).gjf (generated)

017190888.b3lyp_6-31g(d).firefly.inp (generated)

017190888.b3lyp_6-31g(d).smash.inp (generated)

017190888.b3lyp_6-31g(d).nwchem.inp (generated) 017190888.b3lyp_6-31g(d).log.xz 017190888.td-b3lyp_6-31g+(d).inp 017190888.td-b3lyp_6-31g+(d).log.xz

017190888.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190888.td-b3lyp_6-31+g(d).gjf (generated)

017190888.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190888.mol 017190888.PUBCHEM 017190888.mol (via Jmol)
017190902.b3lyp_6-31g(d).inp

017190902.b3lyp_6-31g(d).qchem.inp (generated)

017190902.b3lyp_6-31g(d).gjf (generated)

017190902.b3lyp_6-31g(d).firefly.inp (generated)

017190902.b3lyp_6-31g(d).smash.inp (generated)

017190902.b3lyp_6-31g(d).nwchem.inp (generated) 017190902.b3lyp_6-31g(d).log.xz 017190902.mol 017190902.PUBCHEM 017190902.mol (via Jmol)
017190907.b3lyp_6-31g(d).inp

017190907.b3lyp_6-31g(d).qchem.inp (generated)

017190907.b3lyp_6-31g(d).gjf (generated)

017190907.b3lyp_6-31g(d).firefly.inp (generated)

017190907.b3lyp_6-31g(d).smash.inp (generated)

017190907.b3lyp_6-31g(d).nwchem.inp (generated) 017190907.b3lyp_6-31g(d).log.xz 017190907.td-b3lyp_6-31g+(d).inp 017190907.td-b3lyp_6-31g+(d).log.xz

017190907.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190907.td-b3lyp_6-31+g(d).gjf (generated)

017190907.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190907.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190907.mol 017190907.PUBCHEM 017190907.mol (via Jmol)
017190911.b3lyp_6-31g(d).inp

017190911.b3lyp_6-31g(d).qchem.inp (generated)

017190911.b3lyp_6-31g(d).gjf (generated)

017190911.b3lyp_6-31g(d).firefly.inp (generated)

017190911.b3lyp_6-31g(d).smash.inp (generated)

017190911.b3lyp_6-31g(d).nwchem.inp (generated) 017190911.b3lyp_6-31g(d).log.xz 017190911.mol 017190911.PUBCHEM 017190911.mol (via Jmol)
017190912.b3lyp_6-31g(d).inp

017190912.b3lyp_6-31g(d).qchem.inp (generated)

017190912.b3lyp_6-31g(d).gjf (generated)

017190912.b3lyp_6-31g(d).firefly.inp (generated)

017190912.b3lyp_6-31g(d).smash.inp (generated)

017190912.b3lyp_6-31g(d).nwchem.inp (generated) 017190912.b3lyp_6-31g(d).log.xz 017190912.mol 017190912.PUBCHEM 017190912.mol (via Jmol)
017190921.b3lyp_6-31g(d).inp

017190921.b3lyp_6-31g(d).qchem.inp (generated)

017190921.b3lyp_6-31g(d).gjf (generated)

017190921.b3lyp_6-31g(d).firefly.inp (generated)

017190921.b3lyp_6-31g(d).smash.inp (generated)

017190921.b3lyp_6-31g(d).nwchem.inp (generated) 017190921.b3lyp_6-31g(d).log.xz 017190921.td-b3lyp_6-31g+(d).inp 017190921.td-b3lyp_6-31g+(d).log.xz

017190921.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190921.td-b3lyp_6-31+g(d).gjf (generated)

017190921.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190921.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190921.mol 017190921.PUBCHEM 017190921.mol (via Jmol)
017190922.b3lyp_6-31g(d).inp

017190922.b3lyp_6-31g(d).qchem.inp (generated)

017190922.b3lyp_6-31g(d).gjf (generated)

017190922.b3lyp_6-31g(d).firefly.inp (generated)

017190922.b3lyp_6-31g(d).smash.inp (generated)

017190922.b3lyp_6-31g(d).nwchem.inp (generated) 017190922.b3lyp_6-31g(d).log.xz 017190922.td-b3lyp_6-31g+(d).inp 017190922.td-b3lyp_6-31g+(d).log.xz

017190922.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190922.td-b3lyp_6-31+g(d).gjf (generated)

017190922.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190922.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190922.mol 017190922.PUBCHEM 017190922.mol (via Jmol)
017190927.b3lyp_6-31g(d).inp

017190927.b3lyp_6-31g(d).qchem.inp (generated)

017190927.b3lyp_6-31g(d).gjf (generated)

017190927.b3lyp_6-31g(d).firefly.inp (generated)

017190927.b3lyp_6-31g(d).smash.inp (generated)

017190927.b3lyp_6-31g(d).nwchem.inp (generated) 017190927.b3lyp_6-31g(d).log.xz 017190927.td-b3lyp_6-31g+(d).inp 017190927.td-b3lyp_6-31g+(d).log.xz

017190927.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190927.td-b3lyp_6-31+g(d).gjf (generated)

017190927.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190927.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190927.mol 017190927.PUBCHEM 017190927.mol (via Jmol)
017190928.b3lyp_6-31g(d).inp

017190928.b3lyp_6-31g(d).qchem.inp (generated)

017190928.b3lyp_6-31g(d).gjf (generated)

017190928.b3lyp_6-31g(d).firefly.inp (generated)

017190928.b3lyp_6-31g(d).smash.inp (generated)

017190928.b3lyp_6-31g(d).nwchem.inp (generated) 017190928.b3lyp_6-31g(d).log.xz 017190928.td-b3lyp_6-31g+(d).inp 017190928.td-b3lyp_6-31g+(d).log.xz

017190928.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190928.td-b3lyp_6-31+g(d).gjf (generated)

017190928.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190928.mol 017190928.PUBCHEM 017190928.mol (via Jmol)
017190929.b3lyp_6-31g(d).inp

017190929.b3lyp_6-31g(d).qchem.inp (generated)

017190929.b3lyp_6-31g(d).gjf (generated)

017190929.b3lyp_6-31g(d).firefly.inp (generated)

017190929.b3lyp_6-31g(d).smash.inp (generated)

017190929.b3lyp_6-31g(d).nwchem.inp (generated) 017190929.b3lyp_6-31g(d).log.xz 017190929.td-b3lyp_6-31g+(d).inp 017190929.td-b3lyp_6-31g+(d).log.xz

017190929.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190929.td-b3lyp_6-31+g(d).gjf (generated)

017190929.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190929.mol 017190929.PUBCHEM 017190929.mol (via Jmol)
017190930.b3lyp_6-31g(d).inp

017190930.b3lyp_6-31g(d).qchem.inp (generated)

017190930.b3lyp_6-31g(d).gjf (generated)

017190930.b3lyp_6-31g(d).firefly.inp (generated)

017190930.b3lyp_6-31g(d).smash.inp (generated)

017190930.b3lyp_6-31g(d).nwchem.inp (generated) 017190930.b3lyp_6-31g(d).log.xz 017190930.td-b3lyp_6-31g+(d).inp 017190930.td-b3lyp_6-31g+(d).log.xz

017190930.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190930.td-b3lyp_6-31+g(d).gjf (generated)

017190930.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190930.mol 017190930.PUBCHEM 017190930.mol (via Jmol)
017190931.b3lyp_6-31g(d).inp

017190931.b3lyp_6-31g(d).qchem.inp (generated)

017190931.b3lyp_6-31g(d).gjf (generated)

017190931.b3lyp_6-31g(d).firefly.inp (generated)

017190931.b3lyp_6-31g(d).smash.inp (generated)

017190931.b3lyp_6-31g(d).nwchem.inp (generated) 017190931.b3lyp_6-31g(d).log.xz 017190931.td-b3lyp_6-31g+(d).inp 017190931.td-b3lyp_6-31g+(d).log.xz

017190931.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190931.td-b3lyp_6-31+g(d).gjf (generated)

017190931.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190931.mol 017190931.PUBCHEM 017190931.mol (via Jmol)
017190932.b3lyp_6-31g(d).inp

017190932.b3lyp_6-31g(d).qchem.inp (generated)

017190932.b3lyp_6-31g(d).gjf (generated)

017190932.b3lyp_6-31g(d).firefly.inp (generated)

017190932.b3lyp_6-31g(d).smash.inp (generated)

017190932.b3lyp_6-31g(d).nwchem.inp (generated) 017190932.b3lyp_6-31g(d).log.xz 017190932.td-b3lyp_6-31g+(d).inp 017190932.td-b3lyp_6-31g+(d).log.xz

017190932.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190932.td-b3lyp_6-31+g(d).gjf (generated)

017190932.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190932.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190932.mol 017190932.PUBCHEM 017190932.mol (via Jmol)
017190953.b3lyp_6-31g(d).inp

017190953.b3lyp_6-31g(d).qchem.inp (generated)

017190953.b3lyp_6-31g(d).gjf (generated)

017190953.b3lyp_6-31g(d).firefly.inp (generated)

017190953.b3lyp_6-31g(d).smash.inp (generated)

017190953.b3lyp_6-31g(d).nwchem.inp (generated) 017190953.b3lyp_6-31g(d).log.xz 017190953.td-b3lyp_6-31g+(d).inp 017190953.td-b3lyp_6-31g+(d).log.xz

017190953.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190953.td-b3lyp_6-31+g(d).gjf (generated)

017190953.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190953.mol 017190953.PUBCHEM 017190953.mol (via Jmol)
017190957.b3lyp_6-31g(d).inp

017190957.b3lyp_6-31g(d).qchem.inp (generated)

017190957.b3lyp_6-31g(d).gjf (generated)

017190957.b3lyp_6-31g(d).firefly.inp (generated)

017190957.b3lyp_6-31g(d).smash.inp (generated)

017190957.b3lyp_6-31g(d).nwchem.inp (generated) 017190957.b3lyp_6-31g(d).log.xz 017190957.td-b3lyp_6-31g+(d).inp 017190957.td-b3lyp_6-31g+(d).log.xz

017190957.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190957.td-b3lyp_6-31+g(d).gjf (generated)

017190957.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190957.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190957.mol 017190957.PUBCHEM 017190957.mol (via Jmol)
017190964.b3lyp_6-31g(d).inp

017190964.b3lyp_6-31g(d).qchem.inp (generated)

017190964.b3lyp_6-31g(d).gjf (generated)

017190964.b3lyp_6-31g(d).firefly.inp (generated)

017190964.b3lyp_6-31g(d).smash.inp (generated)

017190964.b3lyp_6-31g(d).nwchem.inp (generated) 017190964.b3lyp_6-31g(d).log.xz 017190964.td-b3lyp_6-31g+(d).inp 017190964.td-b3lyp_6-31g+(d).log.xz

017190964.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190964.td-b3lyp_6-31+g(d).gjf (generated)

017190964.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190964.mol 017190964.PUBCHEM 017190964.mol (via Jmol)
017190965.b3lyp_6-31g(d).inp

017190965.b3lyp_6-31g(d).qchem.inp (generated)

017190965.b3lyp_6-31g(d).gjf (generated)

017190965.b3lyp_6-31g(d).firefly.inp (generated)

017190965.b3lyp_6-31g(d).smash.inp (generated)

017190965.b3lyp_6-31g(d).nwchem.inp (generated) 017190965.b3lyp_6-31g(d).log.xz 017190965.td-b3lyp_6-31g+(d).inp 017190965.td-b3lyp_6-31g+(d).log.xz

017190965.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190965.td-b3lyp_6-31+g(d).gjf (generated)

017190965.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190965.mol 017190965.PUBCHEM 017190965.mol (via Jmol)
017190967.b3lyp_6-31g(d).inp

017190967.b3lyp_6-31g(d).qchem.inp (generated)

017190967.b3lyp_6-31g(d).gjf (generated)

017190967.b3lyp_6-31g(d).firefly.inp (generated)

017190967.b3lyp_6-31g(d).smash.inp (generated)

017190967.b3lyp_6-31g(d).nwchem.inp (generated) 017190967.b3lyp_6-31g(d).log.xz 017190967.td-b3lyp_6-31g+(d).inp 017190967.td-b3lyp_6-31g+(d).log.xz

017190967.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190967.td-b3lyp_6-31+g(d).gjf (generated)

017190967.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190967.mol 017190967.PUBCHEM 017190967.mol (via Jmol)
017190969.b3lyp_6-31g(d).inp

017190969.b3lyp_6-31g(d).qchem.inp (generated)

017190969.b3lyp_6-31g(d).gjf (generated)

017190969.b3lyp_6-31g(d).firefly.inp (generated)

017190969.b3lyp_6-31g(d).smash.inp (generated)

017190969.b3lyp_6-31g(d).nwchem.inp (generated) 017190969.b3lyp_6-31g(d).log.xz 017190969.td-b3lyp_6-31g+(d).inp 017190969.td-b3lyp_6-31g+(d).log.xz

017190969.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190969.td-b3lyp_6-31+g(d).gjf (generated)

017190969.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190969.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190969.mol 017190969.PUBCHEM 017190969.mol (via Jmol)
017190970.b3lyp_6-31g(d).inp

017190970.b3lyp_6-31g(d).qchem.inp (generated)

017190970.b3lyp_6-31g(d).gjf (generated)

017190970.b3lyp_6-31g(d).firefly.inp (generated)

017190970.b3lyp_6-31g(d).smash.inp (generated)

017190970.b3lyp_6-31g(d).nwchem.inp (generated) 017190970.b3lyp_6-31g(d).log.xz 017190970.td-b3lyp_6-31g+(d).inp 017190970.td-b3lyp_6-31g+(d).log.xz

017190970.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190970.td-b3lyp_6-31+g(d).gjf (generated)

017190970.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190970.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190970.mol 017190970.PUBCHEM 017190970.mol (via Jmol)
017190971.b3lyp_6-31g(d).inp

017190971.b3lyp_6-31g(d).qchem.inp (generated)

017190971.b3lyp_6-31g(d).gjf (generated)

017190971.b3lyp_6-31g(d).firefly.inp (generated)

017190971.b3lyp_6-31g(d).smash.inp (generated)

017190971.b3lyp_6-31g(d).nwchem.inp (generated) 017190971.b3lyp_6-31g(d).log.xz 017190971.mol 017190971.PUBCHEM 017190971.mol (via Jmol)
017190978.b3lyp_6-31g(d).inp

017190978.b3lyp_6-31g(d).qchem.inp (generated)

017190978.b3lyp_6-31g(d).gjf (generated)

017190978.b3lyp_6-31g(d).firefly.inp (generated)

017190978.b3lyp_6-31g(d).smash.inp (generated)

017190978.b3lyp_6-31g(d).nwchem.inp (generated) 017190978.b3lyp_6-31g(d).log.xz 017190978.td-b3lyp_6-31g+(d).inp 017190978.td-b3lyp_6-31g+(d).log.xz

017190978.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190978.td-b3lyp_6-31+g(d).gjf (generated)

017190978.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190978.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190978.mol 017190978.PUBCHEM 017190978.mol (via Jmol)
017190979.b3lyp_6-31g(d).inp

017190979.b3lyp_6-31g(d).qchem.inp (generated)

017190979.b3lyp_6-31g(d).gjf (generated)

017190979.b3lyp_6-31g(d).firefly.inp (generated)

017190979.b3lyp_6-31g(d).smash.inp (generated)

017190979.b3lyp_6-31g(d).nwchem.inp (generated) 017190979.b3lyp_6-31g(d).log.xz 017190979.mol 017190979.PUBCHEM 017190979.mol (via Jmol)
017190980.b3lyp_6-31g(d).inp

017190980.b3lyp_6-31g(d).qchem.inp (generated)

017190980.b3lyp_6-31g(d).gjf (generated)

017190980.b3lyp_6-31g(d).firefly.inp (generated)

017190980.b3lyp_6-31g(d).smash.inp (generated)

017190980.b3lyp_6-31g(d).nwchem.inp (generated) 017190980.b3lyp_6-31g(d).log.xz 017190980.td-b3lyp_6-31g+(d).inp 017190980.td-b3lyp_6-31g+(d).log.xz

017190980.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190980.td-b3lyp_6-31+g(d).gjf (generated)

017190980.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190980.mol 017190980.PUBCHEM 017190980.mol (via Jmol)
017190990.b3lyp_6-31g(d).inp

017190990.b3lyp_6-31g(d).qchem.inp (generated)

017190990.b3lyp_6-31g(d).gjf (generated)

017190990.b3lyp_6-31g(d).firefly.inp (generated)

017190990.b3lyp_6-31g(d).smash.inp (generated)

017190990.b3lyp_6-31g(d).nwchem.inp (generated) 017190990.b3lyp_6-31g(d).log.xz 017190990.td-b3lyp_6-31g+(d).inp 017190990.td-b3lyp_6-31g+(d).log.xz

017190990.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190990.td-b3lyp_6-31+g(d).gjf (generated)

017190990.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190990.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190990.mol 017190990.PUBCHEM 017190990.mol (via Jmol)
017190992.b3lyp_6-31g(d).inp

017190992.b3lyp_6-31g(d).qchem.inp (generated)

017190992.b3lyp_6-31g(d).gjf (generated)

017190992.b3lyp_6-31g(d).firefly.inp (generated)

017190992.b3lyp_6-31g(d).smash.inp (generated)

017190992.b3lyp_6-31g(d).nwchem.inp (generated) 017190992.b3lyp_6-31g(d).log.xz 017190992.td-b3lyp_6-31g+(d).inp 017190992.td-b3lyp_6-31g+(d).log.xz

017190992.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190992.td-b3lyp_6-31+g(d).gjf (generated)

017190992.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190992.mol 017190992.PUBCHEM 017190992.mol (via Jmol)
017190993.b3lyp_6-31g(d).inp

017190993.b3lyp_6-31g(d).qchem.inp (generated)

017190993.b3lyp_6-31g(d).gjf (generated)

017190993.b3lyp_6-31g(d).firefly.inp (generated)

017190993.b3lyp_6-31g(d).smash.inp (generated)

017190993.b3lyp_6-31g(d).nwchem.inp (generated) 017190993.b3lyp_6-31g(d).log.xz 017190993.mol 017190993.PUBCHEM 017190993.mol (via Jmol)
017190994.b3lyp_6-31g(d).inp

017190994.b3lyp_6-31g(d).qchem.inp (generated)

017190994.b3lyp_6-31g(d).gjf (generated)

017190994.b3lyp_6-31g(d).firefly.inp (generated)

017190994.b3lyp_6-31g(d).smash.inp (generated)

017190994.b3lyp_6-31g(d).nwchem.inp (generated) 017190994.b3lyp_6-31g(d).log.xz 017190994.td-b3lyp_6-31g+(d).inp 017190994.td-b3lyp_6-31g+(d).log.xz

017190994.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190994.td-b3lyp_6-31+g(d).gjf (generated)

017190994.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190994.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190994.mol 017190994.PUBCHEM 017190994.mol (via Jmol)
017190995.b3lyp_6-31g(d).inp

017190995.b3lyp_6-31g(d).qchem.inp (generated)

017190995.b3lyp_6-31g(d).gjf (generated)

017190995.b3lyp_6-31g(d).firefly.inp (generated)

017190995.b3lyp_6-31g(d).smash.inp (generated)

017190995.b3lyp_6-31g(d).nwchem.inp (generated) 017190995.b3lyp_6-31g(d).log.xz 017190995.td-b3lyp_6-31g+(d).inp 017190995.td-b3lyp_6-31g+(d).log.xz

017190995.td-b3lyp_6-31+g(d).qchem.inp (generated)

017190995.td-b3lyp_6-31+g(d).gjf (generated)

017190995.td-b3lyp_6-31+g(d).firefly.inp (generated)

017190995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017190995.mol 017190995.PUBCHEM 017190995.mol (via Jmol)
017191050.b3lyp_6-31g(d).inp

017191050.b3lyp_6-31g(d).qchem.inp (generated)

017191050.b3lyp_6-31g(d).gjf (generated)

017191050.b3lyp_6-31g(d).firefly.inp (generated)

017191050.b3lyp_6-31g(d).smash.inp (generated)

017191050.b3lyp_6-31g(d).nwchem.inp (generated) 017191050.b3lyp_6-31g(d).log.xz 017191050.td-b3lyp_6-31g+(d).inp 017191050.td-b3lyp_6-31g+(d).log.xz

017191050.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191050.td-b3lyp_6-31+g(d).gjf (generated)

017191050.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191050.mol 017191050.PUBCHEM 017191050.mol (via Jmol)
017191052.b3lyp_6-31g(d).inp

017191052.b3lyp_6-31g(d).qchem.inp (generated)

017191052.b3lyp_6-31g(d).gjf (generated)

017191052.b3lyp_6-31g(d).firefly.inp (generated)

017191052.b3lyp_6-31g(d).smash.inp (generated)

017191052.b3lyp_6-31g(d).nwchem.inp (generated) 017191052.b3lyp_6-31g(d).log.xz 017191052.mol 017191052.PUBCHEM 017191052.mol (via Jmol)
017191053.b3lyp_6-31g(d).inp

017191053.b3lyp_6-31g(d).qchem.inp (generated)

017191053.b3lyp_6-31g(d).gjf (generated)

017191053.b3lyp_6-31g(d).firefly.inp (generated)

017191053.b3lyp_6-31g(d).smash.inp (generated)

017191053.b3lyp_6-31g(d).nwchem.inp (generated) 017191053.b3lyp_6-31g(d).log.xz 017191053.mol 017191053.PUBCHEM 017191053.mol (via Jmol)
017191112.b3lyp_6-31g(d).inp

017191112.b3lyp_6-31g(d).qchem.inp (generated)

017191112.b3lyp_6-31g(d).gjf (generated)

017191112.b3lyp_6-31g(d).firefly.inp (generated)

017191112.b3lyp_6-31g(d).smash.inp (generated)

017191112.b3lyp_6-31g(d).nwchem.inp (generated) 017191112.b3lyp_6-31g(d).log.xz 017191112.td-b3lyp_6-31g+(d).inp 017191112.td-b3lyp_6-31g+(d).log.xz

017191112.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191112.td-b3lyp_6-31+g(d).gjf (generated)

017191112.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191112.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191112.mol 017191112.PUBCHEM 017191112.mol (via Jmol)
017191122.b3lyp_6-31g(d).inp

017191122.b3lyp_6-31g(d).qchem.inp (generated)

017191122.b3lyp_6-31g(d).gjf (generated)

017191122.b3lyp_6-31g(d).firefly.inp (generated)

017191122.b3lyp_6-31g(d).smash.inp (generated)

017191122.b3lyp_6-31g(d).nwchem.inp (generated) 017191122.b3lyp_6-31g(d).log.xz 017191122.mol 017191122.PUBCHEM 017191122.mol (via Jmol)
017191123.b3lyp_6-31g(d).inp

017191123.b3lyp_6-31g(d).qchem.inp (generated)

017191123.b3lyp_6-31g(d).gjf (generated)

017191123.b3lyp_6-31g(d).firefly.inp (generated)

017191123.b3lyp_6-31g(d).smash.inp (generated)

017191123.b3lyp_6-31g(d).nwchem.inp (generated) 017191123.b3lyp_6-31g(d).log.xz 017191123.mol 017191123.PUBCHEM 017191123.mol (via Jmol)
017191124.b3lyp_6-31g(d).inp

017191124.b3lyp_6-31g(d).qchem.inp (generated)

017191124.b3lyp_6-31g(d).gjf (generated)

017191124.b3lyp_6-31g(d).firefly.inp (generated)

017191124.b3lyp_6-31g(d).smash.inp (generated)

017191124.b3lyp_6-31g(d).nwchem.inp (generated) 017191124.b3lyp_6-31g(d).log.xz 017191124.td-b3lyp_6-31g+(d).inp 017191124.td-b3lyp_6-31g+(d).log.xz

017191124.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191124.td-b3lyp_6-31+g(d).gjf (generated)

017191124.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191124.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191124.mol 017191124.PUBCHEM 017191124.mol (via Jmol)
017191125.b3lyp_6-31g(d).inp

017191125.b3lyp_6-31g(d).qchem.inp (generated)

017191125.b3lyp_6-31g(d).gjf (generated)

017191125.b3lyp_6-31g(d).firefly.inp (generated)

017191125.b3lyp_6-31g(d).smash.inp (generated)

017191125.b3lyp_6-31g(d).nwchem.inp (generated) 017191125.b3lyp_6-31g(d).log.xz 017191125.td-b3lyp_6-31g+(d).inp 017191125.td-b3lyp_6-31g+(d).log.xz

017191125.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191125.td-b3lyp_6-31+g(d).gjf (generated)

017191125.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191125.mol 017191125.PUBCHEM 017191125.mol (via Jmol)
017191128.b3lyp_6-31g(d).inp

017191128.b3lyp_6-31g(d).qchem.inp (generated)

017191128.b3lyp_6-31g(d).gjf (generated)

017191128.b3lyp_6-31g(d).firefly.inp (generated)

017191128.b3lyp_6-31g(d).smash.inp (generated)

017191128.b3lyp_6-31g(d).nwchem.inp (generated) 017191128.b3lyp_6-31g(d).log.xz 017191128.mol 017191128.PUBCHEM 017191128.mol (via Jmol)
017191150.b3lyp_6-31g(d).inp

017191150.b3lyp_6-31g(d).qchem.inp (generated)

017191150.b3lyp_6-31g(d).gjf (generated)

017191150.b3lyp_6-31g(d).firefly.inp (generated)

017191150.b3lyp_6-31g(d).smash.inp (generated)

017191150.b3lyp_6-31g(d).nwchem.inp (generated) 017191150.b3lyp_6-31g(d).log.xz 017191150.td-b3lyp_6-31g+(d).inp 017191150.td-b3lyp_6-31g+(d).log.xz

017191150.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191150.td-b3lyp_6-31+g(d).gjf (generated)

017191150.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191150.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191150.mol 017191150.PUBCHEM 017191150.mol (via Jmol)
017191153.b3lyp_6-31g(d).inp

017191153.b3lyp_6-31g(d).qchem.inp (generated)

017191153.b3lyp_6-31g(d).gjf (generated)

017191153.b3lyp_6-31g(d).firefly.inp (generated)

017191153.b3lyp_6-31g(d).smash.inp (generated)

017191153.b3lyp_6-31g(d).nwchem.inp (generated) 017191153.b3lyp_6-31g(d).log.xz 017191153.td-b3lyp_6-31g+(d).inp 017191153.td-b3lyp_6-31g+(d).log.xz

017191153.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191153.td-b3lyp_6-31+g(d).gjf (generated)

017191153.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191153.mol 017191153.PUBCHEM 017191153.mol (via Jmol)
017191160.b3lyp_6-31g(d).inp

017191160.b3lyp_6-31g(d).qchem.inp (generated)

017191160.b3lyp_6-31g(d).gjf (generated)

017191160.b3lyp_6-31g(d).firefly.inp (generated)

017191160.b3lyp_6-31g(d).smash.inp (generated)

017191160.b3lyp_6-31g(d).nwchem.inp (generated) 017191160.b3lyp_6-31g(d).log.xz 017191160.td-b3lyp_6-31g+(d).inp 017191160.td-b3lyp_6-31g+(d).log.xz

017191160.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191160.td-b3lyp_6-31+g(d).gjf (generated)

017191160.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191160.mol 017191160.PUBCHEM 017191160.mol (via Jmol)
017191256.b3lyp_6-31g(d).inp

017191256.b3lyp_6-31g(d).qchem.inp (generated)

017191256.b3lyp_6-31g(d).gjf (generated)

017191256.b3lyp_6-31g(d).firefly.inp (generated)

017191256.b3lyp_6-31g(d).smash.inp (generated)

017191256.b3lyp_6-31g(d).nwchem.inp (generated) 017191256.b3lyp_6-31g(d).log.xz 017191256.td-b3lyp_6-31g+(d).inp 017191256.td-b3lyp_6-31g+(d).log.xz

017191256.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191256.td-b3lyp_6-31+g(d).gjf (generated)

017191256.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191256.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191256.mol 017191256.PUBCHEM 017191256.mol (via Jmol)
017191341.b3lyp_6-31g(d).inp

017191341.b3lyp_6-31g(d).qchem.inp (generated)

017191341.b3lyp_6-31g(d).gjf (generated)

017191341.b3lyp_6-31g(d).firefly.inp (generated)

017191341.b3lyp_6-31g(d).smash.inp (generated)

017191341.b3lyp_6-31g(d).nwchem.inp (generated) 017191341.b3lyp_6-31g(d).log.xz 017191341.mol 017191341.PUBCHEM 017191341.mol (via Jmol)
017191353.b3lyp_6-31g(d).inp

017191353.b3lyp_6-31g(d).qchem.inp (generated)

017191353.b3lyp_6-31g(d).gjf (generated)

017191353.b3lyp_6-31g(d).firefly.inp (generated)

017191353.b3lyp_6-31g(d).smash.inp (generated)

017191353.b3lyp_6-31g(d).nwchem.inp (generated) 017191353.b3lyp_6-31g(d).log.xz 017191353.td-b3lyp_6-31g+(d).inp 017191353.td-b3lyp_6-31g+(d).log.xz

017191353.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191353.td-b3lyp_6-31+g(d).gjf (generated)

017191353.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191353.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191353.mol 017191353.PUBCHEM 017191353.mol (via Jmol)
017191439.b3lyp_6-31g(d).inp

017191439.b3lyp_6-31g(d).qchem.inp (generated)

017191439.b3lyp_6-31g(d).gjf (generated)

017191439.b3lyp_6-31g(d).firefly.inp (generated)

017191439.b3lyp_6-31g(d).smash.inp (generated)

017191439.b3lyp_6-31g(d).nwchem.inp (generated) 017191439.b3lyp_6-31g(d).log.xz 017191439.td-b3lyp_6-31g+(d).inp 017191439.td-b3lyp_6-31g+(d).log.xz

017191439.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191439.td-b3lyp_6-31+g(d).gjf (generated)

017191439.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191439.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191439.mol 017191439.PUBCHEM 017191439.mol (via Jmol)
017191444.b3lyp_6-31g(d).inp

017191444.b3lyp_6-31g(d).qchem.inp (generated)

017191444.b3lyp_6-31g(d).gjf (generated)

017191444.b3lyp_6-31g(d).firefly.inp (generated)

017191444.b3lyp_6-31g(d).smash.inp (generated)

017191444.b3lyp_6-31g(d).nwchem.inp (generated) 017191444.b3lyp_6-31g(d).log.xz 017191444.td-b3lyp_6-31g+(d).inp 017191444.td-b3lyp_6-31g+(d).log.xz

017191444.td-b3lyp_6-31+g(d).qchem.inp (generated)

017191444.td-b3lyp_6-31+g(d).gjf (generated)

017191444.td-b3lyp_6-31+g(d).firefly.inp (generated)

017191444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017191444.mol 017191444.PUBCHEM 017191444.mol (via Jmol)
017193929.b3lyp_6-31g(d).inp

017193929.b3lyp_6-31g(d).qchem.inp (generated)

017193929.b3lyp_6-31g(d).gjf (generated)

017193929.b3lyp_6-31g(d).firefly.inp (generated)

017193929.b3lyp_6-31g(d).smash.inp (generated)

017193929.b3lyp_6-31g(d).nwchem.inp (generated) 017193929.b3lyp_6-31g(d).log.xz 017193929.td-b3lyp_6-31g+(d).inp 017193929.td-b3lyp_6-31g+(d).log.xz

017193929.td-b3lyp_6-31+g(d).qchem.inp (generated)

017193929.td-b3lyp_6-31+g(d).gjf (generated)

017193929.td-b3lyp_6-31+g(d).firefly.inp (generated)

017193929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017193929.mol 017193929.PUBCHEM 017193929.mol (via Jmol)
017194219.b3lyp_6-31g(d).inp

017194219.b3lyp_6-31g(d).qchem.inp (generated)

017194219.b3lyp_6-31g(d).gjf (generated)

017194219.b3lyp_6-31g(d).firefly.inp (generated)

017194219.b3lyp_6-31g(d).smash.inp (generated)

017194219.b3lyp_6-31g(d).nwchem.inp (generated) 017194219.b3lyp_6-31g(d).log.xz 017194219.td-b3lyp_6-31g+(d).inp 017194219.td-b3lyp_6-31g+(d).log.xz

017194219.td-b3lyp_6-31+g(d).qchem.inp (generated)

017194219.td-b3lyp_6-31+g(d).gjf (generated)

017194219.td-b3lyp_6-31+g(d).firefly.inp (generated)

017194219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017194219.mol 017194219.PUBCHEM 017194219.mol (via Jmol)
017195100.b3lyp_6-31g(d).inp

017195100.b3lyp_6-31g(d).qchem.inp (generated)

017195100.b3lyp_6-31g(d).gjf (generated)

017195100.b3lyp_6-31g(d).firefly.inp (generated)

017195100.b3lyp_6-31g(d).smash.inp (generated)

017195100.b3lyp_6-31g(d).nwchem.inp (generated) 017195100.b3lyp_6-31g(d).log.xz 017195100.mol 017195100.PUBCHEM 017195100.mol (via Jmol)
017195948.b3lyp_6-31g(d).inp

017195948.b3lyp_6-31g(d).qchem.inp (generated)

017195948.b3lyp_6-31g(d).gjf (generated)

017195948.b3lyp_6-31g(d).firefly.inp (generated)

017195948.b3lyp_6-31g(d).smash.inp (generated)

017195948.b3lyp_6-31g(d).nwchem.inp (generated) 017195948.b3lyp_6-31g(d).log.xz 017195948.td-b3lyp_6-31g+(d).inp 017195948.td-b3lyp_6-31g+(d).log.xz

017195948.td-b3lyp_6-31+g(d).qchem.inp (generated)

017195948.td-b3lyp_6-31+g(d).gjf (generated)

017195948.td-b3lyp_6-31+g(d).firefly.inp (generated)

017195948.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017195948.mol 017195948.PUBCHEM 017195948.mol (via Jmol)
017196022.b3lyp_6-31g(d).inp

017196022.b3lyp_6-31g(d).qchem.inp (generated)

017196022.b3lyp_6-31g(d).gjf (generated)

017196022.b3lyp_6-31g(d).firefly.inp (generated)

017196022.b3lyp_6-31g(d).smash.inp (generated)

017196022.b3lyp_6-31g(d).nwchem.inp (generated) 017196022.b3lyp_6-31g(d).log.xz 017196022.td-b3lyp_6-31g+(d).inp 017196022.td-b3lyp_6-31g+(d).log.xz

017196022.td-b3lyp_6-31+g(d).qchem.inp (generated)

017196022.td-b3lyp_6-31+g(d).gjf (generated)

017196022.td-b3lyp_6-31+g(d).firefly.inp (generated)

017196022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017196022.mol 017196022.PUBCHEM 017196022.mol (via Jmol)
017196728.b3lyp_6-31g(d).inp

017196728.b3lyp_6-31g(d).qchem.inp (generated)

017196728.b3lyp_6-31g(d).gjf (generated)

017196728.b3lyp_6-31g(d).firefly.inp (generated)

017196728.b3lyp_6-31g(d).smash.inp (generated)

017196728.b3lyp_6-31g(d).nwchem.inp (generated) 017196728.b3lyp_6-31g(d).log.xz 017196728.mol 017196728.PUBCHEM 017196728.mol (via Jmol)
017196730.b3lyp_6-31g(d).inp

017196730.b3lyp_6-31g(d).qchem.inp (generated)

017196730.b3lyp_6-31g(d).gjf (generated)

017196730.b3lyp_6-31g(d).firefly.inp (generated)

017196730.b3lyp_6-31g(d).smash.inp (generated)

017196730.b3lyp_6-31g(d).nwchem.inp (generated) 017196730.b3lyp_6-31g(d).log.xz 017196730.td-b3lyp_6-31g+(d).inp 017196730.td-b3lyp_6-31g+(d).log.xz

017196730.td-b3lyp_6-31+g(d).qchem.inp (generated)

017196730.td-b3lyp_6-31+g(d).gjf (generated)

017196730.td-b3lyp_6-31+g(d).firefly.inp (generated)

017196730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017196730.mol 017196730.PUBCHEM 017196730.mol (via Jmol)
017197905.b3lyp_6-31g(d).inp

017197905.b3lyp_6-31g(d).qchem.inp (generated)

017197905.b3lyp_6-31g(d).gjf (generated)

017197905.b3lyp_6-31g(d).firefly.inp (generated)

017197905.b3lyp_6-31g(d).smash.inp (generated)

017197905.b3lyp_6-31g(d).nwchem.inp (generated) 017197905.b3lyp_6-31g(d).log.xz 017197905.td-b3lyp_6-31g+(d).inp 017197905.td-b3lyp_6-31g+(d).log.xz

017197905.td-b3lyp_6-31+g(d).qchem.inp (generated)

017197905.td-b3lyp_6-31+g(d).gjf (generated)

017197905.td-b3lyp_6-31+g(d).firefly.inp (generated)

017197905.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017197905.mol 017197905.PUBCHEM 017197905.mol (via Jmol)
017198338.b3lyp_6-31g(d).inp

017198338.b3lyp_6-31g(d).qchem.inp (generated)

017198338.b3lyp_6-31g(d).gjf (generated)

017198338.b3lyp_6-31g(d).firefly.inp (generated)

017198338.b3lyp_6-31g(d).smash.inp (generated)

017198338.b3lyp_6-31g(d).nwchem.inp (generated) 017198338.b3lyp_6-31g(d).log.xz 017198338.td-b3lyp_6-31g+(d).inp 017198338.td-b3lyp_6-31g+(d).log.xz

017198338.td-b3lyp_6-31+g(d).qchem.inp (generated)

017198338.td-b3lyp_6-31+g(d).gjf (generated)

017198338.td-b3lyp_6-31+g(d).firefly.inp (generated)

017198338.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017198338.mol 017198338.PUBCHEM 017198338.mol (via Jmol)
017198382.b3lyp_6-31g(d).inp

017198382.b3lyp_6-31g(d).qchem.inp (generated)

017198382.b3lyp_6-31g(d).gjf (generated)

017198382.b3lyp_6-31g(d).firefly.inp (generated)

017198382.b3lyp_6-31g(d).smash.inp (generated)

017198382.b3lyp_6-31g(d).nwchem.inp (generated) 017198382.b3lyp_6-31g(d).log.xz 017198382.td-b3lyp_6-31g+(d).inp 017198382.td-b3lyp_6-31g+(d).log.xz

017198382.td-b3lyp_6-31+g(d).qchem.inp (generated)

017198382.td-b3lyp_6-31+g(d).gjf (generated)

017198382.td-b3lyp_6-31+g(d).firefly.inp (generated)

017198382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017198382.mol 017198382.PUBCHEM 017198382.mol (via Jmol)
017198385.b3lyp_6-31g(d).inp

017198385.b3lyp_6-31g(d).qchem.inp (generated)

017198385.b3lyp_6-31g(d).gjf (generated)

017198385.b3lyp_6-31g(d).firefly.inp (generated)

017198385.b3lyp_6-31g(d).smash.inp (generated)

017198385.b3lyp_6-31g(d).nwchem.inp (generated) 017198385.b3lyp_6-31g(d).log.xz 017198385.td-b3lyp_6-31g+(d).inp 017198385.td-b3lyp_6-31g+(d).log.xz

017198385.td-b3lyp_6-31+g(d).qchem.inp (generated)

017198385.td-b3lyp_6-31+g(d).gjf (generated)

017198385.td-b3lyp_6-31+g(d).firefly.inp (generated)

017198385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017198385.mol 017198385.PUBCHEM 017198385.mol (via Jmol)
017198390.b3lyp_6-31g(d).inp

017198390.b3lyp_6-31g(d).qchem.inp (generated)

017198390.b3lyp_6-31g(d).gjf (generated)

017198390.b3lyp_6-31g(d).firefly.inp (generated)

017198390.b3lyp_6-31g(d).smash.inp (generated)

017198390.b3lyp_6-31g(d).nwchem.inp (generated) 017198390.b3lyp_6-31g(d).log.xz 017198390.mol 017198390.PUBCHEM 017198390.mol (via Jmol)
017198469.b3lyp_6-31g(d).inp

017198469.b3lyp_6-31g(d).qchem.inp (generated)

017198469.b3lyp_6-31g(d).gjf (generated)

017198469.b3lyp_6-31g(d).firefly.inp (generated)

017198469.b3lyp_6-31g(d).smash.inp (generated)

017198469.b3lyp_6-31g(d).nwchem.inp (generated) 017198469.b3lyp_6-31g(d).log.xz 017198469.td-b3lyp_6-31g+(d).inp 017198469.td-b3lyp_6-31g+(d).log.xz

017198469.td-b3lyp_6-31+g(d).qchem.inp (generated)

017198469.td-b3lyp_6-31+g(d).gjf (generated)

017198469.td-b3lyp_6-31+g(d).firefly.inp (generated)

017198469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017198469.mol 017198469.PUBCHEM 017198469.mol (via Jmol)
017199428.b3lyp_6-31g(d).inp

017199428.b3lyp_6-31g(d).qchem.inp (generated)

017199428.b3lyp_6-31g(d).gjf (generated)

017199428.b3lyp_6-31g(d).firefly.inp (generated)

017199428.b3lyp_6-31g(d).smash.inp (generated)

017199428.b3lyp_6-31g(d).nwchem.inp (generated) 017199428.b3lyp_6-31g(d).log.xz 017199428.td-b3lyp_6-31g+(d).inp 017199428.td-b3lyp_6-31g+(d).log.xz

017199428.td-b3lyp_6-31+g(d).qchem.inp (generated)

017199428.td-b3lyp_6-31+g(d).gjf (generated)

017199428.td-b3lyp_6-31+g(d).firefly.inp (generated)

017199428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017199428.mol 017199428.PUBCHEM 017199428.mol (via Jmol)
017199659.b3lyp_6-31g(d).inp

017199659.b3lyp_6-31g(d).qchem.inp (generated)

017199659.b3lyp_6-31g(d).gjf (generated)

017199659.b3lyp_6-31g(d).firefly.inp (generated)

017199659.b3lyp_6-31g(d).smash.inp (generated)

017199659.b3lyp_6-31g(d).nwchem.inp (generated) 017199659.b3lyp_6-31g(d).log.xz 017199659.td-b3lyp_6-31g+(d).inp 017199659.td-b3lyp_6-31g+(d).log.xz

017199659.td-b3lyp_6-31+g(d).qchem.inp (generated)

017199659.td-b3lyp_6-31+g(d).gjf (generated)

017199659.td-b3lyp_6-31+g(d).firefly.inp (generated)

017199659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017199659.mol 017199659.PUBCHEM 017199659.mol (via Jmol)
017199796.b3lyp_6-31g(d).inp

017199796.b3lyp_6-31g(d).qchem.inp (generated)

017199796.b3lyp_6-31g(d).gjf (generated)

017199796.b3lyp_6-31g(d).firefly.inp (generated)

017199796.b3lyp_6-31g(d).smash.inp (generated)

017199796.b3lyp_6-31g(d).nwchem.inp (generated) 017199796.b3lyp_6-31g(d).log.xz 017199796.mol 017199796.PUBCHEM 017199796.mol (via Jmol)
017199803.b3lyp_6-31g(d).inp

017199803.b3lyp_6-31g(d).qchem.inp (generated)

017199803.b3lyp_6-31g(d).gjf (generated)

017199803.b3lyp_6-31g(d).firefly.inp (generated)

017199803.b3lyp_6-31g(d).smash.inp (generated)

017199803.b3lyp_6-31g(d).nwchem.inp (generated) 017199803.b3lyp_6-31g(d).log.xz 017199803.td-b3lyp_6-31g+(d).inp 017199803.td-b3lyp_6-31g+(d).log.xz

017199803.td-b3lyp_6-31+g(d).qchem.inp (generated)

017199803.td-b3lyp_6-31+g(d).gjf (generated)

017199803.td-b3lyp_6-31+g(d).firefly.inp (generated)

017199803.td-b3lyp_6-31+g(d).nwchem.inp (generated) 017199803.mol 017199803.PUBCHEM 017199803.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com