Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 349 (290) in this page
052931614.b3lyp_6-31g(d).inp

052931614.b3lyp_6-31g(d).qchem.inp (generated)

052931614.b3lyp_6-31g(d).gjf (generated)

052931614.b3lyp_6-31g(d).firefly.inp (generated)

052931614.b3lyp_6-31g(d).smash.inp (generated)

052931614.b3lyp_6-31g(d).nwchem.inp (generated) 052931614.b3lyp_6-31g(d).log.xz 052931614.td-b3lyp_6-31g+(d).inp 052931614.td-b3lyp_6-31g+(d).log.xz

052931614.td-b3lyp_6-31+g(d).qchem.inp (generated)

052931614.td-b3lyp_6-31+g(d).gjf (generated)

052931614.td-b3lyp_6-31+g(d).firefly.inp (generated)

052931614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052931614.mol 052931614.PUBCHEM 052931614.mol (via Jmol)
052931652.b3lyp_6-31g(d).inp

052931652.b3lyp_6-31g(d).qchem.inp (generated)

052931652.b3lyp_6-31g(d).gjf (generated)

052931652.b3lyp_6-31g(d).firefly.inp (generated)

052931652.b3lyp_6-31g(d).smash.inp (generated)

052931652.b3lyp_6-31g(d).nwchem.inp (generated) 052931652.b3lyp_6-31g(d).log.xz 052931652.td-b3lyp_6-31g+(d).inp 052931652.td-b3lyp_6-31g+(d).log.xz

052931652.td-b3lyp_6-31+g(d).qchem.inp (generated)

052931652.td-b3lyp_6-31+g(d).gjf (generated)

052931652.td-b3lyp_6-31+g(d).firefly.inp (generated)

052931652.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052931652.mol 052931652.PUBCHEM 052931652.mol (via Jmol)
052932043.b3lyp_6-31g(d).inp

052932043.b3lyp_6-31g(d).qchem.inp (generated)

052932043.b3lyp_6-31g(d).gjf (generated)

052932043.b3lyp_6-31g(d).firefly.inp (generated)

052932043.b3lyp_6-31g(d).smash.inp (generated)

052932043.b3lyp_6-31g(d).nwchem.inp (generated) 052932043.b3lyp_6-31g(d).log.xz 052932043.mol 052932043.PUBCHEM 052932043.mol (via Jmol)
052932282.b3lyp_6-31g(d).inp

052932282.b3lyp_6-31g(d).qchem.inp (generated)

052932282.b3lyp_6-31g(d).gjf (generated)

052932282.b3lyp_6-31g(d).firefly.inp (generated)

052932282.b3lyp_6-31g(d).smash.inp (generated)

052932282.b3lyp_6-31g(d).nwchem.inp (generated) 052932282.b3lyp_6-31g(d).log.xz 052932282.td-b3lyp_6-31g+(d).inp 052932282.td-b3lyp_6-31g+(d).log.xz

052932282.td-b3lyp_6-31+g(d).qchem.inp (generated)

052932282.td-b3lyp_6-31+g(d).gjf (generated)

052932282.td-b3lyp_6-31+g(d).firefly.inp (generated)

052932282.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052932282.mol 052932282.PUBCHEM 052932282.mol (via Jmol)
052932551.b3lyp_6-31g(d).inp

052932551.b3lyp_6-31g(d).qchem.inp (generated)

052932551.b3lyp_6-31g(d).gjf (generated)

052932551.b3lyp_6-31g(d).firefly.inp (generated)

052932551.b3lyp_6-31g(d).smash.inp (generated)

052932551.b3lyp_6-31g(d).nwchem.inp (generated) 052932551.b3lyp_6-31g(d).log.xz 052932551.td-b3lyp_6-31g+(d).inp 052932551.td-b3lyp_6-31g+(d).log.xz

052932551.td-b3lyp_6-31+g(d).qchem.inp (generated)

052932551.td-b3lyp_6-31+g(d).gjf (generated)

052932551.td-b3lyp_6-31+g(d).firefly.inp (generated)

052932551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052932551.mol 052932551.PUBCHEM 052932551.mol (via Jmol)
052933084.b3lyp_6-31g(d).inp

052933084.b3lyp_6-31g(d).qchem.inp (generated)

052933084.b3lyp_6-31g(d).gjf (generated)

052933084.b3lyp_6-31g(d).firefly.inp (generated)

052933084.b3lyp_6-31g(d).smash.inp (generated)

052933084.b3lyp_6-31g(d).nwchem.inp (generated) 052933084.b3lyp_6-31g(d).log.xz 052933084.td-b3lyp_6-31g+(d).inp 052933084.td-b3lyp_6-31g+(d).log.xz

052933084.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933084.td-b3lyp_6-31+g(d).gjf (generated)

052933084.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933084.mol 052933084.PUBCHEM 052933084.mol (via Jmol)
052933085.b3lyp_6-31g(d).inp

052933085.b3lyp_6-31g(d).qchem.inp (generated)

052933085.b3lyp_6-31g(d).gjf (generated)

052933085.b3lyp_6-31g(d).firefly.inp (generated)

052933085.b3lyp_6-31g(d).smash.inp (generated)

052933085.b3lyp_6-31g(d).nwchem.inp (generated) 052933085.b3lyp_6-31g(d).log.xz 052933085.td-b3lyp_6-31g+(d).inp 052933085.td-b3lyp_6-31g+(d).log.xz

052933085.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933085.td-b3lyp_6-31+g(d).gjf (generated)

052933085.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933085.mol 052933085.PUBCHEM 052933085.mol (via Jmol)
052933106.b3lyp_6-31g(d).inp

052933106.b3lyp_6-31g(d).qchem.inp (generated)

052933106.b3lyp_6-31g(d).gjf (generated)

052933106.b3lyp_6-31g(d).firefly.inp (generated)

052933106.b3lyp_6-31g(d).smash.inp (generated)

052933106.b3lyp_6-31g(d).nwchem.inp (generated) 052933106.b3lyp_6-31g(d).log.xz 052933106.td-b3lyp_6-31g+(d).inp 052933106.td-b3lyp_6-31g+(d).log.xz

052933106.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933106.td-b3lyp_6-31+g(d).gjf (generated)

052933106.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933106.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933106.mol 052933106.PUBCHEM 052933106.mol (via Jmol)
052933199.b3lyp_6-31g(d).inp

052933199.b3lyp_6-31g(d).qchem.inp (generated)

052933199.b3lyp_6-31g(d).gjf (generated)

052933199.b3lyp_6-31g(d).firefly.inp (generated)

052933199.b3lyp_6-31g(d).smash.inp (generated)

052933199.b3lyp_6-31g(d).nwchem.inp (generated) 052933199.b3lyp_6-31g(d).log.xz 052933199.td-b3lyp_6-31g+(d).inp 052933199.td-b3lyp_6-31g+(d).log.xz

052933199.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933199.td-b3lyp_6-31+g(d).gjf (generated)

052933199.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933199.mol 052933199.PUBCHEM 052933199.mol (via Jmol)
052933223.b3lyp_6-31g(d).inp

052933223.b3lyp_6-31g(d).qchem.inp (generated)

052933223.b3lyp_6-31g(d).gjf (generated)

052933223.b3lyp_6-31g(d).firefly.inp (generated)

052933223.b3lyp_6-31g(d).smash.inp (generated)

052933223.b3lyp_6-31g(d).nwchem.inp (generated) 052933223.b3lyp_6-31g(d).log.xz 052933223.td-b3lyp_6-31g+(d).inp 052933223.td-b3lyp_6-31g+(d).log.xz

052933223.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933223.td-b3lyp_6-31+g(d).gjf (generated)

052933223.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933223.mol 052933223.PUBCHEM 052933223.mol (via Jmol)
052933224.b3lyp_6-31g(d).inp

052933224.b3lyp_6-31g(d).qchem.inp (generated)

052933224.b3lyp_6-31g(d).gjf (generated)

052933224.b3lyp_6-31g(d).firefly.inp (generated)

052933224.b3lyp_6-31g(d).smash.inp (generated)

052933224.b3lyp_6-31g(d).nwchem.inp (generated) 052933224.b3lyp_6-31g(d).log.xz 052933224.td-b3lyp_6-31g+(d).inp 052933224.td-b3lyp_6-31g+(d).log.xz

052933224.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933224.td-b3lyp_6-31+g(d).gjf (generated)

052933224.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933224.mol 052933224.PUBCHEM 052933224.mol (via Jmol)
052933225.b3lyp_6-31g(d).inp

052933225.b3lyp_6-31g(d).qchem.inp (generated)

052933225.b3lyp_6-31g(d).gjf (generated)

052933225.b3lyp_6-31g(d).firefly.inp (generated)

052933225.b3lyp_6-31g(d).smash.inp (generated)

052933225.b3lyp_6-31g(d).nwchem.inp (generated) 052933225.b3lyp_6-31g(d).log.xz 052933225.td-b3lyp_6-31g+(d).inp 052933225.td-b3lyp_6-31g+(d).log.xz

052933225.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933225.td-b3lyp_6-31+g(d).gjf (generated)

052933225.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933225.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933225.mol 052933225.PUBCHEM 052933225.mol (via Jmol)
052933226.b3lyp_6-31g(d).inp

052933226.b3lyp_6-31g(d).qchem.inp (generated)

052933226.b3lyp_6-31g(d).gjf (generated)

052933226.b3lyp_6-31g(d).firefly.inp (generated)

052933226.b3lyp_6-31g(d).smash.inp (generated)

052933226.b3lyp_6-31g(d).nwchem.inp (generated) 052933226.b3lyp_6-31g(d).log.xz 052933226.td-b3lyp_6-31g+(d).inp 052933226.td-b3lyp_6-31g+(d).log.xz

052933226.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933226.td-b3lyp_6-31+g(d).gjf (generated)

052933226.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933226.mol 052933226.PUBCHEM 052933226.mol (via Jmol)
052933227.b3lyp_6-31g(d).inp

052933227.b3lyp_6-31g(d).qchem.inp (generated)

052933227.b3lyp_6-31g(d).gjf (generated)

052933227.b3lyp_6-31g(d).firefly.inp (generated)

052933227.b3lyp_6-31g(d).smash.inp (generated)

052933227.b3lyp_6-31g(d).nwchem.inp (generated) 052933227.b3lyp_6-31g(d).log.xz 052933227.td-b3lyp_6-31g+(d).inp 052933227.td-b3lyp_6-31g+(d).log.xz

052933227.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933227.td-b3lyp_6-31+g(d).gjf (generated)

052933227.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933227.mol 052933227.PUBCHEM 052933227.mol (via Jmol)
052933319.b3lyp_6-31g(d).inp

052933319.b3lyp_6-31g(d).qchem.inp (generated)

052933319.b3lyp_6-31g(d).gjf (generated)

052933319.b3lyp_6-31g(d).firefly.inp (generated)

052933319.b3lyp_6-31g(d).smash.inp (generated)

052933319.b3lyp_6-31g(d).nwchem.inp (generated) 052933319.b3lyp_6-31g(d).log.xz 052933319.td-b3lyp_6-31g+(d).inp 052933319.td-b3lyp_6-31g+(d).log.xz

052933319.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933319.td-b3lyp_6-31+g(d).gjf (generated)

052933319.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933319.mol 052933319.PUBCHEM 052933319.mol (via Jmol)
052933320.b3lyp_6-31g(d).inp

052933320.b3lyp_6-31g(d).qchem.inp (generated)

052933320.b3lyp_6-31g(d).gjf (generated)

052933320.b3lyp_6-31g(d).firefly.inp (generated)

052933320.b3lyp_6-31g(d).smash.inp (generated)

052933320.b3lyp_6-31g(d).nwchem.inp (generated) 052933320.b3lyp_6-31g(d).log.xz 052933320.td-b3lyp_6-31g+(d).inp 052933320.td-b3lyp_6-31g+(d).log.xz

052933320.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933320.td-b3lyp_6-31+g(d).gjf (generated)

052933320.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933320.mol 052933320.PUBCHEM 052933320.mol (via Jmol)
052933322.b3lyp_6-31g(d).inp

052933322.b3lyp_6-31g(d).qchem.inp (generated)

052933322.b3lyp_6-31g(d).gjf (generated)

052933322.b3lyp_6-31g(d).firefly.inp (generated)

052933322.b3lyp_6-31g(d).smash.inp (generated)

052933322.b3lyp_6-31g(d).nwchem.inp (generated) 052933322.b3lyp_6-31g(d).log.xz 052933322.td-b3lyp_6-31g+(d).inp 052933322.td-b3lyp_6-31g+(d).log.xz

052933322.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933322.td-b3lyp_6-31+g(d).gjf (generated)

052933322.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933322.mol 052933322.PUBCHEM 052933322.mol (via Jmol)
052933323.b3lyp_6-31g(d).inp

052933323.b3lyp_6-31g(d).qchem.inp (generated)

052933323.b3lyp_6-31g(d).gjf (generated)

052933323.b3lyp_6-31g(d).firefly.inp (generated)

052933323.b3lyp_6-31g(d).smash.inp (generated)

052933323.b3lyp_6-31g(d).nwchem.inp (generated) 052933323.b3lyp_6-31g(d).log.xz 052933323.td-b3lyp_6-31g+(d).inp 052933323.td-b3lyp_6-31g+(d).log.xz

052933323.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933323.td-b3lyp_6-31+g(d).gjf (generated)

052933323.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933323.mol 052933323.PUBCHEM 052933323.mol (via Jmol)
052933324.b3lyp_6-31g(d).inp

052933324.b3lyp_6-31g(d).qchem.inp (generated)

052933324.b3lyp_6-31g(d).gjf (generated)

052933324.b3lyp_6-31g(d).firefly.inp (generated)

052933324.b3lyp_6-31g(d).smash.inp (generated)

052933324.b3lyp_6-31g(d).nwchem.inp (generated) 052933324.b3lyp_6-31g(d).log.xz 052933324.td-b3lyp_6-31g+(d).inp 052933324.td-b3lyp_6-31g+(d).log.xz

052933324.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933324.td-b3lyp_6-31+g(d).gjf (generated)

052933324.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933324.mol 052933324.PUBCHEM 052933324.mol (via Jmol)
052933327.b3lyp_6-31g(d).inp

052933327.b3lyp_6-31g(d).qchem.inp (generated)

052933327.b3lyp_6-31g(d).gjf (generated)

052933327.b3lyp_6-31g(d).firefly.inp (generated)

052933327.b3lyp_6-31g(d).smash.inp (generated)

052933327.b3lyp_6-31g(d).nwchem.inp (generated) 052933327.b3lyp_6-31g(d).log.xz 052933327.td-b3lyp_6-31g+(d).inp 052933327.td-b3lyp_6-31g+(d).log.xz

052933327.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933327.td-b3lyp_6-31+g(d).gjf (generated)

052933327.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933327.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933327.mol 052933327.PUBCHEM 052933327.mol (via Jmol)
052933345.b3lyp_6-31g(d).inp

052933345.b3lyp_6-31g(d).qchem.inp (generated)

052933345.b3lyp_6-31g(d).gjf (generated)

052933345.b3lyp_6-31g(d).firefly.inp (generated)

052933345.b3lyp_6-31g(d).smash.inp (generated)

052933345.b3lyp_6-31g(d).nwchem.inp (generated) 052933345.b3lyp_6-31g(d).log.xz 052933345.mol 052933345.PUBCHEM 052933345.mol (via Jmol)
052933346.b3lyp_6-31g(d).inp

052933346.b3lyp_6-31g(d).qchem.inp (generated)

052933346.b3lyp_6-31g(d).gjf (generated)

052933346.b3lyp_6-31g(d).firefly.inp (generated)

052933346.b3lyp_6-31g(d).smash.inp (generated)

052933346.b3lyp_6-31g(d).nwchem.inp (generated) 052933346.b3lyp_6-31g(d).log.xz 052933346.mol 052933346.PUBCHEM 052933346.mol (via Jmol)
052933348.b3lyp_6-31g(d).inp

052933348.b3lyp_6-31g(d).qchem.inp (generated)

052933348.b3lyp_6-31g(d).gjf (generated)

052933348.b3lyp_6-31g(d).firefly.inp (generated)

052933348.b3lyp_6-31g(d).smash.inp (generated)

052933348.b3lyp_6-31g(d).nwchem.inp (generated) 052933348.b3lyp_6-31g(d).log.xz 052933348.mol 052933348.PUBCHEM 052933348.mol (via Jmol)
052933448.b3lyp_6-31g(d).inp

052933448.b3lyp_6-31g(d).qchem.inp (generated)

052933448.b3lyp_6-31g(d).gjf (generated)

052933448.b3lyp_6-31g(d).firefly.inp (generated)

052933448.b3lyp_6-31g(d).smash.inp (generated)

052933448.b3lyp_6-31g(d).nwchem.inp (generated) 052933448.b3lyp_6-31g(d).log.xz 052933448.td-b3lyp_6-31g+(d).inp 052933448.td-b3lyp_6-31g+(d).log.xz

052933448.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933448.td-b3lyp_6-31+g(d).gjf (generated)

052933448.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933448.mol 052933448.PUBCHEM 052933448.mol (via Jmol)
052933465.b3lyp_6-31g(d).inp

052933465.b3lyp_6-31g(d).qchem.inp (generated)

052933465.b3lyp_6-31g(d).gjf (generated)

052933465.b3lyp_6-31g(d).firefly.inp (generated)

052933465.b3lyp_6-31g(d).smash.inp (generated)

052933465.b3lyp_6-31g(d).nwchem.inp (generated) 052933465.b3lyp_6-31g(d).log.xz 052933465.mol 052933465.PUBCHEM 052933465.mol (via Jmol)
052933467.b3lyp_6-31g(d).inp

052933467.b3lyp_6-31g(d).qchem.inp (generated)

052933467.b3lyp_6-31g(d).gjf (generated)

052933467.b3lyp_6-31g(d).firefly.inp (generated)

052933467.b3lyp_6-31g(d).smash.inp (generated)

052933467.b3lyp_6-31g(d).nwchem.inp (generated) 052933467.b3lyp_6-31g(d).log.xz 052933467.td-b3lyp_6-31g+(d).inp 052933467.td-b3lyp_6-31g+(d).log.xz

052933467.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933467.td-b3lyp_6-31+g(d).gjf (generated)

052933467.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933467.mol 052933467.PUBCHEM 052933467.mol (via Jmol)
052933468.b3lyp_6-31g(d).inp

052933468.b3lyp_6-31g(d).qchem.inp (generated)

052933468.b3lyp_6-31g(d).gjf (generated)

052933468.b3lyp_6-31g(d).firefly.inp (generated)

052933468.b3lyp_6-31g(d).smash.inp (generated)

052933468.b3lyp_6-31g(d).nwchem.inp (generated) 052933468.b3lyp_6-31g(d).log.xz 052933468.td-b3lyp_6-31g+(d).inp 052933468.td-b3lyp_6-31g+(d).log.xz

052933468.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933468.td-b3lyp_6-31+g(d).gjf (generated)

052933468.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933468.mol 052933468.PUBCHEM 052933468.mol (via Jmol)
052933469.b3lyp_6-31g(d).inp

052933469.b3lyp_6-31g(d).qchem.inp (generated)

052933469.b3lyp_6-31g(d).gjf (generated)

052933469.b3lyp_6-31g(d).firefly.inp (generated)

052933469.b3lyp_6-31g(d).smash.inp (generated)

052933469.b3lyp_6-31g(d).nwchem.inp (generated) 052933469.b3lyp_6-31g(d).log.xz 052933469.td-b3lyp_6-31g+(d).inp 052933469.td-b3lyp_6-31g+(d).log.xz

052933469.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933469.td-b3lyp_6-31+g(d).gjf (generated)

052933469.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933469.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933469.mol 052933469.PUBCHEM 052933469.mol (via Jmol)
052933522.b3lyp_6-31g(d).inp

052933522.b3lyp_6-31g(d).qchem.inp (generated)

052933522.b3lyp_6-31g(d).gjf (generated)

052933522.b3lyp_6-31g(d).firefly.inp (generated)

052933522.b3lyp_6-31g(d).smash.inp (generated)

052933522.b3lyp_6-31g(d).nwchem.inp (generated) 052933522.b3lyp_6-31g(d).log.xz 052933522.td-b3lyp_6-31g+(d).inp 052933522.td-b3lyp_6-31g+(d).log.xz

052933522.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933522.td-b3lyp_6-31+g(d).gjf (generated)

052933522.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933522.mol 052933522.PUBCHEM 052933522.mol (via Jmol)
052933525.b3lyp_6-31g(d).inp

052933525.b3lyp_6-31g(d).qchem.inp (generated)

052933525.b3lyp_6-31g(d).gjf (generated)

052933525.b3lyp_6-31g(d).firefly.inp (generated)

052933525.b3lyp_6-31g(d).smash.inp (generated)

052933525.b3lyp_6-31g(d).nwchem.inp (generated) 052933525.b3lyp_6-31g(d).log.xz 052933525.mol 052933525.PUBCHEM 052933525.mol (via Jmol)
052933526.b3lyp_6-31g(d).inp

052933526.b3lyp_6-31g(d).qchem.inp (generated)

052933526.b3lyp_6-31g(d).gjf (generated)

052933526.b3lyp_6-31g(d).firefly.inp (generated)

052933526.b3lyp_6-31g(d).smash.inp (generated)

052933526.b3lyp_6-31g(d).nwchem.inp (generated) 052933526.b3lyp_6-31g(d).log.xz 052933526.td-b3lyp_6-31g+(d).inp 052933526.td-b3lyp_6-31g+(d).log.xz

052933526.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933526.td-b3lyp_6-31+g(d).gjf (generated)

052933526.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933526.mol 052933526.PUBCHEM 052933526.mol (via Jmol)
052933564.b3lyp_6-31g(d).inp

052933564.b3lyp_6-31g(d).qchem.inp (generated)

052933564.b3lyp_6-31g(d).gjf (generated)

052933564.b3lyp_6-31g(d).firefly.inp (generated)

052933564.b3lyp_6-31g(d).smash.inp (generated)

052933564.b3lyp_6-31g(d).nwchem.inp (generated) 052933564.b3lyp_6-31g(d).log.xz 052933564.td-b3lyp_6-31g+(d).inp 052933564.td-b3lyp_6-31g+(d).log.xz

052933564.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933564.td-b3lyp_6-31+g(d).gjf (generated)

052933564.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933564.mol 052933564.PUBCHEM 052933564.mol (via Jmol)
052933565.b3lyp_6-31g(d).inp

052933565.b3lyp_6-31g(d).qchem.inp (generated)

052933565.b3lyp_6-31g(d).gjf (generated)

052933565.b3lyp_6-31g(d).firefly.inp (generated)

052933565.b3lyp_6-31g(d).smash.inp (generated)

052933565.b3lyp_6-31g(d).nwchem.inp (generated) 052933565.b3lyp_6-31g(d).log.xz 052933565.td-b3lyp_6-31g+(d).inp 052933565.td-b3lyp_6-31g+(d).log.xz

052933565.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933565.td-b3lyp_6-31+g(d).gjf (generated)

052933565.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933565.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933565.mol 052933565.PUBCHEM 052933565.mol (via Jmol)
052933568.b3lyp_6-31g(d).inp

052933568.b3lyp_6-31g(d).qchem.inp (generated)

052933568.b3lyp_6-31g(d).gjf (generated)

052933568.b3lyp_6-31g(d).firefly.inp (generated)

052933568.b3lyp_6-31g(d).smash.inp (generated)

052933568.b3lyp_6-31g(d).nwchem.inp (generated) 052933568.b3lyp_6-31g(d).log.xz 052933568.td-b3lyp_6-31g+(d).inp 052933568.td-b3lyp_6-31g+(d).log.xz

052933568.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933568.td-b3lyp_6-31+g(d).gjf (generated)

052933568.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933568.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933568.mol 052933568.PUBCHEM 052933568.mol (via Jmol)
052933569.b3lyp_6-31g(d).inp

052933569.b3lyp_6-31g(d).qchem.inp (generated)

052933569.b3lyp_6-31g(d).gjf (generated)

052933569.b3lyp_6-31g(d).firefly.inp (generated)

052933569.b3lyp_6-31g(d).smash.inp (generated)

052933569.b3lyp_6-31g(d).nwchem.inp (generated) 052933569.b3lyp_6-31g(d).log.xz 052933569.td-b3lyp_6-31g+(d).inp 052933569.td-b3lyp_6-31g+(d).log.xz

052933569.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933569.td-b3lyp_6-31+g(d).gjf (generated)

052933569.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933569.mol 052933569.PUBCHEM 052933569.mol (via Jmol)
052933570.b3lyp_6-31g(d).inp

052933570.b3lyp_6-31g(d).qchem.inp (generated)

052933570.b3lyp_6-31g(d).gjf (generated)

052933570.b3lyp_6-31g(d).firefly.inp (generated)

052933570.b3lyp_6-31g(d).smash.inp (generated)

052933570.b3lyp_6-31g(d).nwchem.inp (generated) 052933570.b3lyp_6-31g(d).log.xz 052933570.td-b3lyp_6-31g+(d).inp 052933570.td-b3lyp_6-31g+(d).log.xz

052933570.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933570.td-b3lyp_6-31+g(d).gjf (generated)

052933570.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933570.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933570.mol 052933570.PUBCHEM 052933570.mol (via Jmol)
052933572.b3lyp_6-31g(d).inp

052933572.b3lyp_6-31g(d).qchem.inp (generated)

052933572.b3lyp_6-31g(d).gjf (generated)

052933572.b3lyp_6-31g(d).firefly.inp (generated)

052933572.b3lyp_6-31g(d).smash.inp (generated)

052933572.b3lyp_6-31g(d).nwchem.inp (generated) 052933572.b3lyp_6-31g(d).log.xz 052933572.td-b3lyp_6-31g+(d).inp 052933572.td-b3lyp_6-31g+(d).log.xz

052933572.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933572.td-b3lyp_6-31+g(d).gjf (generated)

052933572.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933572.mol 052933572.PUBCHEM 052933572.mol (via Jmol)
052933574.b3lyp_6-31g(d).inp

052933574.b3lyp_6-31g(d).qchem.inp (generated)

052933574.b3lyp_6-31g(d).gjf (generated)

052933574.b3lyp_6-31g(d).firefly.inp (generated)

052933574.b3lyp_6-31g(d).smash.inp (generated)

052933574.b3lyp_6-31g(d).nwchem.inp (generated) 052933574.b3lyp_6-31g(d).log.xz 052933574.td-b3lyp_6-31g+(d).inp 052933574.td-b3lyp_6-31g+(d).log.xz

052933574.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933574.td-b3lyp_6-31+g(d).gjf (generated)

052933574.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933574.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933574.mol 052933574.PUBCHEM 052933574.mol (via Jmol)
052933716.b3lyp_6-31g(d).inp

052933716.b3lyp_6-31g(d).qchem.inp (generated)

052933716.b3lyp_6-31g(d).gjf (generated)

052933716.b3lyp_6-31g(d).firefly.inp (generated)

052933716.b3lyp_6-31g(d).smash.inp (generated)

052933716.b3lyp_6-31g(d).nwchem.inp (generated) 052933716.b3lyp_6-31g(d).log.xz 052933716.td-b3lyp_6-31g+(d).inp 052933716.td-b3lyp_6-31g+(d).log.xz

052933716.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933716.td-b3lyp_6-31+g(d).gjf (generated)

052933716.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933716.mol 052933716.PUBCHEM 052933716.mol (via Jmol)
052933720.b3lyp_6-31g(d).inp

052933720.b3lyp_6-31g(d).qchem.inp (generated)

052933720.b3lyp_6-31g(d).gjf (generated)

052933720.b3lyp_6-31g(d).firefly.inp (generated)

052933720.b3lyp_6-31g(d).smash.inp (generated)

052933720.b3lyp_6-31g(d).nwchem.inp (generated) 052933720.b3lyp_6-31g(d).log.xz 052933720.mol 052933720.PUBCHEM 052933720.mol (via Jmol)
052933780.b3lyp_6-31g(d).inp

052933780.b3lyp_6-31g(d).qchem.inp (generated)

052933780.b3lyp_6-31g(d).gjf (generated)

052933780.b3lyp_6-31g(d).firefly.inp (generated)

052933780.b3lyp_6-31g(d).smash.inp (generated)

052933780.b3lyp_6-31g(d).nwchem.inp (generated) 052933780.b3lyp_6-31g(d).log.xz 052933780.td-b3lyp_6-31g+(d).inp 052933780.td-b3lyp_6-31g+(d).log.xz

052933780.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933780.td-b3lyp_6-31+g(d).gjf (generated)

052933780.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933780.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933780.mol 052933780.PUBCHEM 052933780.mol (via Jmol)
052933811.b3lyp_6-31g(d).inp

052933811.b3lyp_6-31g(d).qchem.inp (generated)

052933811.b3lyp_6-31g(d).gjf (generated)

052933811.b3lyp_6-31g(d).firefly.inp (generated)

052933811.b3lyp_6-31g(d).smash.inp (generated)

052933811.b3lyp_6-31g(d).nwchem.inp (generated) 052933811.b3lyp_6-31g(d).log.xz 052933811.td-b3lyp_6-31g+(d).inp 052933811.td-b3lyp_6-31g+(d).log.xz

052933811.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933811.td-b3lyp_6-31+g(d).gjf (generated)

052933811.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933811.mol 052933811.PUBCHEM 052933811.mol (via Jmol)
052933832.b3lyp_6-31g(d).inp

052933832.b3lyp_6-31g(d).qchem.inp (generated)

052933832.b3lyp_6-31g(d).gjf (generated)

052933832.b3lyp_6-31g(d).firefly.inp (generated)

052933832.b3lyp_6-31g(d).smash.inp (generated)

052933832.b3lyp_6-31g(d).nwchem.inp (generated) 052933832.b3lyp_6-31g(d).log.xz 052933832.td-b3lyp_6-31g+(d).inp 052933832.td-b3lyp_6-31g+(d).log.xz

052933832.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933832.td-b3lyp_6-31+g(d).gjf (generated)

052933832.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933832.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933832.mol 052933832.PUBCHEM 052933832.mol (via Jmol)
052933834.b3lyp_6-31g(d).inp

052933834.b3lyp_6-31g(d).qchem.inp (generated)

052933834.b3lyp_6-31g(d).gjf (generated)

052933834.b3lyp_6-31g(d).firefly.inp (generated)

052933834.b3lyp_6-31g(d).smash.inp (generated)

052933834.b3lyp_6-31g(d).nwchem.inp (generated) 052933834.b3lyp_6-31g(d).log.xz 052933834.td-b3lyp_6-31g+(d).inp 052933834.td-b3lyp_6-31g+(d).log.xz

052933834.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933834.td-b3lyp_6-31+g(d).gjf (generated)

052933834.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933834.mol 052933834.PUBCHEM 052933834.mol (via Jmol)
052933836.b3lyp_6-31g(d).inp

052933836.b3lyp_6-31g(d).qchem.inp (generated)

052933836.b3lyp_6-31g(d).gjf (generated)

052933836.b3lyp_6-31g(d).firefly.inp (generated)

052933836.b3lyp_6-31g(d).smash.inp (generated)

052933836.b3lyp_6-31g(d).nwchem.inp (generated) 052933836.b3lyp_6-31g(d).log.xz 052933836.td-b3lyp_6-31g+(d).inp 052933836.td-b3lyp_6-31g+(d).log.xz

052933836.td-b3lyp_6-31+g(d).qchem.inp (generated)

052933836.td-b3lyp_6-31+g(d).gjf (generated)

052933836.td-b3lyp_6-31+g(d).firefly.inp (generated)

052933836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052933836.mol 052933836.PUBCHEM 052933836.mol (via Jmol)
052935391.b3lyp_6-31g(d).inp

052935391.b3lyp_6-31g(d).qchem.inp (generated)

052935391.b3lyp_6-31g(d).gjf (generated)

052935391.b3lyp_6-31g(d).firefly.inp (generated)

052935391.b3lyp_6-31g(d).smash.inp (generated)

052935391.b3lyp_6-31g(d).nwchem.inp (generated) 052935391.b3lyp_6-31g(d).log.xz 052935391.td-b3lyp_6-31g+(d).inp 052935391.td-b3lyp_6-31g+(d).log.xz

052935391.td-b3lyp_6-31+g(d).qchem.inp (generated)

052935391.td-b3lyp_6-31+g(d).gjf (generated)

052935391.td-b3lyp_6-31+g(d).firefly.inp (generated)

052935391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052935391.mol 052935391.PUBCHEM 052935391.mol (via Jmol)
052935392.b3lyp_6-31g(d).inp

052935392.b3lyp_6-31g(d).qchem.inp (generated)

052935392.b3lyp_6-31g(d).gjf (generated)

052935392.b3lyp_6-31g(d).firefly.inp (generated)

052935392.b3lyp_6-31g(d).smash.inp (generated)

052935392.b3lyp_6-31g(d).nwchem.inp (generated) 052935392.b3lyp_6-31g(d).log.xz 052935392.td-b3lyp_6-31g+(d).inp 052935392.td-b3lyp_6-31g+(d).log.xz

052935392.td-b3lyp_6-31+g(d).qchem.inp (generated)

052935392.td-b3lyp_6-31+g(d).gjf (generated)

052935392.td-b3lyp_6-31+g(d).firefly.inp (generated)

052935392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052935392.mol 052935392.PUBCHEM 052935392.mol (via Jmol)
052935473.b3lyp_6-31g(d).inp

052935473.b3lyp_6-31g(d).qchem.inp (generated)

052935473.b3lyp_6-31g(d).gjf (generated)

052935473.b3lyp_6-31g(d).firefly.inp (generated)

052935473.b3lyp_6-31g(d).smash.inp (generated)

052935473.b3lyp_6-31g(d).nwchem.inp (generated) 052935473.b3lyp_6-31g(d).log.xz 052935473.td-b3lyp_6-31g+(d).inp 052935473.td-b3lyp_6-31g+(d).log.xz

052935473.td-b3lyp_6-31+g(d).qchem.inp (generated)

052935473.td-b3lyp_6-31+g(d).gjf (generated)

052935473.td-b3lyp_6-31+g(d).firefly.inp (generated)

052935473.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052935473.mol 052935473.PUBCHEM 052935473.mol (via Jmol)
052936167.b3lyp_6-31g(d).inp

052936167.b3lyp_6-31g(d).qchem.inp (generated)

052936167.b3lyp_6-31g(d).gjf (generated)

052936167.b3lyp_6-31g(d).firefly.inp (generated)

052936167.b3lyp_6-31g(d).smash.inp (generated)

052936167.b3lyp_6-31g(d).nwchem.inp (generated) 052936167.b3lyp_6-31g(d).log.xz 052936167.td-b3lyp_6-31g+(d).inp 052936167.td-b3lyp_6-31g+(d).log.xz

052936167.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936167.td-b3lyp_6-31+g(d).gjf (generated)

052936167.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936167.mol 052936167.PUBCHEM 052936167.mol (via Jmol)
052936345.b3lyp_6-31g(d).inp

052936345.b3lyp_6-31g(d).qchem.inp (generated)

052936345.b3lyp_6-31g(d).gjf (generated)

052936345.b3lyp_6-31g(d).firefly.inp (generated)

052936345.b3lyp_6-31g(d).smash.inp (generated)

052936345.b3lyp_6-31g(d).nwchem.inp (generated) 052936345.b3lyp_6-31g(d).log.xz 052936345.td-b3lyp_6-31g+(d).inp 052936345.td-b3lyp_6-31g+(d).log.xz

052936345.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936345.td-b3lyp_6-31+g(d).gjf (generated)

052936345.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936345.mol 052936345.PUBCHEM 052936345.mol (via Jmol)
052936346.b3lyp_6-31g(d).inp

052936346.b3lyp_6-31g(d).qchem.inp (generated)

052936346.b3lyp_6-31g(d).gjf (generated)

052936346.b3lyp_6-31g(d).firefly.inp (generated)

052936346.b3lyp_6-31g(d).smash.inp (generated)

052936346.b3lyp_6-31g(d).nwchem.inp (generated) 052936346.b3lyp_6-31g(d).log.xz 052936346.td-b3lyp_6-31g+(d).inp 052936346.td-b3lyp_6-31g+(d).log.xz

052936346.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936346.td-b3lyp_6-31+g(d).gjf (generated)

052936346.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936346.mol 052936346.PUBCHEM 052936346.mol (via Jmol)
052936348.b3lyp_6-31g(d).inp

052936348.b3lyp_6-31g(d).qchem.inp (generated)

052936348.b3lyp_6-31g(d).gjf (generated)

052936348.b3lyp_6-31g(d).firefly.inp (generated)

052936348.b3lyp_6-31g(d).smash.inp (generated)

052936348.b3lyp_6-31g(d).nwchem.inp (generated) 052936348.b3lyp_6-31g(d).log.xz 052936348.td-b3lyp_6-31g+(d).inp 052936348.td-b3lyp_6-31g+(d).log.xz

052936348.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936348.td-b3lyp_6-31+g(d).gjf (generated)

052936348.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936348.mol 052936348.PUBCHEM 052936348.mol (via Jmol)
052936350.b3lyp_6-31g(d).inp

052936350.b3lyp_6-31g(d).qchem.inp (generated)

052936350.b3lyp_6-31g(d).gjf (generated)

052936350.b3lyp_6-31g(d).firefly.inp (generated)

052936350.b3lyp_6-31g(d).smash.inp (generated)

052936350.b3lyp_6-31g(d).nwchem.inp (generated) 052936350.b3lyp_6-31g(d).log.xz 052936350.td-b3lyp_6-31g+(d).inp 052936350.td-b3lyp_6-31g+(d).log.xz

052936350.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936350.td-b3lyp_6-31+g(d).gjf (generated)

052936350.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936350.mol 052936350.PUBCHEM 052936350.mol (via Jmol)
052936351.b3lyp_6-31g(d).inp

052936351.b3lyp_6-31g(d).qchem.inp (generated)

052936351.b3lyp_6-31g(d).gjf (generated)

052936351.b3lyp_6-31g(d).firefly.inp (generated)

052936351.b3lyp_6-31g(d).smash.inp (generated)

052936351.b3lyp_6-31g(d).nwchem.inp (generated) 052936351.b3lyp_6-31g(d).log.xz 052936351.td-b3lyp_6-31g+(d).inp 052936351.td-b3lyp_6-31g+(d).log.xz

052936351.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936351.td-b3lyp_6-31+g(d).gjf (generated)

052936351.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936351.mol 052936351.PUBCHEM 052936351.mol (via Jmol)
052936365.b3lyp_6-31g(d).inp

052936365.b3lyp_6-31g(d).qchem.inp (generated)

052936365.b3lyp_6-31g(d).gjf (generated)

052936365.b3lyp_6-31g(d).firefly.inp (generated)

052936365.b3lyp_6-31g(d).smash.inp (generated)

052936365.b3lyp_6-31g(d).nwchem.inp (generated) 052936365.b3lyp_6-31g(d).log.xz 052936365.td-b3lyp_6-31g+(d).inp 052936365.td-b3lyp_6-31g+(d).log.xz

052936365.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936365.td-b3lyp_6-31+g(d).gjf (generated)

052936365.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936365.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936365.mol 052936365.PUBCHEM 052936365.mol (via Jmol)
052936368.b3lyp_6-31g(d).inp

052936368.b3lyp_6-31g(d).qchem.inp (generated)

052936368.b3lyp_6-31g(d).gjf (generated)

052936368.b3lyp_6-31g(d).firefly.inp (generated)

052936368.b3lyp_6-31g(d).smash.inp (generated)

052936368.b3lyp_6-31g(d).nwchem.inp (generated) 052936368.b3lyp_6-31g(d).log.xz 052936368.td-b3lyp_6-31g+(d).inp 052936368.td-b3lyp_6-31g+(d).log.xz

052936368.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936368.td-b3lyp_6-31+g(d).gjf (generated)

052936368.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936368.mol 052936368.PUBCHEM 052936368.mol (via Jmol)
052936374.b3lyp_6-31g(d).inp

052936374.b3lyp_6-31g(d).qchem.inp (generated)

052936374.b3lyp_6-31g(d).gjf (generated)

052936374.b3lyp_6-31g(d).firefly.inp (generated)

052936374.b3lyp_6-31g(d).smash.inp (generated)

052936374.b3lyp_6-31g(d).nwchem.inp (generated) 052936374.b3lyp_6-31g(d).log.xz 052936374.mol 052936374.PUBCHEM 052936374.mol (via Jmol)
052936383.b3lyp_6-31g(d).inp

052936383.b3lyp_6-31g(d).qchem.inp (generated)

052936383.b3lyp_6-31g(d).gjf (generated)

052936383.b3lyp_6-31g(d).firefly.inp (generated)

052936383.b3lyp_6-31g(d).smash.inp (generated)

052936383.b3lyp_6-31g(d).nwchem.inp (generated) 052936383.b3lyp_6-31g(d).log.xz 052936383.mol 052936383.PUBCHEM 052936383.mol (via Jmol)
052936425.b3lyp_6-31g(d).inp

052936425.b3lyp_6-31g(d).qchem.inp (generated)

052936425.b3lyp_6-31g(d).gjf (generated)

052936425.b3lyp_6-31g(d).firefly.inp (generated)

052936425.b3lyp_6-31g(d).smash.inp (generated)

052936425.b3lyp_6-31g(d).nwchem.inp (generated) 052936425.b3lyp_6-31g(d).log.xz 052936425.mol 052936425.PUBCHEM 052936425.mol (via Jmol)
052936430.b3lyp_6-31g(d).inp

052936430.b3lyp_6-31g(d).qchem.inp (generated)

052936430.b3lyp_6-31g(d).gjf (generated)

052936430.b3lyp_6-31g(d).firefly.inp (generated)

052936430.b3lyp_6-31g(d).smash.inp (generated)

052936430.b3lyp_6-31g(d).nwchem.inp (generated) 052936430.b3lyp_6-31g(d).log.xz 052936430.td-b3lyp_6-31g+(d).inp 052936430.td-b3lyp_6-31g+(d).log.xz

052936430.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936430.td-b3lyp_6-31+g(d).gjf (generated)

052936430.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936430.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936430.mol 052936430.PUBCHEM 052936430.mol (via Jmol)
052936448.b3lyp_6-31g(d).inp

052936448.b3lyp_6-31g(d).qchem.inp (generated)

052936448.b3lyp_6-31g(d).gjf (generated)

052936448.b3lyp_6-31g(d).firefly.inp (generated)

052936448.b3lyp_6-31g(d).smash.inp (generated)

052936448.b3lyp_6-31g(d).nwchem.inp (generated) 052936448.b3lyp_6-31g(d).log.xz 052936448.td-b3lyp_6-31g+(d).inp 052936448.td-b3lyp_6-31g+(d).log.xz

052936448.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936448.td-b3lyp_6-31+g(d).gjf (generated)

052936448.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936448.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936448.mol 052936448.PUBCHEM 052936448.mol (via Jmol)
052936449.b3lyp_6-31g(d).inp

052936449.b3lyp_6-31g(d).qchem.inp (generated)

052936449.b3lyp_6-31g(d).gjf (generated)

052936449.b3lyp_6-31g(d).firefly.inp (generated)

052936449.b3lyp_6-31g(d).smash.inp (generated)

052936449.b3lyp_6-31g(d).nwchem.inp (generated) 052936449.b3lyp_6-31g(d).log.xz 052936449.td-b3lyp_6-31g+(d).inp 052936449.td-b3lyp_6-31g+(d).log.xz

052936449.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936449.td-b3lyp_6-31+g(d).gjf (generated)

052936449.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936449.mol 052936449.PUBCHEM 052936449.mol (via Jmol)
052936498.b3lyp_6-31g(d).inp

052936498.b3lyp_6-31g(d).qchem.inp (generated)

052936498.b3lyp_6-31g(d).gjf (generated)

052936498.b3lyp_6-31g(d).firefly.inp (generated)

052936498.b3lyp_6-31g(d).smash.inp (generated)

052936498.b3lyp_6-31g(d).nwchem.inp (generated) 052936498.b3lyp_6-31g(d).log.xz 052936498.td-b3lyp_6-31g+(d).inp 052936498.td-b3lyp_6-31g+(d).log.xz

052936498.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936498.td-b3lyp_6-31+g(d).gjf (generated)

052936498.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936498.mol 052936498.PUBCHEM 052936498.mol (via Jmol)
052936558.b3lyp_6-31g(d).inp

052936558.b3lyp_6-31g(d).qchem.inp (generated)

052936558.b3lyp_6-31g(d).gjf (generated)

052936558.b3lyp_6-31g(d).firefly.inp (generated)

052936558.b3lyp_6-31g(d).smash.inp (generated)

052936558.b3lyp_6-31g(d).nwchem.inp (generated) 052936558.b3lyp_6-31g(d).log.xz 052936558.td-b3lyp_6-31g+(d).inp 052936558.td-b3lyp_6-31g+(d).log.xz

052936558.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936558.td-b3lyp_6-31+g(d).gjf (generated)

052936558.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936558.mol 052936558.PUBCHEM 052936558.mol (via Jmol)
052936562.b3lyp_6-31g(d).inp

052936562.b3lyp_6-31g(d).qchem.inp (generated)

052936562.b3lyp_6-31g(d).gjf (generated)

052936562.b3lyp_6-31g(d).firefly.inp (generated)

052936562.b3lyp_6-31g(d).smash.inp (generated)

052936562.b3lyp_6-31g(d).nwchem.inp (generated) 052936562.b3lyp_6-31g(d).log.xz 052936562.td-b3lyp_6-31g+(d).inp 052936562.td-b3lyp_6-31g+(d).log.xz

052936562.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936562.td-b3lyp_6-31+g(d).gjf (generated)

052936562.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936562.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936562.mol 052936562.PUBCHEM 052936562.mol (via Jmol)
052936564.b3lyp_6-31g(d).inp

052936564.b3lyp_6-31g(d).qchem.inp (generated)

052936564.b3lyp_6-31g(d).gjf (generated)

052936564.b3lyp_6-31g(d).firefly.inp (generated)

052936564.b3lyp_6-31g(d).smash.inp (generated)

052936564.b3lyp_6-31g(d).nwchem.inp (generated) 052936564.b3lyp_6-31g(d).log.xz 052936564.td-b3lyp_6-31g+(d).inp 052936564.td-b3lyp_6-31g+(d).log.xz

052936564.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936564.td-b3lyp_6-31+g(d).gjf (generated)

052936564.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936564.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936564.mol 052936564.PUBCHEM 052936564.mol (via Jmol)
052936569.b3lyp_6-31g(d).inp

052936569.b3lyp_6-31g(d).qchem.inp (generated)

052936569.b3lyp_6-31g(d).gjf (generated)

052936569.b3lyp_6-31g(d).firefly.inp (generated)

052936569.b3lyp_6-31g(d).smash.inp (generated)

052936569.b3lyp_6-31g(d).nwchem.inp (generated) 052936569.b3lyp_6-31g(d).log.xz 052936569.td-b3lyp_6-31g+(d).inp 052936569.td-b3lyp_6-31g+(d).log.xz

052936569.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936569.td-b3lyp_6-31+g(d).gjf (generated)

052936569.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936569.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936569.mol 052936569.PUBCHEM 052936569.mol (via Jmol)
052936570.b3lyp_6-31g(d).inp

052936570.b3lyp_6-31g(d).qchem.inp (generated)

052936570.b3lyp_6-31g(d).gjf (generated)

052936570.b3lyp_6-31g(d).firefly.inp (generated)

052936570.b3lyp_6-31g(d).smash.inp (generated)

052936570.b3lyp_6-31g(d).nwchem.inp (generated) 052936570.b3lyp_6-31g(d).log.xz 052936570.mol 052936570.PUBCHEM 052936570.mol (via Jmol)
052936600.b3lyp_6-31g(d).inp

052936600.b3lyp_6-31g(d).qchem.inp (generated)

052936600.b3lyp_6-31g(d).gjf (generated)

052936600.b3lyp_6-31g(d).firefly.inp (generated)

052936600.b3lyp_6-31g(d).smash.inp (generated)

052936600.b3lyp_6-31g(d).nwchem.inp (generated) 052936600.b3lyp_6-31g(d).log.xz 052936600.td-b3lyp_6-31g+(d).inp 052936600.td-b3lyp_6-31g+(d).log.xz

052936600.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936600.td-b3lyp_6-31+g(d).gjf (generated)

052936600.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936600.mol 052936600.PUBCHEM 052936600.mol (via Jmol)
052936670.b3lyp_6-31g(d).inp

052936670.b3lyp_6-31g(d).qchem.inp (generated)

052936670.b3lyp_6-31g(d).gjf (generated)

052936670.b3lyp_6-31g(d).firefly.inp (generated)

052936670.b3lyp_6-31g(d).smash.inp (generated)

052936670.b3lyp_6-31g(d).nwchem.inp (generated) 052936670.b3lyp_6-31g(d).log.xz 052936670.td-b3lyp_6-31g+(d).inp 052936670.td-b3lyp_6-31g+(d).log.xz

052936670.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936670.td-b3lyp_6-31+g(d).gjf (generated)

052936670.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936670.mol 052936670.PUBCHEM 052936670.mol (via Jmol)
052936671.b3lyp_6-31g(d).inp

052936671.b3lyp_6-31g(d).qchem.inp (generated)

052936671.b3lyp_6-31g(d).gjf (generated)

052936671.b3lyp_6-31g(d).firefly.inp (generated)

052936671.b3lyp_6-31g(d).smash.inp (generated)

052936671.b3lyp_6-31g(d).nwchem.inp (generated) 052936671.b3lyp_6-31g(d).log.xz 052936671.td-b3lyp_6-31g+(d).inp 052936671.td-b3lyp_6-31g+(d).log.xz

052936671.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936671.td-b3lyp_6-31+g(d).gjf (generated)

052936671.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936671.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936671.mol 052936671.PUBCHEM 052936671.mol (via Jmol)
052936673.b3lyp_6-31g(d).inp

052936673.b3lyp_6-31g(d).qchem.inp (generated)

052936673.b3lyp_6-31g(d).gjf (generated)

052936673.b3lyp_6-31g(d).firefly.inp (generated)

052936673.b3lyp_6-31g(d).smash.inp (generated)

052936673.b3lyp_6-31g(d).nwchem.inp (generated) 052936673.b3lyp_6-31g(d).log.xz 052936673.td-b3lyp_6-31g+(d).inp 052936673.td-b3lyp_6-31g+(d).log.xz

052936673.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936673.td-b3lyp_6-31+g(d).gjf (generated)

052936673.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936673.mol 052936673.PUBCHEM 052936673.mol (via Jmol)
052936676.b3lyp_6-31g(d).inp

052936676.b3lyp_6-31g(d).qchem.inp (generated)

052936676.b3lyp_6-31g(d).gjf (generated)

052936676.b3lyp_6-31g(d).firefly.inp (generated)

052936676.b3lyp_6-31g(d).smash.inp (generated)

052936676.b3lyp_6-31g(d).nwchem.inp (generated) 052936676.b3lyp_6-31g(d).log.xz 052936676.td-b3lyp_6-31g+(d).inp 052936676.td-b3lyp_6-31g+(d).log.xz

052936676.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936676.td-b3lyp_6-31+g(d).gjf (generated)

052936676.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936676.mol 052936676.PUBCHEM 052936676.mol (via Jmol)
052936688.b3lyp_6-31g(d).inp

052936688.b3lyp_6-31g(d).qchem.inp (generated)

052936688.b3lyp_6-31g(d).gjf (generated)

052936688.b3lyp_6-31g(d).firefly.inp (generated)

052936688.b3lyp_6-31g(d).smash.inp (generated)

052936688.b3lyp_6-31g(d).nwchem.inp (generated) 052936688.b3lyp_6-31g(d).log.xz 052936688.td-b3lyp_6-31g+(d).inp 052936688.td-b3lyp_6-31g+(d).log.xz

052936688.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936688.td-b3lyp_6-31+g(d).gjf (generated)

052936688.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936688.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936688.mol 052936688.PUBCHEM 052936688.mol (via Jmol)
052936710.b3lyp_6-31g(d).inp

052936710.b3lyp_6-31g(d).qchem.inp (generated)

052936710.b3lyp_6-31g(d).gjf (generated)

052936710.b3lyp_6-31g(d).firefly.inp (generated)

052936710.b3lyp_6-31g(d).smash.inp (generated)

052936710.b3lyp_6-31g(d).nwchem.inp (generated) 052936710.b3lyp_6-31g(d).log.xz 052936710.td-b3lyp_6-31g+(d).inp 052936710.td-b3lyp_6-31g+(d).log.xz

052936710.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936710.td-b3lyp_6-31+g(d).gjf (generated)

052936710.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936710.mol 052936710.PUBCHEM 052936710.mol (via Jmol)
052936745.b3lyp_6-31g(d).inp

052936745.b3lyp_6-31g(d).qchem.inp (generated)

052936745.b3lyp_6-31g(d).gjf (generated)

052936745.b3lyp_6-31g(d).firefly.inp (generated)

052936745.b3lyp_6-31g(d).smash.inp (generated)

052936745.b3lyp_6-31g(d).nwchem.inp (generated) 052936745.b3lyp_6-31g(d).log.xz 052936745.td-b3lyp_6-31g+(d).inp 052936745.td-b3lyp_6-31g+(d).log.xz

052936745.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936745.td-b3lyp_6-31+g(d).gjf (generated)

052936745.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936745.mol 052936745.PUBCHEM 052936745.mol (via Jmol)
052936778.b3lyp_6-31g(d).inp

052936778.b3lyp_6-31g(d).qchem.inp (generated)

052936778.b3lyp_6-31g(d).gjf (generated)

052936778.b3lyp_6-31g(d).firefly.inp (generated)

052936778.b3lyp_6-31g(d).smash.inp (generated)

052936778.b3lyp_6-31g(d).nwchem.inp (generated) 052936778.b3lyp_6-31g(d).log.xz 052936778.mol 052936778.PUBCHEM 052936778.mol (via Jmol)
052936779.b3lyp_6-31g(d).inp

052936779.b3lyp_6-31g(d).qchem.inp (generated)

052936779.b3lyp_6-31g(d).gjf (generated)

052936779.b3lyp_6-31g(d).firefly.inp (generated)

052936779.b3lyp_6-31g(d).smash.inp (generated)

052936779.b3lyp_6-31g(d).nwchem.inp (generated) 052936779.b3lyp_6-31g(d).log.xz 052936779.mol 052936779.PUBCHEM 052936779.mol (via Jmol)
052936851.b3lyp_6-31g(d).inp

052936851.b3lyp_6-31g(d).qchem.inp (generated)

052936851.b3lyp_6-31g(d).gjf (generated)

052936851.b3lyp_6-31g(d).firefly.inp (generated)

052936851.b3lyp_6-31g(d).smash.inp (generated)

052936851.b3lyp_6-31g(d).nwchem.inp (generated) 052936851.b3lyp_6-31g(d).log.xz 052936851.td-b3lyp_6-31g+(d).inp 052936851.td-b3lyp_6-31g+(d).log.xz

052936851.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936851.td-b3lyp_6-31+g(d).gjf (generated)

052936851.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936851.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936851.mol 052936851.PUBCHEM 052936851.mol (via Jmol)
052936853.b3lyp_6-31g(d).inp

052936853.b3lyp_6-31g(d).qchem.inp (generated)

052936853.b3lyp_6-31g(d).gjf (generated)

052936853.b3lyp_6-31g(d).firefly.inp (generated)

052936853.b3lyp_6-31g(d).smash.inp (generated)

052936853.b3lyp_6-31g(d).nwchem.inp (generated) 052936853.b3lyp_6-31g(d).log.xz 052936853.td-b3lyp_6-31g+(d).inp 052936853.td-b3lyp_6-31g+(d).log.xz

052936853.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936853.td-b3lyp_6-31+g(d).gjf (generated)

052936853.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936853.mol 052936853.PUBCHEM 052936853.mol (via Jmol)
052936854.b3lyp_6-31g(d).inp

052936854.b3lyp_6-31g(d).qchem.inp (generated)

052936854.b3lyp_6-31g(d).gjf (generated)

052936854.b3lyp_6-31g(d).firefly.inp (generated)

052936854.b3lyp_6-31g(d).smash.inp (generated)

052936854.b3lyp_6-31g(d).nwchem.inp (generated) 052936854.b3lyp_6-31g(d).log.xz 052936854.td-b3lyp_6-31g+(d).inp 052936854.td-b3lyp_6-31g+(d).log.xz

052936854.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936854.td-b3lyp_6-31+g(d).gjf (generated)

052936854.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936854.mol 052936854.PUBCHEM 052936854.mol (via Jmol)
052936874.b3lyp_6-31g(d).inp

052936874.b3lyp_6-31g(d).qchem.inp (generated)

052936874.b3lyp_6-31g(d).gjf (generated)

052936874.b3lyp_6-31g(d).firefly.inp (generated)

052936874.b3lyp_6-31g(d).smash.inp (generated)

052936874.b3lyp_6-31g(d).nwchem.inp (generated) 052936874.b3lyp_6-31g(d).log.xz 052936874.td-b3lyp_6-31g+(d).inp 052936874.td-b3lyp_6-31g+(d).log.xz

052936874.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936874.td-b3lyp_6-31+g(d).gjf (generated)

052936874.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936874.mol 052936874.PUBCHEM 052936874.mol (via Jmol)
052936877.b3lyp_6-31g(d).inp

052936877.b3lyp_6-31g(d).qchem.inp (generated)

052936877.b3lyp_6-31g(d).gjf (generated)

052936877.b3lyp_6-31g(d).firefly.inp (generated)

052936877.b3lyp_6-31g(d).smash.inp (generated)

052936877.b3lyp_6-31g(d).nwchem.inp (generated) 052936877.b3lyp_6-31g(d).log.xz 052936877.td-b3lyp_6-31g+(d).inp 052936877.td-b3lyp_6-31g+(d).log.xz

052936877.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936877.td-b3lyp_6-31+g(d).gjf (generated)

052936877.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936877.mol 052936877.PUBCHEM 052936877.mol (via Jmol)
052936963.b3lyp_6-31g(d).inp

052936963.b3lyp_6-31g(d).qchem.inp (generated)

052936963.b3lyp_6-31g(d).gjf (generated)

052936963.b3lyp_6-31g(d).firefly.inp (generated)

052936963.b3lyp_6-31g(d).smash.inp (generated)

052936963.b3lyp_6-31g(d).nwchem.inp (generated) 052936963.b3lyp_6-31g(d).log.xz 052936963.td-b3lyp_6-31g+(d).inp 052936963.td-b3lyp_6-31g+(d).log.xz

052936963.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936963.td-b3lyp_6-31+g(d).gjf (generated)

052936963.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936963.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936963.mol 052936963.PUBCHEM 052936963.mol (via Jmol)
052936964.b3lyp_6-31g(d).inp

052936964.b3lyp_6-31g(d).qchem.inp (generated)

052936964.b3lyp_6-31g(d).gjf (generated)

052936964.b3lyp_6-31g(d).firefly.inp (generated)

052936964.b3lyp_6-31g(d).smash.inp (generated)

052936964.b3lyp_6-31g(d).nwchem.inp (generated) 052936964.b3lyp_6-31g(d).log.xz 052936964.td-b3lyp_6-31g+(d).inp 052936964.td-b3lyp_6-31g+(d).log.xz

052936964.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936964.td-b3lyp_6-31+g(d).gjf (generated)

052936964.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936964.mol 052936964.PUBCHEM 052936964.mol (via Jmol)
052936992.b3lyp_6-31g(d).inp

052936992.b3lyp_6-31g(d).qchem.inp (generated)

052936992.b3lyp_6-31g(d).gjf (generated)

052936992.b3lyp_6-31g(d).firefly.inp (generated)

052936992.b3lyp_6-31g(d).smash.inp (generated)

052936992.b3lyp_6-31g(d).nwchem.inp (generated) 052936992.b3lyp_6-31g(d).log.xz 052936992.td-b3lyp_6-31g+(d).inp 052936992.td-b3lyp_6-31g+(d).log.xz

052936992.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936992.td-b3lyp_6-31+g(d).gjf (generated)

052936992.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936992.mol 052936992.PUBCHEM 052936992.mol (via Jmol)
052936995.b3lyp_6-31g(d).inp

052936995.b3lyp_6-31g(d).qchem.inp (generated)

052936995.b3lyp_6-31g(d).gjf (generated)

052936995.b3lyp_6-31g(d).firefly.inp (generated)

052936995.b3lyp_6-31g(d).smash.inp (generated)

052936995.b3lyp_6-31g(d).nwchem.inp (generated) 052936995.b3lyp_6-31g(d).log.xz 052936995.td-b3lyp_6-31g+(d).inp 052936995.td-b3lyp_6-31g+(d).log.xz

052936995.td-b3lyp_6-31+g(d).qchem.inp (generated)

052936995.td-b3lyp_6-31+g(d).gjf (generated)

052936995.td-b3lyp_6-31+g(d).firefly.inp (generated)

052936995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052936995.mol 052936995.PUBCHEM 052936995.mol (via Jmol)
052937073.b3lyp_6-31g(d).inp

052937073.b3lyp_6-31g(d).qchem.inp (generated)

052937073.b3lyp_6-31g(d).gjf (generated)

052937073.b3lyp_6-31g(d).firefly.inp (generated)

052937073.b3lyp_6-31g(d).smash.inp (generated)

052937073.b3lyp_6-31g(d).nwchem.inp (generated) 052937073.b3lyp_6-31g(d).log.xz 052937073.td-b3lyp_6-31g+(d).inp 052937073.td-b3lyp_6-31g+(d).log.xz

052937073.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937073.td-b3lyp_6-31+g(d).gjf (generated)

052937073.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937073.mol 052937073.PUBCHEM 052937073.mol (via Jmol)
052937090.b3lyp_6-31g(d).inp

052937090.b3lyp_6-31g(d).qchem.inp (generated)

052937090.b3lyp_6-31g(d).gjf (generated)

052937090.b3lyp_6-31g(d).firefly.inp (generated)

052937090.b3lyp_6-31g(d).smash.inp (generated)

052937090.b3lyp_6-31g(d).nwchem.inp (generated) 052937090.b3lyp_6-31g(d).log.xz 052937090.td-b3lyp_6-31g+(d).inp 052937090.td-b3lyp_6-31g+(d).log.xz

052937090.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937090.td-b3lyp_6-31+g(d).gjf (generated)

052937090.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937090.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937090.mol 052937090.PUBCHEM 052937090.mol (via Jmol)
052937159.b3lyp_6-31g(d).inp

052937159.b3lyp_6-31g(d).qchem.inp (generated)

052937159.b3lyp_6-31g(d).gjf (generated)

052937159.b3lyp_6-31g(d).firefly.inp (generated)

052937159.b3lyp_6-31g(d).smash.inp (generated)

052937159.b3lyp_6-31g(d).nwchem.inp (generated) 052937159.b3lyp_6-31g(d).log.xz 052937159.td-b3lyp_6-31g+(d).inp 052937159.td-b3lyp_6-31g+(d).log.xz

052937159.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937159.td-b3lyp_6-31+g(d).gjf (generated)

052937159.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937159.mol 052937159.PUBCHEM 052937159.mol (via Jmol)
052937160.b3lyp_6-31g(d).inp

052937160.b3lyp_6-31g(d).qchem.inp (generated)

052937160.b3lyp_6-31g(d).gjf (generated)

052937160.b3lyp_6-31g(d).firefly.inp (generated)

052937160.b3lyp_6-31g(d).smash.inp (generated)

052937160.b3lyp_6-31g(d).nwchem.inp (generated) 052937160.b3lyp_6-31g(d).log.xz 052937160.td-b3lyp_6-31g+(d).inp 052937160.td-b3lyp_6-31g+(d).log.xz

052937160.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937160.td-b3lyp_6-31+g(d).gjf (generated)

052937160.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937160.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937160.mol 052937160.PUBCHEM 052937160.mol (via Jmol)
052937161.b3lyp_6-31g(d).inp

052937161.b3lyp_6-31g(d).qchem.inp (generated)

052937161.b3lyp_6-31g(d).gjf (generated)

052937161.b3lyp_6-31g(d).firefly.inp (generated)

052937161.b3lyp_6-31g(d).smash.inp (generated)

052937161.b3lyp_6-31g(d).nwchem.inp (generated) 052937161.b3lyp_6-31g(d).log.xz 052937161.td-b3lyp_6-31g+(d).inp 052937161.td-b3lyp_6-31g+(d).log.xz

052937161.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937161.td-b3lyp_6-31+g(d).gjf (generated)

052937161.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937161.mol 052937161.PUBCHEM 052937161.mol (via Jmol)
052937162.b3lyp_6-31g(d).inp

052937162.b3lyp_6-31g(d).qchem.inp (generated)

052937162.b3lyp_6-31g(d).gjf (generated)

052937162.b3lyp_6-31g(d).firefly.inp (generated)

052937162.b3lyp_6-31g(d).smash.inp (generated)

052937162.b3lyp_6-31g(d).nwchem.inp (generated) 052937162.b3lyp_6-31g(d).log.xz 052937162.td-b3lyp_6-31g+(d).inp 052937162.td-b3lyp_6-31g+(d).log.xz

052937162.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937162.td-b3lyp_6-31+g(d).gjf (generated)

052937162.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937162.mol 052937162.PUBCHEM 052937162.mol (via Jmol)
052937163.b3lyp_6-31g(d).inp

052937163.b3lyp_6-31g(d).qchem.inp (generated)

052937163.b3lyp_6-31g(d).gjf (generated)

052937163.b3lyp_6-31g(d).firefly.inp (generated)

052937163.b3lyp_6-31g(d).smash.inp (generated)

052937163.b3lyp_6-31g(d).nwchem.inp (generated) 052937163.b3lyp_6-31g(d).log.xz 052937163.td-b3lyp_6-31g+(d).inp 052937163.td-b3lyp_6-31g+(d).log.xz

052937163.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937163.td-b3lyp_6-31+g(d).gjf (generated)

052937163.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937163.mol 052937163.PUBCHEM 052937163.mol (via Jmol)
052937164.b3lyp_6-31g(d).inp

052937164.b3lyp_6-31g(d).qchem.inp (generated)

052937164.b3lyp_6-31g(d).gjf (generated)

052937164.b3lyp_6-31g(d).firefly.inp (generated)

052937164.b3lyp_6-31g(d).smash.inp (generated)

052937164.b3lyp_6-31g(d).nwchem.inp (generated) 052937164.b3lyp_6-31g(d).log.xz 052937164.td-b3lyp_6-31g+(d).inp 052937164.td-b3lyp_6-31g+(d).log.xz

052937164.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937164.td-b3lyp_6-31+g(d).gjf (generated)

052937164.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937164.mol 052937164.PUBCHEM 052937164.mol (via Jmol)
052937165.b3lyp_6-31g(d).inp

052937165.b3lyp_6-31g(d).qchem.inp (generated)

052937165.b3lyp_6-31g(d).gjf (generated)

052937165.b3lyp_6-31g(d).firefly.inp (generated)

052937165.b3lyp_6-31g(d).smash.inp (generated)

052937165.b3lyp_6-31g(d).nwchem.inp (generated) 052937165.b3lyp_6-31g(d).log.xz 052937165.td-b3lyp_6-31g+(d).inp 052937165.td-b3lyp_6-31g+(d).log.xz

052937165.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937165.td-b3lyp_6-31+g(d).gjf (generated)

052937165.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937165.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937165.mol 052937165.PUBCHEM 052937165.mol (via Jmol)
052937224.b3lyp_6-31g(d).inp

052937224.b3lyp_6-31g(d).qchem.inp (generated)

052937224.b3lyp_6-31g(d).gjf (generated)

052937224.b3lyp_6-31g(d).firefly.inp (generated)

052937224.b3lyp_6-31g(d).smash.inp (generated)

052937224.b3lyp_6-31g(d).nwchem.inp (generated) 052937224.b3lyp_6-31g(d).log.xz 052937224.td-b3lyp_6-31g+(d).inp 052937224.td-b3lyp_6-31g+(d).log.xz

052937224.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937224.td-b3lyp_6-31+g(d).gjf (generated)

052937224.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937224.mol 052937224.PUBCHEM 052937224.mol (via Jmol)
052937226.b3lyp_6-31g(d).inp

052937226.b3lyp_6-31g(d).qchem.inp (generated)

052937226.b3lyp_6-31g(d).gjf (generated)

052937226.b3lyp_6-31g(d).firefly.inp (generated)

052937226.b3lyp_6-31g(d).smash.inp (generated)

052937226.b3lyp_6-31g(d).nwchem.inp (generated) 052937226.b3lyp_6-31g(d).log.xz 052937226.td-b3lyp_6-31g+(d).inp 052937226.td-b3lyp_6-31g+(d).log.xz

052937226.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937226.td-b3lyp_6-31+g(d).gjf (generated)

052937226.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937226.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937226.mol 052937226.PUBCHEM 052937226.mol (via Jmol)
052937262.b3lyp_6-31g(d).inp

052937262.b3lyp_6-31g(d).qchem.inp (generated)

052937262.b3lyp_6-31g(d).gjf (generated)

052937262.b3lyp_6-31g(d).firefly.inp (generated)

052937262.b3lyp_6-31g(d).smash.inp (generated)

052937262.b3lyp_6-31g(d).nwchem.inp (generated) 052937262.b3lyp_6-31g(d).log.xz 052937262.td-b3lyp_6-31g+(d).inp 052937262.td-b3lyp_6-31g+(d).log.xz

052937262.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937262.td-b3lyp_6-31+g(d).gjf (generated)

052937262.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937262.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937262.mol 052937262.PUBCHEM 052937262.mol (via Jmol)
052937263.b3lyp_6-31g(d).inp

052937263.b3lyp_6-31g(d).qchem.inp (generated)

052937263.b3lyp_6-31g(d).gjf (generated)

052937263.b3lyp_6-31g(d).firefly.inp (generated)

052937263.b3lyp_6-31g(d).smash.inp (generated)

052937263.b3lyp_6-31g(d).nwchem.inp (generated) 052937263.b3lyp_6-31g(d).log.xz 052937263.mol 052937263.PUBCHEM 052937263.mol (via Jmol)
052937264.b3lyp_6-31g(d).inp

052937264.b3lyp_6-31g(d).qchem.inp (generated)

052937264.b3lyp_6-31g(d).gjf (generated)

052937264.b3lyp_6-31g(d).firefly.inp (generated)

052937264.b3lyp_6-31g(d).smash.inp (generated)

052937264.b3lyp_6-31g(d).nwchem.inp (generated) 052937264.b3lyp_6-31g(d).log.xz 052937264.td-b3lyp_6-31g+(d).inp 052937264.td-b3lyp_6-31g+(d).log.xz

052937264.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937264.td-b3lyp_6-31+g(d).gjf (generated)

052937264.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937264.mol 052937264.PUBCHEM 052937264.mol (via Jmol)
052937396.b3lyp_6-31g(d).inp

052937396.b3lyp_6-31g(d).qchem.inp (generated)

052937396.b3lyp_6-31g(d).gjf (generated)

052937396.b3lyp_6-31g(d).firefly.inp (generated)

052937396.b3lyp_6-31g(d).smash.inp (generated)

052937396.b3lyp_6-31g(d).nwchem.inp (generated) 052937396.b3lyp_6-31g(d).log.xz 052937396.td-b3lyp_6-31g+(d).inp 052937396.td-b3lyp_6-31g+(d).log.xz

052937396.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937396.td-b3lyp_6-31+g(d).gjf (generated)

052937396.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937396.mol 052937396.PUBCHEM 052937396.mol (via Jmol)
052937448.b3lyp_6-31g(d).inp

052937448.b3lyp_6-31g(d).qchem.inp (generated)

052937448.b3lyp_6-31g(d).gjf (generated)

052937448.b3lyp_6-31g(d).firefly.inp (generated)

052937448.b3lyp_6-31g(d).smash.inp (generated)

052937448.b3lyp_6-31g(d).nwchem.inp (generated) 052937448.b3lyp_6-31g(d).log.xz 052937448.mol 052937448.PUBCHEM 052937448.mol (via Jmol)
052937479.b3lyp_6-31g(d).inp

052937479.b3lyp_6-31g(d).qchem.inp (generated)

052937479.b3lyp_6-31g(d).gjf (generated)

052937479.b3lyp_6-31g(d).firefly.inp (generated)

052937479.b3lyp_6-31g(d).smash.inp (generated)

052937479.b3lyp_6-31g(d).nwchem.inp (generated) 052937479.b3lyp_6-31g(d).log.xz 052937479.td-b3lyp_6-31g+(d).inp 052937479.td-b3lyp_6-31g+(d).log.xz

052937479.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937479.td-b3lyp_6-31+g(d).gjf (generated)

052937479.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937479.mol 052937479.PUBCHEM 052937479.mol (via Jmol)
052937488.b3lyp_6-31g(d).inp

052937488.b3lyp_6-31g(d).qchem.inp (generated)

052937488.b3lyp_6-31g(d).gjf (generated)

052937488.b3lyp_6-31g(d).firefly.inp (generated)

052937488.b3lyp_6-31g(d).smash.inp (generated)

052937488.b3lyp_6-31g(d).nwchem.inp (generated) 052937488.b3lyp_6-31g(d).log.xz 052937488.td-b3lyp_6-31g+(d).inp 052937488.td-b3lyp_6-31g+(d).log.xz

052937488.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937488.td-b3lyp_6-31+g(d).gjf (generated)

052937488.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937488.mol 052937488.PUBCHEM 052937488.mol (via Jmol)
052937494.b3lyp_6-31g(d).inp

052937494.b3lyp_6-31g(d).qchem.inp (generated)

052937494.b3lyp_6-31g(d).gjf (generated)

052937494.b3lyp_6-31g(d).firefly.inp (generated)

052937494.b3lyp_6-31g(d).smash.inp (generated)

052937494.b3lyp_6-31g(d).nwchem.inp (generated) 052937494.b3lyp_6-31g(d).log.xz 052937494.td-b3lyp_6-31g+(d).inp 052937494.td-b3lyp_6-31g+(d).log.xz

052937494.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937494.td-b3lyp_6-31+g(d).gjf (generated)

052937494.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937494.mol 052937494.PUBCHEM 052937494.mol (via Jmol)
052937538.b3lyp_6-31g(d).inp

052937538.b3lyp_6-31g(d).qchem.inp (generated)

052937538.b3lyp_6-31g(d).gjf (generated)

052937538.b3lyp_6-31g(d).firefly.inp (generated)

052937538.b3lyp_6-31g(d).smash.inp (generated)

052937538.b3lyp_6-31g(d).nwchem.inp (generated) 052937538.b3lyp_6-31g(d).log.xz 052937538.td-b3lyp_6-31g+(d).inp 052937538.td-b3lyp_6-31g+(d).log.xz

052937538.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937538.td-b3lyp_6-31+g(d).gjf (generated)

052937538.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937538.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937538.mol 052937538.PUBCHEM 052937538.mol (via Jmol)
052937546.b3lyp_6-31g(d).inp

052937546.b3lyp_6-31g(d).qchem.inp (generated)

052937546.b3lyp_6-31g(d).gjf (generated)

052937546.b3lyp_6-31g(d).firefly.inp (generated)

052937546.b3lyp_6-31g(d).smash.inp (generated)

052937546.b3lyp_6-31g(d).nwchem.inp (generated) 052937546.b3lyp_6-31g(d).log.xz 052937546.td-b3lyp_6-31g+(d).inp 052937546.td-b3lyp_6-31g+(d).log.xz

052937546.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937546.td-b3lyp_6-31+g(d).gjf (generated)

052937546.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937546.mol 052937546.PUBCHEM 052937546.mol (via Jmol)
052937563.b3lyp_6-31g(d).inp

052937563.b3lyp_6-31g(d).qchem.inp (generated)

052937563.b3lyp_6-31g(d).gjf (generated)

052937563.b3lyp_6-31g(d).firefly.inp (generated)

052937563.b3lyp_6-31g(d).smash.inp (generated)

052937563.b3lyp_6-31g(d).nwchem.inp (generated) 052937563.b3lyp_6-31g(d).log.xz 052937563.td-b3lyp_6-31g+(d).inp 052937563.td-b3lyp_6-31g+(d).log.xz

052937563.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937563.td-b3lyp_6-31+g(d).gjf (generated)

052937563.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937563.mol 052937563.PUBCHEM 052937563.mol (via Jmol)
052937581.b3lyp_6-31g(d).inp

052937581.b3lyp_6-31g(d).qchem.inp (generated)

052937581.b3lyp_6-31g(d).gjf (generated)

052937581.b3lyp_6-31g(d).firefly.inp (generated)

052937581.b3lyp_6-31g(d).smash.inp (generated)

052937581.b3lyp_6-31g(d).nwchem.inp (generated) 052937581.b3lyp_6-31g(d).log.xz 052937581.td-b3lyp_6-31g+(d).inp 052937581.td-b3lyp_6-31g+(d).log.xz

052937581.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937581.td-b3lyp_6-31+g(d).gjf (generated)

052937581.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937581.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937581.mol 052937581.PUBCHEM 052937581.mol (via Jmol)
052937593.b3lyp_6-31g(d).inp

052937593.b3lyp_6-31g(d).qchem.inp (generated)

052937593.b3lyp_6-31g(d).gjf (generated)

052937593.b3lyp_6-31g(d).firefly.inp (generated)

052937593.b3lyp_6-31g(d).smash.inp (generated)

052937593.b3lyp_6-31g(d).nwchem.inp (generated) 052937593.b3lyp_6-31g(d).log.xz 052937593.mol 052937593.PUBCHEM 052937593.mol (via Jmol)
052937599.b3lyp_6-31g(d).inp

052937599.b3lyp_6-31g(d).qchem.inp (generated)

052937599.b3lyp_6-31g(d).gjf (generated)

052937599.b3lyp_6-31g(d).firefly.inp (generated)

052937599.b3lyp_6-31g(d).smash.inp (generated)

052937599.b3lyp_6-31g(d).nwchem.inp (generated) 052937599.b3lyp_6-31g(d).log.xz 052937599.td-b3lyp_6-31g+(d).inp 052937599.td-b3lyp_6-31g+(d).log.xz

052937599.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937599.td-b3lyp_6-31+g(d).gjf (generated)

052937599.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937599.mol 052937599.PUBCHEM 052937599.mol (via Jmol)
052937600.b3lyp_6-31g(d).inp

052937600.b3lyp_6-31g(d).qchem.inp (generated)

052937600.b3lyp_6-31g(d).gjf (generated)

052937600.b3lyp_6-31g(d).firefly.inp (generated)

052937600.b3lyp_6-31g(d).smash.inp (generated)

052937600.b3lyp_6-31g(d).nwchem.inp (generated) 052937600.b3lyp_6-31g(d).log.xz 052937600.td-b3lyp_6-31g+(d).inp 052937600.td-b3lyp_6-31g+(d).log.xz

052937600.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937600.td-b3lyp_6-31+g(d).gjf (generated)

052937600.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937600.mol 052937600.PUBCHEM 052937600.mol (via Jmol)
052937639.b3lyp_6-31g(d).inp

052937639.b3lyp_6-31g(d).qchem.inp (generated)

052937639.b3lyp_6-31g(d).gjf (generated)

052937639.b3lyp_6-31g(d).firefly.inp (generated)

052937639.b3lyp_6-31g(d).smash.inp (generated)

052937639.b3lyp_6-31g(d).nwchem.inp (generated) 052937639.b3lyp_6-31g(d).log.xz 052937639.td-b3lyp_6-31g+(d).inp 052937639.td-b3lyp_6-31g+(d).log.xz

052937639.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937639.td-b3lyp_6-31+g(d).gjf (generated)

052937639.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937639.mol 052937639.PUBCHEM 052937639.mol (via Jmol)
052937681.b3lyp_6-31g(d).inp

052937681.b3lyp_6-31g(d).qchem.inp (generated)

052937681.b3lyp_6-31g(d).gjf (generated)

052937681.b3lyp_6-31g(d).firefly.inp (generated)

052937681.b3lyp_6-31g(d).smash.inp (generated)

052937681.b3lyp_6-31g(d).nwchem.inp (generated) 052937681.b3lyp_6-31g(d).log.xz 052937681.td-b3lyp_6-31g+(d).inp 052937681.td-b3lyp_6-31g+(d).log.xz

052937681.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937681.td-b3lyp_6-31+g(d).gjf (generated)

052937681.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937681.mol 052937681.PUBCHEM 052937681.mol (via Jmol)
052937720.b3lyp_6-31g(d).inp

052937720.b3lyp_6-31g(d).qchem.inp (generated)

052937720.b3lyp_6-31g(d).gjf (generated)

052937720.b3lyp_6-31g(d).firefly.inp (generated)

052937720.b3lyp_6-31g(d).smash.inp (generated)

052937720.b3lyp_6-31g(d).nwchem.inp (generated) 052937720.b3lyp_6-31g(d).log.xz 052937720.td-b3lyp_6-31g+(d).inp 052937720.td-b3lyp_6-31g+(d).log.xz

052937720.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937720.td-b3lyp_6-31+g(d).gjf (generated)

052937720.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937720.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937720.mol 052937720.PUBCHEM 052937720.mol (via Jmol)
052937721.b3lyp_6-31g(d).inp

052937721.b3lyp_6-31g(d).qchem.inp (generated)

052937721.b3lyp_6-31g(d).gjf (generated)

052937721.b3lyp_6-31g(d).firefly.inp (generated)

052937721.b3lyp_6-31g(d).smash.inp (generated)

052937721.b3lyp_6-31g(d).nwchem.inp (generated) 052937721.b3lyp_6-31g(d).log.xz 052937721.mol 052937721.PUBCHEM 052937721.mol (via Jmol)
052937722.b3lyp_6-31g(d).inp

052937722.b3lyp_6-31g(d).qchem.inp (generated)

052937722.b3lyp_6-31g(d).gjf (generated)

052937722.b3lyp_6-31g(d).firefly.inp (generated)

052937722.b3lyp_6-31g(d).smash.inp (generated)

052937722.b3lyp_6-31g(d).nwchem.inp (generated) 052937722.b3lyp_6-31g(d).log.xz 052937722.td-b3lyp_6-31g+(d).inp 052937722.td-b3lyp_6-31g+(d).log.xz

052937722.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937722.td-b3lyp_6-31+g(d).gjf (generated)

052937722.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937722.mol 052937722.PUBCHEM 052937722.mol (via Jmol)
052937724.b3lyp_6-31g(d).inp

052937724.b3lyp_6-31g(d).qchem.inp (generated)

052937724.b3lyp_6-31g(d).gjf (generated)

052937724.b3lyp_6-31g(d).firefly.inp (generated)

052937724.b3lyp_6-31g(d).smash.inp (generated)

052937724.b3lyp_6-31g(d).nwchem.inp (generated) 052937724.b3lyp_6-31g(d).log.xz 052937724.td-b3lyp_6-31g+(d).inp 052937724.td-b3lyp_6-31g+(d).log.xz

052937724.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937724.td-b3lyp_6-31+g(d).gjf (generated)

052937724.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937724.mol 052937724.PUBCHEM 052937724.mol (via Jmol)
052937772.b3lyp_6-31g(d).inp

052937772.b3lyp_6-31g(d).qchem.inp (generated)

052937772.b3lyp_6-31g(d).gjf (generated)

052937772.b3lyp_6-31g(d).firefly.inp (generated)

052937772.b3lyp_6-31g(d).smash.inp (generated)

052937772.b3lyp_6-31g(d).nwchem.inp (generated) 052937772.b3lyp_6-31g(d).log.xz 052937772.td-b3lyp_6-31g+(d).inp 052937772.td-b3lyp_6-31g+(d).log.xz

052937772.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937772.td-b3lyp_6-31+g(d).gjf (generated)

052937772.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937772.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937772.mol 052937772.PUBCHEM 052937772.mol (via Jmol)
052937872.b3lyp_6-31g(d).inp

052937872.b3lyp_6-31g(d).qchem.inp (generated)

052937872.b3lyp_6-31g(d).gjf (generated)

052937872.b3lyp_6-31g(d).firefly.inp (generated)

052937872.b3lyp_6-31g(d).smash.inp (generated)

052937872.b3lyp_6-31g(d).nwchem.inp (generated) 052937872.b3lyp_6-31g(d).log.xz 052937872.td-b3lyp_6-31g+(d).inp 052937872.td-b3lyp_6-31g+(d).log.xz

052937872.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937872.td-b3lyp_6-31+g(d).gjf (generated)

052937872.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937872.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937872.mol 052937872.PUBCHEM 052937872.mol (via Jmol)
052937873.b3lyp_6-31g(d).inp

052937873.b3lyp_6-31g(d).qchem.inp (generated)

052937873.b3lyp_6-31g(d).gjf (generated)

052937873.b3lyp_6-31g(d).firefly.inp (generated)

052937873.b3lyp_6-31g(d).smash.inp (generated)

052937873.b3lyp_6-31g(d).nwchem.inp (generated) 052937873.b3lyp_6-31g(d).log.xz 052937873.td-b3lyp_6-31g+(d).inp 052937873.td-b3lyp_6-31g+(d).log.xz

052937873.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937873.td-b3lyp_6-31+g(d).gjf (generated)

052937873.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937873.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937873.mol 052937873.PUBCHEM 052937873.mol (via Jmol)
052937874.b3lyp_6-31g(d).inp

052937874.b3lyp_6-31g(d).qchem.inp (generated)

052937874.b3lyp_6-31g(d).gjf (generated)

052937874.b3lyp_6-31g(d).firefly.inp (generated)

052937874.b3lyp_6-31g(d).smash.inp (generated)

052937874.b3lyp_6-31g(d).nwchem.inp (generated) 052937874.b3lyp_6-31g(d).log.xz 052937874.td-b3lyp_6-31g+(d).inp 052937874.td-b3lyp_6-31g+(d).log.xz

052937874.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937874.td-b3lyp_6-31+g(d).gjf (generated)

052937874.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937874.mol 052937874.PUBCHEM 052937874.mol (via Jmol)
052937877.b3lyp_6-31g(d).inp

052937877.b3lyp_6-31g(d).qchem.inp (generated)

052937877.b3lyp_6-31g(d).gjf (generated)

052937877.b3lyp_6-31g(d).firefly.inp (generated)

052937877.b3lyp_6-31g(d).smash.inp (generated)

052937877.b3lyp_6-31g(d).nwchem.inp (generated) 052937877.b3lyp_6-31g(d).log.xz 052937877.td-b3lyp_6-31g+(d).inp 052937877.td-b3lyp_6-31g+(d).log.xz

052937877.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937877.td-b3lyp_6-31+g(d).gjf (generated)

052937877.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937877.mol 052937877.PUBCHEM 052937877.mol (via Jmol)
052937897.b3lyp_6-31g(d).inp

052937897.b3lyp_6-31g(d).qchem.inp (generated)

052937897.b3lyp_6-31g(d).gjf (generated)

052937897.b3lyp_6-31g(d).firefly.inp (generated)

052937897.b3lyp_6-31g(d).smash.inp (generated)

052937897.b3lyp_6-31g(d).nwchem.inp (generated) 052937897.b3lyp_6-31g(d).log.xz 052937897.td-b3lyp_6-31g+(d).inp 052937897.td-b3lyp_6-31g+(d).log.xz

052937897.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937897.td-b3lyp_6-31+g(d).gjf (generated)

052937897.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937897.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937897.mol 052937897.PUBCHEM 052937897.mol (via Jmol)
052937909.b3lyp_6-31g(d).inp

052937909.b3lyp_6-31g(d).qchem.inp (generated)

052937909.b3lyp_6-31g(d).gjf (generated)

052937909.b3lyp_6-31g(d).firefly.inp (generated)

052937909.b3lyp_6-31g(d).smash.inp (generated)

052937909.b3lyp_6-31g(d).nwchem.inp (generated) 052937909.b3lyp_6-31g(d).log.xz 052937909.mol 052937909.PUBCHEM 052937909.mol (via Jmol)
052937933.b3lyp_6-31g(d).inp

052937933.b3lyp_6-31g(d).qchem.inp (generated)

052937933.b3lyp_6-31g(d).gjf (generated)

052937933.b3lyp_6-31g(d).firefly.inp (generated)

052937933.b3lyp_6-31g(d).smash.inp (generated)

052937933.b3lyp_6-31g(d).nwchem.inp (generated) 052937933.b3lyp_6-31g(d).log.xz 052937933.td-b3lyp_6-31g+(d).inp 052937933.td-b3lyp_6-31g+(d).log.xz

052937933.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937933.td-b3lyp_6-31+g(d).gjf (generated)

052937933.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937933.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937933.mol 052937933.PUBCHEM 052937933.mol (via Jmol)
052937935.b3lyp_6-31g(d).inp

052937935.b3lyp_6-31g(d).qchem.inp (generated)

052937935.b3lyp_6-31g(d).gjf (generated)

052937935.b3lyp_6-31g(d).firefly.inp (generated)

052937935.b3lyp_6-31g(d).smash.inp (generated)

052937935.b3lyp_6-31g(d).nwchem.inp (generated) 052937935.b3lyp_6-31g(d).log.xz 052937935.td-b3lyp_6-31g+(d).inp 052937935.td-b3lyp_6-31g+(d).log.xz

052937935.td-b3lyp_6-31+g(d).qchem.inp (generated)

052937935.td-b3lyp_6-31+g(d).gjf (generated)

052937935.td-b3lyp_6-31+g(d).firefly.inp (generated)

052937935.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052937935.mol 052937935.PUBCHEM 052937935.mol (via Jmol)
052938020.b3lyp_6-31g(d).inp

052938020.b3lyp_6-31g(d).qchem.inp (generated)

052938020.b3lyp_6-31g(d).gjf (generated)

052938020.b3lyp_6-31g(d).firefly.inp (generated)

052938020.b3lyp_6-31g(d).smash.inp (generated)

052938020.b3lyp_6-31g(d).nwchem.inp (generated) 052938020.b3lyp_6-31g(d).log.xz 052938020.td-b3lyp_6-31g+(d).inp 052938020.td-b3lyp_6-31g+(d).log.xz

052938020.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938020.td-b3lyp_6-31+g(d).gjf (generated)

052938020.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938020.mol 052938020.PUBCHEM 052938020.mol (via Jmol)
052938022.b3lyp_6-31g(d).inp

052938022.b3lyp_6-31g(d).qchem.inp (generated)

052938022.b3lyp_6-31g(d).gjf (generated)

052938022.b3lyp_6-31g(d).firefly.inp (generated)

052938022.b3lyp_6-31g(d).smash.inp (generated)

052938022.b3lyp_6-31g(d).nwchem.inp (generated) 052938022.b3lyp_6-31g(d).log.xz 052938022.td-b3lyp_6-31g+(d).inp 052938022.td-b3lyp_6-31g+(d).log.xz

052938022.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938022.td-b3lyp_6-31+g(d).gjf (generated)

052938022.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938022.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938022.mol 052938022.PUBCHEM 052938022.mol (via Jmol)
052938119.b3lyp_6-31g(d).inp

052938119.b3lyp_6-31g(d).qchem.inp (generated)

052938119.b3lyp_6-31g(d).gjf (generated)

052938119.b3lyp_6-31g(d).firefly.inp (generated)

052938119.b3lyp_6-31g(d).smash.inp (generated)

052938119.b3lyp_6-31g(d).nwchem.inp (generated) 052938119.b3lyp_6-31g(d).log.xz 052938119.td-b3lyp_6-31g+(d).inp 052938119.td-b3lyp_6-31g+(d).log.xz

052938119.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938119.td-b3lyp_6-31+g(d).gjf (generated)

052938119.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938119.mol 052938119.PUBCHEM 052938119.mol (via Jmol)
052938121.b3lyp_6-31g(d).inp

052938121.b3lyp_6-31g(d).qchem.inp (generated)

052938121.b3lyp_6-31g(d).gjf (generated)

052938121.b3lyp_6-31g(d).firefly.inp (generated)

052938121.b3lyp_6-31g(d).smash.inp (generated)

052938121.b3lyp_6-31g(d).nwchem.inp (generated) 052938121.b3lyp_6-31g(d).log.xz 052938121.td-b3lyp_6-31g+(d).inp 052938121.td-b3lyp_6-31g+(d).log.xz

052938121.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938121.td-b3lyp_6-31+g(d).gjf (generated)

052938121.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938121.mol 052938121.PUBCHEM 052938121.mol (via Jmol)
052938211.b3lyp_6-31g(d).inp

052938211.b3lyp_6-31g(d).qchem.inp (generated)

052938211.b3lyp_6-31g(d).gjf (generated)

052938211.b3lyp_6-31g(d).firefly.inp (generated)

052938211.b3lyp_6-31g(d).smash.inp (generated)

052938211.b3lyp_6-31g(d).nwchem.inp (generated) 052938211.b3lyp_6-31g(d).log.xz 052938211.td-b3lyp_6-31g+(d).inp 052938211.td-b3lyp_6-31g+(d).log.xz

052938211.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938211.td-b3lyp_6-31+g(d).gjf (generated)

052938211.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938211.mol 052938211.PUBCHEM 052938211.mol (via Jmol)
052938251.b3lyp_6-31g(d).inp

052938251.b3lyp_6-31g(d).qchem.inp (generated)

052938251.b3lyp_6-31g(d).gjf (generated)

052938251.b3lyp_6-31g(d).firefly.inp (generated)

052938251.b3lyp_6-31g(d).smash.inp (generated)

052938251.b3lyp_6-31g(d).nwchem.inp (generated) 052938251.b3lyp_6-31g(d).log.xz 052938251.td-b3lyp_6-31g+(d).inp 052938251.td-b3lyp_6-31g+(d).log.xz

052938251.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938251.td-b3lyp_6-31+g(d).gjf (generated)

052938251.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938251.mol 052938251.PUBCHEM 052938251.mol (via Jmol)
052938356.b3lyp_6-31g(d).inp

052938356.b3lyp_6-31g(d).qchem.inp (generated)

052938356.b3lyp_6-31g(d).gjf (generated)

052938356.b3lyp_6-31g(d).firefly.inp (generated)

052938356.b3lyp_6-31g(d).smash.inp (generated)

052938356.b3lyp_6-31g(d).nwchem.inp (generated) 052938356.b3lyp_6-31g(d).log.xz 052938356.td-b3lyp_6-31g+(d).inp 052938356.td-b3lyp_6-31g+(d).log.xz

052938356.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938356.td-b3lyp_6-31+g(d).gjf (generated)

052938356.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938356.mol 052938356.PUBCHEM 052938356.mol (via Jmol)
052938388.b3lyp_6-31g(d).inp

052938388.b3lyp_6-31g(d).qchem.inp (generated)

052938388.b3lyp_6-31g(d).gjf (generated)

052938388.b3lyp_6-31g(d).firefly.inp (generated)

052938388.b3lyp_6-31g(d).smash.inp (generated)

052938388.b3lyp_6-31g(d).nwchem.inp (generated) 052938388.b3lyp_6-31g(d).log.xz 052938388.td-b3lyp_6-31g+(d).inp 052938388.td-b3lyp_6-31g+(d).log.xz

052938388.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938388.td-b3lyp_6-31+g(d).gjf (generated)

052938388.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938388.mol 052938388.PUBCHEM 052938388.mol (via Jmol)
052938484.b3lyp_6-31g(d).inp

052938484.b3lyp_6-31g(d).qchem.inp (generated)

052938484.b3lyp_6-31g(d).gjf (generated)

052938484.b3lyp_6-31g(d).firefly.inp (generated)

052938484.b3lyp_6-31g(d).smash.inp (generated)

052938484.b3lyp_6-31g(d).nwchem.inp (generated) 052938484.b3lyp_6-31g(d).log.xz 052938484.mol 052938484.PUBCHEM 052938484.mol (via Jmol)
052938495.b3lyp_6-31g(d).inp

052938495.b3lyp_6-31g(d).qchem.inp (generated)

052938495.b3lyp_6-31g(d).gjf (generated)

052938495.b3lyp_6-31g(d).firefly.inp (generated)

052938495.b3lyp_6-31g(d).smash.inp (generated)

052938495.b3lyp_6-31g(d).nwchem.inp (generated) 052938495.b3lyp_6-31g(d).log.xz 052938495.mol 052938495.PUBCHEM 052938495.mol (via Jmol)
052938511.b3lyp_6-31g(d).inp

052938511.b3lyp_6-31g(d).qchem.inp (generated)

052938511.b3lyp_6-31g(d).gjf (generated)

052938511.b3lyp_6-31g(d).firefly.inp (generated)

052938511.b3lyp_6-31g(d).smash.inp (generated)

052938511.b3lyp_6-31g(d).nwchem.inp (generated) 052938511.b3lyp_6-31g(d).log.xz 052938511.td-b3lyp_6-31g+(d).inp 052938511.td-b3lyp_6-31g+(d).log.xz

052938511.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938511.td-b3lyp_6-31+g(d).gjf (generated)

052938511.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938511.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938511.mol 052938511.PUBCHEM 052938511.mol (via Jmol)
052938620.b3lyp_6-31g(d).inp

052938620.b3lyp_6-31g(d).qchem.inp (generated)

052938620.b3lyp_6-31g(d).gjf (generated)

052938620.b3lyp_6-31g(d).firefly.inp (generated)

052938620.b3lyp_6-31g(d).smash.inp (generated)

052938620.b3lyp_6-31g(d).nwchem.inp (generated) 052938620.b3lyp_6-31g(d).log.xz 052938620.td-b3lyp_6-31g+(d).inp 052938620.td-b3lyp_6-31g+(d).log.xz

052938620.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938620.td-b3lyp_6-31+g(d).gjf (generated)

052938620.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938620.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938620.mol 052938620.PUBCHEM 052938620.mol (via Jmol)
052938621.b3lyp_6-31g(d).inp

052938621.b3lyp_6-31g(d).qchem.inp (generated)

052938621.b3lyp_6-31g(d).gjf (generated)

052938621.b3lyp_6-31g(d).firefly.inp (generated)

052938621.b3lyp_6-31g(d).smash.inp (generated)

052938621.b3lyp_6-31g(d).nwchem.inp (generated) 052938621.b3lyp_6-31g(d).log.xz 052938621.td-b3lyp_6-31g+(d).inp 052938621.td-b3lyp_6-31g+(d).log.xz

052938621.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938621.td-b3lyp_6-31+g(d).gjf (generated)

052938621.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938621.mol 052938621.PUBCHEM 052938621.mol (via Jmol)
052938622.b3lyp_6-31g(d).inp

052938622.b3lyp_6-31g(d).qchem.inp (generated)

052938622.b3lyp_6-31g(d).gjf (generated)

052938622.b3lyp_6-31g(d).firefly.inp (generated)

052938622.b3lyp_6-31g(d).smash.inp (generated)

052938622.b3lyp_6-31g(d).nwchem.inp (generated) 052938622.b3lyp_6-31g(d).log.xz 052938622.td-b3lyp_6-31g+(d).inp 052938622.td-b3lyp_6-31g+(d).log.xz

052938622.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938622.td-b3lyp_6-31+g(d).gjf (generated)

052938622.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938622.mol 052938622.PUBCHEM 052938622.mol (via Jmol)
052938626.b3lyp_6-31g(d).inp

052938626.b3lyp_6-31g(d).qchem.inp (generated)

052938626.b3lyp_6-31g(d).gjf (generated)

052938626.b3lyp_6-31g(d).firefly.inp (generated)

052938626.b3lyp_6-31g(d).smash.inp (generated)

052938626.b3lyp_6-31g(d).nwchem.inp (generated) 052938626.b3lyp_6-31g(d).log.xz 052938626.mol 052938626.PUBCHEM 052938626.mol (via Jmol)
052938680.b3lyp_6-31g(d).inp

052938680.b3lyp_6-31g(d).qchem.inp (generated)

052938680.b3lyp_6-31g(d).gjf (generated)

052938680.b3lyp_6-31g(d).firefly.inp (generated)

052938680.b3lyp_6-31g(d).smash.inp (generated)

052938680.b3lyp_6-31g(d).nwchem.inp (generated) 052938680.b3lyp_6-31g(d).log.xz 052938680.td-b3lyp_6-31g+(d).inp 052938680.td-b3lyp_6-31g+(d).log.xz

052938680.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938680.td-b3lyp_6-31+g(d).gjf (generated)

052938680.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938680.mol 052938680.PUBCHEM 052938680.mol (via Jmol)
052938769.b3lyp_6-31g(d).inp

052938769.b3lyp_6-31g(d).qchem.inp (generated)

052938769.b3lyp_6-31g(d).gjf (generated)

052938769.b3lyp_6-31g(d).firefly.inp (generated)

052938769.b3lyp_6-31g(d).smash.inp (generated)

052938769.b3lyp_6-31g(d).nwchem.inp (generated) 052938769.b3lyp_6-31g(d).log.xz 052938769.mol 052938769.PUBCHEM 052938769.mol (via Jmol)
052938890.b3lyp_6-31g(d).inp

052938890.b3lyp_6-31g(d).qchem.inp (generated)

052938890.b3lyp_6-31g(d).gjf (generated)

052938890.b3lyp_6-31g(d).firefly.inp (generated)

052938890.b3lyp_6-31g(d).smash.inp (generated)

052938890.b3lyp_6-31g(d).nwchem.inp (generated) 052938890.b3lyp_6-31g(d).log.xz 052938890.td-b3lyp_6-31g+(d).inp 052938890.td-b3lyp_6-31g+(d).log.xz

052938890.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938890.td-b3lyp_6-31+g(d).gjf (generated)

052938890.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938890.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938890.mol 052938890.PUBCHEM 052938890.mol (via Jmol)
052938900.b3lyp_6-31g(d).inp

052938900.b3lyp_6-31g(d).qchem.inp (generated)

052938900.b3lyp_6-31g(d).gjf (generated)

052938900.b3lyp_6-31g(d).firefly.inp (generated)

052938900.b3lyp_6-31g(d).smash.inp (generated)

052938900.b3lyp_6-31g(d).nwchem.inp (generated) 052938900.b3lyp_6-31g(d).log.xz 052938900.td-b3lyp_6-31g+(d).inp 052938900.td-b3lyp_6-31g+(d).log.xz

052938900.td-b3lyp_6-31+g(d).qchem.inp (generated)

052938900.td-b3lyp_6-31+g(d).gjf (generated)

052938900.td-b3lyp_6-31+g(d).firefly.inp (generated)

052938900.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052938900.mol 052938900.PUBCHEM 052938900.mol (via Jmol)
052939017.b3lyp_6-31g(d).inp

052939017.b3lyp_6-31g(d).qchem.inp (generated)

052939017.b3lyp_6-31g(d).gjf (generated)

052939017.b3lyp_6-31g(d).firefly.inp (generated)

052939017.b3lyp_6-31g(d).smash.inp (generated)

052939017.b3lyp_6-31g(d).nwchem.inp (generated) 052939017.b3lyp_6-31g(d).log.xz 052939017.td-b3lyp_6-31g+(d).inp 052939017.td-b3lyp_6-31g+(d).log.xz

052939017.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939017.td-b3lyp_6-31+g(d).gjf (generated)

052939017.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939017.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939017.mol 052939017.PUBCHEM 052939017.mol (via Jmol)
052939082.b3lyp_6-31g(d).inp

052939082.b3lyp_6-31g(d).qchem.inp (generated)

052939082.b3lyp_6-31g(d).gjf (generated)

052939082.b3lyp_6-31g(d).firefly.inp (generated)

052939082.b3lyp_6-31g(d).smash.inp (generated)

052939082.b3lyp_6-31g(d).nwchem.inp (generated) 052939082.b3lyp_6-31g(d).log.xz 052939082.td-b3lyp_6-31g+(d).inp 052939082.td-b3lyp_6-31g+(d).log.xz

052939082.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939082.td-b3lyp_6-31+g(d).gjf (generated)

052939082.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939082.mol 052939082.PUBCHEM 052939082.mol (via Jmol)
052939085.b3lyp_6-31g(d).inp

052939085.b3lyp_6-31g(d).qchem.inp (generated)

052939085.b3lyp_6-31g(d).gjf (generated)

052939085.b3lyp_6-31g(d).firefly.inp (generated)

052939085.b3lyp_6-31g(d).smash.inp (generated)

052939085.b3lyp_6-31g(d).nwchem.inp (generated) 052939085.b3lyp_6-31g(d).log.xz 052939085.td-b3lyp_6-31g+(d).inp 052939085.td-b3lyp_6-31g+(d).log.xz

052939085.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939085.td-b3lyp_6-31+g(d).gjf (generated)

052939085.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939085.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939085.mol 052939085.PUBCHEM 052939085.mol (via Jmol)
052939086.b3lyp_6-31g(d).inp

052939086.b3lyp_6-31g(d).qchem.inp (generated)

052939086.b3lyp_6-31g(d).gjf (generated)

052939086.b3lyp_6-31g(d).firefly.inp (generated)

052939086.b3lyp_6-31g(d).smash.inp (generated)

052939086.b3lyp_6-31g(d).nwchem.inp (generated) 052939086.b3lyp_6-31g(d).log.xz 052939086.td-b3lyp_6-31g+(d).inp 052939086.td-b3lyp_6-31g+(d).log.xz

052939086.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939086.td-b3lyp_6-31+g(d).gjf (generated)

052939086.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939086.mol 052939086.PUBCHEM 052939086.mol (via Jmol)
052939087.b3lyp_6-31g(d).inp

052939087.b3lyp_6-31g(d).qchem.inp (generated)

052939087.b3lyp_6-31g(d).gjf (generated)

052939087.b3lyp_6-31g(d).firefly.inp (generated)

052939087.b3lyp_6-31g(d).smash.inp (generated)

052939087.b3lyp_6-31g(d).nwchem.inp (generated) 052939087.b3lyp_6-31g(d).log.xz 052939087.td-b3lyp_6-31g+(d).inp 052939087.td-b3lyp_6-31g+(d).log.xz

052939087.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939087.td-b3lyp_6-31+g(d).gjf (generated)

052939087.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939087.mol 052939087.PUBCHEM 052939087.mol (via Jmol)
052939197.b3lyp_6-31g(d).inp

052939197.b3lyp_6-31g(d).qchem.inp (generated)

052939197.b3lyp_6-31g(d).gjf (generated)

052939197.b3lyp_6-31g(d).firefly.inp (generated)

052939197.b3lyp_6-31g(d).smash.inp (generated)

052939197.b3lyp_6-31g(d).nwchem.inp (generated) 052939197.b3lyp_6-31g(d).log.xz 052939197.td-b3lyp_6-31g+(d).inp 052939197.td-b3lyp_6-31g+(d).log.xz

052939197.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939197.td-b3lyp_6-31+g(d).gjf (generated)

052939197.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939197.mol 052939197.PUBCHEM 052939197.mol (via Jmol)
052939279.b3lyp_6-31g(d).inp

052939279.b3lyp_6-31g(d).qchem.inp (generated)

052939279.b3lyp_6-31g(d).gjf (generated)

052939279.b3lyp_6-31g(d).firefly.inp (generated)

052939279.b3lyp_6-31g(d).smash.inp (generated)

052939279.b3lyp_6-31g(d).nwchem.inp (generated) 052939279.b3lyp_6-31g(d).log.xz 052939279.td-b3lyp_6-31g+(d).inp 052939279.td-b3lyp_6-31g+(d).log.xz

052939279.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939279.td-b3lyp_6-31+g(d).gjf (generated)

052939279.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939279.mol 052939279.PUBCHEM 052939279.mol (via Jmol)
052939400.b3lyp_6-31g(d).inp

052939400.b3lyp_6-31g(d).qchem.inp (generated)

052939400.b3lyp_6-31g(d).gjf (generated)

052939400.b3lyp_6-31g(d).firefly.inp (generated)

052939400.b3lyp_6-31g(d).smash.inp (generated)

052939400.b3lyp_6-31g(d).nwchem.inp (generated) 052939400.b3lyp_6-31g(d).log.xz 052939400.td-b3lyp_6-31g+(d).inp 052939400.td-b3lyp_6-31g+(d).log.xz

052939400.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939400.td-b3lyp_6-31+g(d).gjf (generated)

052939400.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939400.mol 052939400.PUBCHEM 052939400.mol (via Jmol)
052939472.b3lyp_6-31g(d).inp

052939472.b3lyp_6-31g(d).qchem.inp (generated)

052939472.b3lyp_6-31g(d).gjf (generated)

052939472.b3lyp_6-31g(d).firefly.inp (generated)

052939472.b3lyp_6-31g(d).smash.inp (generated)

052939472.b3lyp_6-31g(d).nwchem.inp (generated) 052939472.b3lyp_6-31g(d).log.xz 052939472.td-b3lyp_6-31g+(d).inp 052939472.td-b3lyp_6-31g+(d).log.xz

052939472.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939472.td-b3lyp_6-31+g(d).gjf (generated)

052939472.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939472.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939472.mol 052939472.PUBCHEM 052939472.mol (via Jmol)
052939608.b3lyp_6-31g(d).inp

052939608.b3lyp_6-31g(d).qchem.inp (generated)

052939608.b3lyp_6-31g(d).gjf (generated)

052939608.b3lyp_6-31g(d).firefly.inp (generated)

052939608.b3lyp_6-31g(d).smash.inp (generated)

052939608.b3lyp_6-31g(d).nwchem.inp (generated) 052939608.b3lyp_6-31g(d).log.xz 052939608.td-b3lyp_6-31g+(d).inp 052939608.td-b3lyp_6-31g+(d).log.xz

052939608.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939608.td-b3lyp_6-31+g(d).gjf (generated)

052939608.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939608.mol 052939608.PUBCHEM 052939608.mol (via Jmol)
052939731.b3lyp_6-31g(d).inp

052939731.b3lyp_6-31g(d).qchem.inp (generated)

052939731.b3lyp_6-31g(d).gjf (generated)

052939731.b3lyp_6-31g(d).firefly.inp (generated)

052939731.b3lyp_6-31g(d).smash.inp (generated)

052939731.b3lyp_6-31g(d).nwchem.inp (generated) 052939731.b3lyp_6-31g(d).log.xz 052939731.mol 052939731.PUBCHEM 052939731.mol (via Jmol)
052939951.b3lyp_6-31g(d).inp

052939951.b3lyp_6-31g(d).qchem.inp (generated)

052939951.b3lyp_6-31g(d).gjf (generated)

052939951.b3lyp_6-31g(d).firefly.inp (generated)

052939951.b3lyp_6-31g(d).smash.inp (generated)

052939951.b3lyp_6-31g(d).nwchem.inp (generated) 052939951.b3lyp_6-31g(d).log.xz 052939951.td-b3lyp_6-31g+(d).inp 052939951.td-b3lyp_6-31g+(d).log.xz

052939951.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939951.td-b3lyp_6-31+g(d).gjf (generated)

052939951.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939951.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939951.mol 052939951.PUBCHEM 052939951.mol (via Jmol)
052939955.b3lyp_6-31g(d).inp

052939955.b3lyp_6-31g(d).qchem.inp (generated)

052939955.b3lyp_6-31g(d).gjf (generated)

052939955.b3lyp_6-31g(d).firefly.inp (generated)

052939955.b3lyp_6-31g(d).smash.inp (generated)

052939955.b3lyp_6-31g(d).nwchem.inp (generated) 052939955.b3lyp_6-31g(d).log.xz 052939955.td-b3lyp_6-31g+(d).inp 052939955.td-b3lyp_6-31g+(d).log.xz

052939955.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939955.td-b3lyp_6-31+g(d).gjf (generated)

052939955.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939955.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939955.mol 052939955.PUBCHEM 052939955.mol (via Jmol)
052939958.b3lyp_6-31g(d).inp

052939958.b3lyp_6-31g(d).qchem.inp (generated)

052939958.b3lyp_6-31g(d).gjf (generated)

052939958.b3lyp_6-31g(d).firefly.inp (generated)

052939958.b3lyp_6-31g(d).smash.inp (generated)

052939958.b3lyp_6-31g(d).nwchem.inp (generated) 052939958.b3lyp_6-31g(d).log.xz 052939958.td-b3lyp_6-31g+(d).inp 052939958.td-b3lyp_6-31g+(d).log.xz

052939958.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939958.td-b3lyp_6-31+g(d).gjf (generated)

052939958.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939958.mol 052939958.PUBCHEM 052939958.mol (via Jmol)
052939959.b3lyp_6-31g(d).inp

052939959.b3lyp_6-31g(d).qchem.inp (generated)

052939959.b3lyp_6-31g(d).gjf (generated)

052939959.b3lyp_6-31g(d).firefly.inp (generated)

052939959.b3lyp_6-31g(d).smash.inp (generated)

052939959.b3lyp_6-31g(d).nwchem.inp (generated) 052939959.b3lyp_6-31g(d).log.xz 052939959.mol 052939959.PUBCHEM 052939959.mol (via Jmol)
052939986.b3lyp_6-31g(d).inp

052939986.b3lyp_6-31g(d).qchem.inp (generated)

052939986.b3lyp_6-31g(d).gjf (generated)

052939986.b3lyp_6-31g(d).firefly.inp (generated)

052939986.b3lyp_6-31g(d).smash.inp (generated)

052939986.b3lyp_6-31g(d).nwchem.inp (generated) 052939986.b3lyp_6-31g(d).log.xz 052939986.td-b3lyp_6-31g+(d).inp 052939986.td-b3lyp_6-31g+(d).log.xz

052939986.td-b3lyp_6-31+g(d).qchem.inp (generated)

052939986.td-b3lyp_6-31+g(d).gjf (generated)

052939986.td-b3lyp_6-31+g(d).firefly.inp (generated)

052939986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052939986.mol 052939986.PUBCHEM 052939986.mol (via Jmol)
052939987.b3lyp_6-31g(d).inp

052939987.b3lyp_6-31g(d).qchem.inp (generated)

052939987.b3lyp_6-31g(d).gjf (generated)

052939987.b3lyp_6-31g(d).firefly.inp (generated)

052939987.b3lyp_6-31g(d).smash.inp (generated)

052939987.b3lyp_6-31g(d).nwchem.inp (generated) 052939987.b3lyp_6-31g(d).log.xz 052939987.mol 052939987.PUBCHEM 052939987.mol (via Jmol)
052940086.b3lyp_6-31g(d).inp

052940086.b3lyp_6-31g(d).qchem.inp (generated)

052940086.b3lyp_6-31g(d).gjf (generated)

052940086.b3lyp_6-31g(d).firefly.inp (generated)

052940086.b3lyp_6-31g(d).smash.inp (generated)

052940086.b3lyp_6-31g(d).nwchem.inp (generated) 052940086.b3lyp_6-31g(d).log.xz 052940086.td-b3lyp_6-31g+(d).inp 052940086.td-b3lyp_6-31g+(d).log.xz

052940086.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940086.td-b3lyp_6-31+g(d).gjf (generated)

052940086.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940086.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940086.mol 052940086.PUBCHEM 052940086.mol (via Jmol)
052940087.b3lyp_6-31g(d).inp

052940087.b3lyp_6-31g(d).qchem.inp (generated)

052940087.b3lyp_6-31g(d).gjf (generated)

052940087.b3lyp_6-31g(d).firefly.inp (generated)

052940087.b3lyp_6-31g(d).smash.inp (generated)

052940087.b3lyp_6-31g(d).nwchem.inp (generated) 052940087.b3lyp_6-31g(d).log.xz 052940087.td-b3lyp_6-31g+(d).inp 052940087.td-b3lyp_6-31g+(d).log.xz

052940087.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940087.td-b3lyp_6-31+g(d).gjf (generated)

052940087.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940087.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940087.mol 052940087.PUBCHEM 052940087.mol (via Jmol)
052940093.b3lyp_6-31g(d).inp

052940093.b3lyp_6-31g(d).qchem.inp (generated)

052940093.b3lyp_6-31g(d).gjf (generated)

052940093.b3lyp_6-31g(d).firefly.inp (generated)

052940093.b3lyp_6-31g(d).smash.inp (generated)

052940093.b3lyp_6-31g(d).nwchem.inp (generated) 052940093.b3lyp_6-31g(d).log.xz 052940093.td-b3lyp_6-31g+(d).inp 052940093.td-b3lyp_6-31g+(d).log.xz

052940093.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940093.td-b3lyp_6-31+g(d).gjf (generated)

052940093.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940093.mol 052940093.PUBCHEM 052940093.mol (via Jmol)
052940098.b3lyp_6-31g(d).inp

052940098.b3lyp_6-31g(d).qchem.inp (generated)

052940098.b3lyp_6-31g(d).gjf (generated)

052940098.b3lyp_6-31g(d).firefly.inp (generated)

052940098.b3lyp_6-31g(d).smash.inp (generated)

052940098.b3lyp_6-31g(d).nwchem.inp (generated) 052940098.b3lyp_6-31g(d).log.xz 052940098.td-b3lyp_6-31g+(d).inp 052940098.td-b3lyp_6-31g+(d).log.xz

052940098.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940098.td-b3lyp_6-31+g(d).gjf (generated)

052940098.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940098.mol 052940098.PUBCHEM 052940098.mol (via Jmol)
052940100.b3lyp_6-31g(d).inp

052940100.b3lyp_6-31g(d).qchem.inp (generated)

052940100.b3lyp_6-31g(d).gjf (generated)

052940100.b3lyp_6-31g(d).firefly.inp (generated)

052940100.b3lyp_6-31g(d).smash.inp (generated)

052940100.b3lyp_6-31g(d).nwchem.inp (generated) 052940100.b3lyp_6-31g(d).log.xz 052940100.td-b3lyp_6-31g+(d).inp 052940100.td-b3lyp_6-31g+(d).log.xz

052940100.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940100.td-b3lyp_6-31+g(d).gjf (generated)

052940100.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940100.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940100.mol 052940100.PUBCHEM 052940100.mol (via Jmol)
052940101.b3lyp_6-31g(d).inp

052940101.b3lyp_6-31g(d).qchem.inp (generated)

052940101.b3lyp_6-31g(d).gjf (generated)

052940101.b3lyp_6-31g(d).firefly.inp (generated)

052940101.b3lyp_6-31g(d).smash.inp (generated)

052940101.b3lyp_6-31g(d).nwchem.inp (generated) 052940101.b3lyp_6-31g(d).log.xz 052940101.td-b3lyp_6-31g+(d).inp 052940101.td-b3lyp_6-31g+(d).log.xz

052940101.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940101.td-b3lyp_6-31+g(d).gjf (generated)

052940101.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940101.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940101.mol 052940101.PUBCHEM 052940101.mol (via Jmol)
052940107.b3lyp_6-31g(d).inp

052940107.b3lyp_6-31g(d).qchem.inp (generated)

052940107.b3lyp_6-31g(d).gjf (generated)

052940107.b3lyp_6-31g(d).firefly.inp (generated)

052940107.b3lyp_6-31g(d).smash.inp (generated)

052940107.b3lyp_6-31g(d).nwchem.inp (generated) 052940107.b3lyp_6-31g(d).log.xz 052940107.td-b3lyp_6-31g+(d).inp 052940107.td-b3lyp_6-31g+(d).log.xz

052940107.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940107.td-b3lyp_6-31+g(d).gjf (generated)

052940107.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940107.mol 052940107.PUBCHEM 052940107.mol (via Jmol)
052940120.b3lyp_6-31g(d).inp

052940120.b3lyp_6-31g(d).qchem.inp (generated)

052940120.b3lyp_6-31g(d).gjf (generated)

052940120.b3lyp_6-31g(d).firefly.inp (generated)

052940120.b3lyp_6-31g(d).smash.inp (generated)

052940120.b3lyp_6-31g(d).nwchem.inp (generated) 052940120.b3lyp_6-31g(d).log.xz 052940120.mol 052940120.PUBCHEM 052940120.mol (via Jmol)
052940127.b3lyp_6-31g(d).inp

052940127.b3lyp_6-31g(d).qchem.inp (generated)

052940127.b3lyp_6-31g(d).gjf (generated)

052940127.b3lyp_6-31g(d).firefly.inp (generated)

052940127.b3lyp_6-31g(d).smash.inp (generated)

052940127.b3lyp_6-31g(d).nwchem.inp (generated) 052940127.b3lyp_6-31g(d).log.xz 052940127.td-b3lyp_6-31g+(d).inp 052940127.td-b3lyp_6-31g+(d).log.xz

052940127.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940127.td-b3lyp_6-31+g(d).gjf (generated)

052940127.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940127.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940127.mol 052940127.PUBCHEM 052940127.mol (via Jmol)
052940166.b3lyp_6-31g(d).inp

052940166.b3lyp_6-31g(d).qchem.inp (generated)

052940166.b3lyp_6-31g(d).gjf (generated)

052940166.b3lyp_6-31g(d).firefly.inp (generated)

052940166.b3lyp_6-31g(d).smash.inp (generated)

052940166.b3lyp_6-31g(d).nwchem.inp (generated) 052940166.b3lyp_6-31g(d).log.xz 052940166.td-b3lyp_6-31g+(d).inp 052940166.td-b3lyp_6-31g+(d).log.xz

052940166.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940166.td-b3lyp_6-31+g(d).gjf (generated)

052940166.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940166.mol 052940166.PUBCHEM 052940166.mol (via Jmol)
052940167.b3lyp_6-31g(d).inp

052940167.b3lyp_6-31g(d).qchem.inp (generated)

052940167.b3lyp_6-31g(d).gjf (generated)

052940167.b3lyp_6-31g(d).firefly.inp (generated)

052940167.b3lyp_6-31g(d).smash.inp (generated)

052940167.b3lyp_6-31g(d).nwchem.inp (generated) 052940167.b3lyp_6-31g(d).log.xz 052940167.td-b3lyp_6-31g+(d).inp 052940167.td-b3lyp_6-31g+(d).log.xz

052940167.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940167.td-b3lyp_6-31+g(d).gjf (generated)

052940167.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940167.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940167.mol 052940167.PUBCHEM 052940167.mol (via Jmol)
052940186.b3lyp_6-31g(d).inp

052940186.b3lyp_6-31g(d).qchem.inp (generated)

052940186.b3lyp_6-31g(d).gjf (generated)

052940186.b3lyp_6-31g(d).firefly.inp (generated)

052940186.b3lyp_6-31g(d).smash.inp (generated)

052940186.b3lyp_6-31g(d).nwchem.inp (generated) 052940186.b3lyp_6-31g(d).log.xz 052940186.td-b3lyp_6-31g+(d).inp 052940186.td-b3lyp_6-31g+(d).log.xz

052940186.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940186.td-b3lyp_6-31+g(d).gjf (generated)

052940186.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940186.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940186.mol 052940186.PUBCHEM 052940186.mol (via Jmol)
052940235.b3lyp_6-31g(d).inp

052940235.b3lyp_6-31g(d).qchem.inp (generated)

052940235.b3lyp_6-31g(d).gjf (generated)

052940235.b3lyp_6-31g(d).firefly.inp (generated)

052940235.b3lyp_6-31g(d).smash.inp (generated)

052940235.b3lyp_6-31g(d).nwchem.inp (generated) 052940235.b3lyp_6-31g(d).log.xz 052940235.td-b3lyp_6-31g+(d).inp 052940235.td-b3lyp_6-31g+(d).log.xz

052940235.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940235.td-b3lyp_6-31+g(d).gjf (generated)

052940235.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940235.mol 052940235.PUBCHEM 052940235.mol (via Jmol)
052940261.b3lyp_6-31g(d).inp

052940261.b3lyp_6-31g(d).qchem.inp (generated)

052940261.b3lyp_6-31g(d).gjf (generated)

052940261.b3lyp_6-31g(d).firefly.inp (generated)

052940261.b3lyp_6-31g(d).smash.inp (generated)

052940261.b3lyp_6-31g(d).nwchem.inp (generated) 052940261.b3lyp_6-31g(d).log.xz 052940261.td-b3lyp_6-31g+(d).inp 052940261.td-b3lyp_6-31g+(d).log.xz

052940261.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940261.td-b3lyp_6-31+g(d).gjf (generated)

052940261.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940261.mol 052940261.PUBCHEM 052940261.mol (via Jmol)
052940272.b3lyp_6-31g(d).inp

052940272.b3lyp_6-31g(d).qchem.inp (generated)

052940272.b3lyp_6-31g(d).gjf (generated)

052940272.b3lyp_6-31g(d).firefly.inp (generated)

052940272.b3lyp_6-31g(d).smash.inp (generated)

052940272.b3lyp_6-31g(d).nwchem.inp (generated) 052940272.b3lyp_6-31g(d).log.xz 052940272.td-b3lyp_6-31g+(d).inp 052940272.td-b3lyp_6-31g+(d).log.xz

052940272.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940272.td-b3lyp_6-31+g(d).gjf (generated)

052940272.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940272.mol 052940272.PUBCHEM 052940272.mol (via Jmol)
052940274.b3lyp_6-31g(d).inp

052940274.b3lyp_6-31g(d).qchem.inp (generated)

052940274.b3lyp_6-31g(d).gjf (generated)

052940274.b3lyp_6-31g(d).firefly.inp (generated)

052940274.b3lyp_6-31g(d).smash.inp (generated)

052940274.b3lyp_6-31g(d).nwchem.inp (generated) 052940274.b3lyp_6-31g(d).log.xz 052940274.td-b3lyp_6-31g+(d).inp 052940274.td-b3lyp_6-31g+(d).log.xz

052940274.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940274.td-b3lyp_6-31+g(d).gjf (generated)

052940274.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940274.mol 052940274.PUBCHEM 052940274.mol (via Jmol)
052940278.b3lyp_6-31g(d).inp

052940278.b3lyp_6-31g(d).qchem.inp (generated)

052940278.b3lyp_6-31g(d).gjf (generated)

052940278.b3lyp_6-31g(d).firefly.inp (generated)

052940278.b3lyp_6-31g(d).smash.inp (generated)

052940278.b3lyp_6-31g(d).nwchem.inp (generated) 052940278.b3lyp_6-31g(d).log.xz 052940278.mol 052940278.PUBCHEM 052940278.mol (via Jmol)
052940279.b3lyp_6-31g(d).inp

052940279.b3lyp_6-31g(d).qchem.inp (generated)

052940279.b3lyp_6-31g(d).gjf (generated)

052940279.b3lyp_6-31g(d).firefly.inp (generated)

052940279.b3lyp_6-31g(d).smash.inp (generated)

052940279.b3lyp_6-31g(d).nwchem.inp (generated) 052940279.b3lyp_6-31g(d).log.xz 052940279.mol 052940279.PUBCHEM 052940279.mol (via Jmol)
052940293.b3lyp_6-31g(d).inp

052940293.b3lyp_6-31g(d).qchem.inp (generated)

052940293.b3lyp_6-31g(d).gjf (generated)

052940293.b3lyp_6-31g(d).firefly.inp (generated)

052940293.b3lyp_6-31g(d).smash.inp (generated)

052940293.b3lyp_6-31g(d).nwchem.inp (generated) 052940293.b3lyp_6-31g(d).log.xz 052940293.mol 052940293.PUBCHEM 052940293.mol (via Jmol)
052940299.b3lyp_6-31g(d).inp

052940299.b3lyp_6-31g(d).qchem.inp (generated)

052940299.b3lyp_6-31g(d).gjf (generated)

052940299.b3lyp_6-31g(d).firefly.inp (generated)

052940299.b3lyp_6-31g(d).smash.inp (generated)

052940299.b3lyp_6-31g(d).nwchem.inp (generated) 052940299.b3lyp_6-31g(d).log.xz 052940299.td-b3lyp_6-31g+(d).inp 052940299.td-b3lyp_6-31g+(d).log.xz

052940299.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940299.td-b3lyp_6-31+g(d).gjf (generated)

052940299.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940299.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940299.mol 052940299.PUBCHEM 052940299.mol (via Jmol)
052940305.b3lyp_6-31g(d).inp

052940305.b3lyp_6-31g(d).qchem.inp (generated)

052940305.b3lyp_6-31g(d).gjf (generated)

052940305.b3lyp_6-31g(d).firefly.inp (generated)

052940305.b3lyp_6-31g(d).smash.inp (generated)

052940305.b3lyp_6-31g(d).nwchem.inp (generated) 052940305.b3lyp_6-31g(d).log.xz 052940305.td-b3lyp_6-31g+(d).inp 052940305.td-b3lyp_6-31g+(d).log.xz

052940305.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940305.td-b3lyp_6-31+g(d).gjf (generated)

052940305.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940305.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940305.mol 052940305.PUBCHEM 052940305.mol (via Jmol)
052940307.b3lyp_6-31g(d).inp

052940307.b3lyp_6-31g(d).qchem.inp (generated)

052940307.b3lyp_6-31g(d).gjf (generated)

052940307.b3lyp_6-31g(d).firefly.inp (generated)

052940307.b3lyp_6-31g(d).smash.inp (generated)

052940307.b3lyp_6-31g(d).nwchem.inp (generated) 052940307.b3lyp_6-31g(d).log.xz 052940307.td-b3lyp_6-31g+(d).inp 052940307.td-b3lyp_6-31g+(d).log.xz

052940307.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940307.td-b3lyp_6-31+g(d).gjf (generated)

052940307.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940307.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940307.mol 052940307.PUBCHEM 052940307.mol (via Jmol)
052940309.b3lyp_6-31g(d).inp

052940309.b3lyp_6-31g(d).qchem.inp (generated)

052940309.b3lyp_6-31g(d).gjf (generated)

052940309.b3lyp_6-31g(d).firefly.inp (generated)

052940309.b3lyp_6-31g(d).smash.inp (generated)

052940309.b3lyp_6-31g(d).nwchem.inp (generated) 052940309.b3lyp_6-31g(d).log.xz 052940309.td-b3lyp_6-31g+(d).inp 052940309.td-b3lyp_6-31g+(d).log.xz

052940309.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940309.td-b3lyp_6-31+g(d).gjf (generated)

052940309.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940309.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940309.mol 052940309.PUBCHEM 052940309.mol (via Jmol)
052940310.b3lyp_6-31g(d).inp

052940310.b3lyp_6-31g(d).qchem.inp (generated)

052940310.b3lyp_6-31g(d).gjf (generated)

052940310.b3lyp_6-31g(d).firefly.inp (generated)

052940310.b3lyp_6-31g(d).smash.inp (generated)

052940310.b3lyp_6-31g(d).nwchem.inp (generated) 052940310.b3lyp_6-31g(d).log.xz 052940310.td-b3lyp_6-31g+(d).inp 052940310.td-b3lyp_6-31g+(d).log.xz

052940310.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940310.td-b3lyp_6-31+g(d).gjf (generated)

052940310.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940310.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940310.mol 052940310.PUBCHEM 052940310.mol (via Jmol)
052940311.b3lyp_6-31g(d).inp

052940311.b3lyp_6-31g(d).qchem.inp (generated)

052940311.b3lyp_6-31g(d).gjf (generated)

052940311.b3lyp_6-31g(d).firefly.inp (generated)

052940311.b3lyp_6-31g(d).smash.inp (generated)

052940311.b3lyp_6-31g(d).nwchem.inp (generated) 052940311.b3lyp_6-31g(d).log.xz 052940311.td-b3lyp_6-31g+(d).inp 052940311.td-b3lyp_6-31g+(d).log.xz

052940311.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940311.td-b3lyp_6-31+g(d).gjf (generated)

052940311.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940311.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940311.mol 052940311.PUBCHEM 052940311.mol (via Jmol)
052940312.b3lyp_6-31g(d).inp

052940312.b3lyp_6-31g(d).qchem.inp (generated)

052940312.b3lyp_6-31g(d).gjf (generated)

052940312.b3lyp_6-31g(d).firefly.inp (generated)

052940312.b3lyp_6-31g(d).smash.inp (generated)

052940312.b3lyp_6-31g(d).nwchem.inp (generated) 052940312.b3lyp_6-31g(d).log.xz 052940312.td-b3lyp_6-31g+(d).inp 052940312.td-b3lyp_6-31g+(d).log.xz

052940312.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940312.td-b3lyp_6-31+g(d).gjf (generated)

052940312.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940312.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940312.mol 052940312.PUBCHEM 052940312.mol (via Jmol)
052940313.b3lyp_6-31g(d).inp

052940313.b3lyp_6-31g(d).qchem.inp (generated)

052940313.b3lyp_6-31g(d).gjf (generated)

052940313.b3lyp_6-31g(d).firefly.inp (generated)

052940313.b3lyp_6-31g(d).smash.inp (generated)

052940313.b3lyp_6-31g(d).nwchem.inp (generated) 052940313.b3lyp_6-31g(d).log.xz 052940313.td-b3lyp_6-31g+(d).inp 052940313.td-b3lyp_6-31g+(d).log.xz

052940313.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940313.td-b3lyp_6-31+g(d).gjf (generated)

052940313.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940313.mol 052940313.PUBCHEM 052940313.mol (via Jmol)
052940314.b3lyp_6-31g(d).inp

052940314.b3lyp_6-31g(d).qchem.inp (generated)

052940314.b3lyp_6-31g(d).gjf (generated)

052940314.b3lyp_6-31g(d).firefly.inp (generated)

052940314.b3lyp_6-31g(d).smash.inp (generated)

052940314.b3lyp_6-31g(d).nwchem.inp (generated) 052940314.b3lyp_6-31g(d).log.xz 052940314.td-b3lyp_6-31g+(d).inp 052940314.td-b3lyp_6-31g+(d).log.xz

052940314.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940314.td-b3lyp_6-31+g(d).gjf (generated)

052940314.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940314.mol 052940314.PUBCHEM 052940314.mol (via Jmol)
052940315.b3lyp_6-31g(d).inp

052940315.b3lyp_6-31g(d).qchem.inp (generated)

052940315.b3lyp_6-31g(d).gjf (generated)

052940315.b3lyp_6-31g(d).firefly.inp (generated)

052940315.b3lyp_6-31g(d).smash.inp (generated)

052940315.b3lyp_6-31g(d).nwchem.inp (generated) 052940315.b3lyp_6-31g(d).log.xz 052940315.td-b3lyp_6-31g+(d).inp 052940315.td-b3lyp_6-31g+(d).log.xz

052940315.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940315.td-b3lyp_6-31+g(d).gjf (generated)

052940315.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940315.mol 052940315.PUBCHEM 052940315.mol (via Jmol)
052940316.b3lyp_6-31g(d).inp

052940316.b3lyp_6-31g(d).qchem.inp (generated)

052940316.b3lyp_6-31g(d).gjf (generated)

052940316.b3lyp_6-31g(d).firefly.inp (generated)

052940316.b3lyp_6-31g(d).smash.inp (generated)

052940316.b3lyp_6-31g(d).nwchem.inp (generated) 052940316.b3lyp_6-31g(d).log.xz 052940316.td-b3lyp_6-31g+(d).inp 052940316.td-b3lyp_6-31g+(d).log.xz

052940316.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940316.td-b3lyp_6-31+g(d).gjf (generated)

052940316.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940316.mol 052940316.PUBCHEM 052940316.mol (via Jmol)
052940318.b3lyp_6-31g(d).inp

052940318.b3lyp_6-31g(d).qchem.inp (generated)

052940318.b3lyp_6-31g(d).gjf (generated)

052940318.b3lyp_6-31g(d).firefly.inp (generated)

052940318.b3lyp_6-31g(d).smash.inp (generated)

052940318.b3lyp_6-31g(d).nwchem.inp (generated) 052940318.b3lyp_6-31g(d).log.xz 052940318.td-b3lyp_6-31g+(d).inp 052940318.td-b3lyp_6-31g+(d).log.xz

052940318.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940318.td-b3lyp_6-31+g(d).gjf (generated)

052940318.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940318.mol 052940318.PUBCHEM 052940318.mol (via Jmol)
052940319.b3lyp_6-31g(d).inp

052940319.b3lyp_6-31g(d).qchem.inp (generated)

052940319.b3lyp_6-31g(d).gjf (generated)

052940319.b3lyp_6-31g(d).firefly.inp (generated)

052940319.b3lyp_6-31g(d).smash.inp (generated)

052940319.b3lyp_6-31g(d).nwchem.inp (generated) 052940319.b3lyp_6-31g(d).log.xz 052940319.td-b3lyp_6-31g+(d).inp 052940319.td-b3lyp_6-31g+(d).log.xz

052940319.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940319.td-b3lyp_6-31+g(d).gjf (generated)

052940319.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940319.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940319.mol 052940319.PUBCHEM 052940319.mol (via Jmol)
052940320.b3lyp_6-31g(d).inp

052940320.b3lyp_6-31g(d).qchem.inp (generated)

052940320.b3lyp_6-31g(d).gjf (generated)

052940320.b3lyp_6-31g(d).firefly.inp (generated)

052940320.b3lyp_6-31g(d).smash.inp (generated)

052940320.b3lyp_6-31g(d).nwchem.inp (generated) 052940320.b3lyp_6-31g(d).log.xz 052940320.mol 052940320.PUBCHEM 052940320.mol (via Jmol)
052940321.b3lyp_6-31g(d).inp

052940321.b3lyp_6-31g(d).qchem.inp (generated)

052940321.b3lyp_6-31g(d).gjf (generated)

052940321.b3lyp_6-31g(d).firefly.inp (generated)

052940321.b3lyp_6-31g(d).smash.inp (generated)

052940321.b3lyp_6-31g(d).nwchem.inp (generated) 052940321.b3lyp_6-31g(d).log.xz 052940321.td-b3lyp_6-31g+(d).inp 052940321.td-b3lyp_6-31g+(d).log.xz

052940321.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940321.td-b3lyp_6-31+g(d).gjf (generated)

052940321.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940321.mol 052940321.PUBCHEM 052940321.mol (via Jmol)
052940322.b3lyp_6-31g(d).inp

052940322.b3lyp_6-31g(d).qchem.inp (generated)

052940322.b3lyp_6-31g(d).gjf (generated)

052940322.b3lyp_6-31g(d).firefly.inp (generated)

052940322.b3lyp_6-31g(d).smash.inp (generated)

052940322.b3lyp_6-31g(d).nwchem.inp (generated) 052940322.b3lyp_6-31g(d).log.xz 052940322.td-b3lyp_6-31g+(d).inp 052940322.td-b3lyp_6-31g+(d).log.xz

052940322.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940322.td-b3lyp_6-31+g(d).gjf (generated)

052940322.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940322.mol 052940322.PUBCHEM 052940322.mol (via Jmol)
052940324.b3lyp_6-31g(d).inp

052940324.b3lyp_6-31g(d).qchem.inp (generated)

052940324.b3lyp_6-31g(d).gjf (generated)

052940324.b3lyp_6-31g(d).firefly.inp (generated)

052940324.b3lyp_6-31g(d).smash.inp (generated)

052940324.b3lyp_6-31g(d).nwchem.inp (generated) 052940324.b3lyp_6-31g(d).log.xz 052940324.mol 052940324.PUBCHEM 052940324.mol (via Jmol)
052940325.b3lyp_6-31g(d).inp

052940325.b3lyp_6-31g(d).qchem.inp (generated)

052940325.b3lyp_6-31g(d).gjf (generated)

052940325.b3lyp_6-31g(d).firefly.inp (generated)

052940325.b3lyp_6-31g(d).smash.inp (generated)

052940325.b3lyp_6-31g(d).nwchem.inp (generated) 052940325.b3lyp_6-31g(d).log.xz 052940325.td-b3lyp_6-31g+(d).inp 052940325.td-b3lyp_6-31g+(d).log.xz

052940325.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940325.td-b3lyp_6-31+g(d).gjf (generated)

052940325.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940325.mol 052940325.PUBCHEM 052940325.mol (via Jmol)
052940328.b3lyp_6-31g(d).inp

052940328.b3lyp_6-31g(d).qchem.inp (generated)

052940328.b3lyp_6-31g(d).gjf (generated)

052940328.b3lyp_6-31g(d).firefly.inp (generated)

052940328.b3lyp_6-31g(d).smash.inp (generated)

052940328.b3lyp_6-31g(d).nwchem.inp (generated) 052940328.b3lyp_6-31g(d).log.xz 052940328.td-b3lyp_6-31g+(d).inp 052940328.td-b3lyp_6-31g+(d).log.xz

052940328.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940328.td-b3lyp_6-31+g(d).gjf (generated)

052940328.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940328.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940328.mol 052940328.PUBCHEM 052940328.mol (via Jmol)
052940344.b3lyp_6-31g(d).inp

052940344.b3lyp_6-31g(d).qchem.inp (generated)

052940344.b3lyp_6-31g(d).gjf (generated)

052940344.b3lyp_6-31g(d).firefly.inp (generated)

052940344.b3lyp_6-31g(d).smash.inp (generated)

052940344.b3lyp_6-31g(d).nwchem.inp (generated) 052940344.b3lyp_6-31g(d).log.xz 052940344.td-b3lyp_6-31g+(d).inp 052940344.td-b3lyp_6-31g+(d).log.xz

052940344.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940344.td-b3lyp_6-31+g(d).gjf (generated)

052940344.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940344.mol 052940344.PUBCHEM 052940344.mol (via Jmol)
052940345.b3lyp_6-31g(d).inp

052940345.b3lyp_6-31g(d).qchem.inp (generated)

052940345.b3lyp_6-31g(d).gjf (generated)

052940345.b3lyp_6-31g(d).firefly.inp (generated)

052940345.b3lyp_6-31g(d).smash.inp (generated)

052940345.b3lyp_6-31g(d).nwchem.inp (generated) 052940345.b3lyp_6-31g(d).log.xz 052940345.td-b3lyp_6-31g+(d).inp 052940345.td-b3lyp_6-31g+(d).log.xz

052940345.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940345.td-b3lyp_6-31+g(d).gjf (generated)

052940345.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940345.mol 052940345.PUBCHEM 052940345.mol (via Jmol)
052940353.b3lyp_6-31g(d).inp

052940353.b3lyp_6-31g(d).qchem.inp (generated)

052940353.b3lyp_6-31g(d).gjf (generated)

052940353.b3lyp_6-31g(d).firefly.inp (generated)

052940353.b3lyp_6-31g(d).smash.inp (generated)

052940353.b3lyp_6-31g(d).nwchem.inp (generated) 052940353.b3lyp_6-31g(d).log.xz 052940353.mol 052940353.PUBCHEM 052940353.mol (via Jmol)
052940356.b3lyp_6-31g(d).inp

052940356.b3lyp_6-31g(d).qchem.inp (generated)

052940356.b3lyp_6-31g(d).gjf (generated)

052940356.b3lyp_6-31g(d).firefly.inp (generated)

052940356.b3lyp_6-31g(d).smash.inp (generated)

052940356.b3lyp_6-31g(d).nwchem.inp (generated) 052940356.b3lyp_6-31g(d).log.xz 052940356.td-b3lyp_6-31g+(d).inp 052940356.td-b3lyp_6-31g+(d).log.xz

052940356.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940356.td-b3lyp_6-31+g(d).gjf (generated)

052940356.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940356.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940356.mol 052940356.PUBCHEM 052940356.mol (via Jmol)
052940358.b3lyp_6-31g(d).inp

052940358.b3lyp_6-31g(d).qchem.inp (generated)

052940358.b3lyp_6-31g(d).gjf (generated)

052940358.b3lyp_6-31g(d).firefly.inp (generated)

052940358.b3lyp_6-31g(d).smash.inp (generated)

052940358.b3lyp_6-31g(d).nwchem.inp (generated) 052940358.b3lyp_6-31g(d).log.xz 052940358.mol 052940358.PUBCHEM 052940358.mol (via Jmol)
052940359.b3lyp_6-31g(d).inp

052940359.b3lyp_6-31g(d).qchem.inp (generated)

052940359.b3lyp_6-31g(d).gjf (generated)

052940359.b3lyp_6-31g(d).firefly.inp (generated)

052940359.b3lyp_6-31g(d).smash.inp (generated)

052940359.b3lyp_6-31g(d).nwchem.inp (generated) 052940359.b3lyp_6-31g(d).log.xz 052940359.mol 052940359.PUBCHEM 052940359.mol (via Jmol)
052940360.b3lyp_6-31g(d).inp

052940360.b3lyp_6-31g(d).qchem.inp (generated)

052940360.b3lyp_6-31g(d).gjf (generated)

052940360.b3lyp_6-31g(d).firefly.inp (generated)

052940360.b3lyp_6-31g(d).smash.inp (generated)

052940360.b3lyp_6-31g(d).nwchem.inp (generated) 052940360.b3lyp_6-31g(d).log.xz 052940360.td-b3lyp_6-31g+(d).inp 052940360.td-b3lyp_6-31g+(d).log.xz

052940360.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940360.td-b3lyp_6-31+g(d).gjf (generated)

052940360.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940360.mol 052940360.PUBCHEM 052940360.mol (via Jmol)
052940367.b3lyp_6-31g(d).inp

052940367.b3lyp_6-31g(d).qchem.inp (generated)

052940367.b3lyp_6-31g(d).gjf (generated)

052940367.b3lyp_6-31g(d).firefly.inp (generated)

052940367.b3lyp_6-31g(d).smash.inp (generated)

052940367.b3lyp_6-31g(d).nwchem.inp (generated) 052940367.b3lyp_6-31g(d).log.xz 052940367.td-b3lyp_6-31g+(d).inp 052940367.td-b3lyp_6-31g+(d).log.xz

052940367.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940367.td-b3lyp_6-31+g(d).gjf (generated)

052940367.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940367.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940367.mol 052940367.PUBCHEM 052940367.mol (via Jmol)
052940368.b3lyp_6-31g(d).inp

052940368.b3lyp_6-31g(d).qchem.inp (generated)

052940368.b3lyp_6-31g(d).gjf (generated)

052940368.b3lyp_6-31g(d).firefly.inp (generated)

052940368.b3lyp_6-31g(d).smash.inp (generated)

052940368.b3lyp_6-31g(d).nwchem.inp (generated) 052940368.b3lyp_6-31g(d).log.xz 052940368.td-b3lyp_6-31g+(d).inp 052940368.td-b3lyp_6-31g+(d).log.xz

052940368.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940368.td-b3lyp_6-31+g(d).gjf (generated)

052940368.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940368.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940368.mol 052940368.PUBCHEM 052940368.mol (via Jmol)
052940371.b3lyp_6-31g(d).inp

052940371.b3lyp_6-31g(d).qchem.inp (generated)

052940371.b3lyp_6-31g(d).gjf (generated)

052940371.b3lyp_6-31g(d).firefly.inp (generated)

052940371.b3lyp_6-31g(d).smash.inp (generated)

052940371.b3lyp_6-31g(d).nwchem.inp (generated) 052940371.b3lyp_6-31g(d).log.xz 052940371.mol 052940371.PUBCHEM 052940371.mol (via Jmol)
052940376.b3lyp_6-31g(d).inp

052940376.b3lyp_6-31g(d).qchem.inp (generated)

052940376.b3lyp_6-31g(d).gjf (generated)

052940376.b3lyp_6-31g(d).firefly.inp (generated)

052940376.b3lyp_6-31g(d).smash.inp (generated)

052940376.b3lyp_6-31g(d).nwchem.inp (generated) 052940376.b3lyp_6-31g(d).log.xz 052940376.td-b3lyp_6-31g+(d).inp 052940376.td-b3lyp_6-31g+(d).log.xz

052940376.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940376.td-b3lyp_6-31+g(d).gjf (generated)

052940376.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940376.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940376.mol 052940376.PUBCHEM 052940376.mol (via Jmol)
052940377.b3lyp_6-31g(d).inp

052940377.b3lyp_6-31g(d).qchem.inp (generated)

052940377.b3lyp_6-31g(d).gjf (generated)

052940377.b3lyp_6-31g(d).firefly.inp (generated)

052940377.b3lyp_6-31g(d).smash.inp (generated)

052940377.b3lyp_6-31g(d).nwchem.inp (generated) 052940377.b3lyp_6-31g(d).log.xz 052940377.td-b3lyp_6-31g+(d).inp 052940377.td-b3lyp_6-31g+(d).log.xz

052940377.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940377.td-b3lyp_6-31+g(d).gjf (generated)

052940377.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940377.mol 052940377.PUBCHEM 052940377.mol (via Jmol)
052940378.b3lyp_6-31g(d).inp

052940378.b3lyp_6-31g(d).qchem.inp (generated)

052940378.b3lyp_6-31g(d).gjf (generated)

052940378.b3lyp_6-31g(d).firefly.inp (generated)

052940378.b3lyp_6-31g(d).smash.inp (generated)

052940378.b3lyp_6-31g(d).nwchem.inp (generated) 052940378.b3lyp_6-31g(d).log.xz 052940378.td-b3lyp_6-31g+(d).inp 052940378.td-b3lyp_6-31g+(d).log.xz

052940378.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940378.td-b3lyp_6-31+g(d).gjf (generated)

052940378.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940378.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940378.mol 052940378.PUBCHEM 052940378.mol (via Jmol)
052940379.b3lyp_6-31g(d).inp

052940379.b3lyp_6-31g(d).qchem.inp (generated)

052940379.b3lyp_6-31g(d).gjf (generated)

052940379.b3lyp_6-31g(d).firefly.inp (generated)

052940379.b3lyp_6-31g(d).smash.inp (generated)

052940379.b3lyp_6-31g(d).nwchem.inp (generated) 052940379.b3lyp_6-31g(d).log.xz 052940379.mol 052940379.PUBCHEM 052940379.mol (via Jmol)
052940380.b3lyp_6-31g(d).inp

052940380.b3lyp_6-31g(d).qchem.inp (generated)

052940380.b3lyp_6-31g(d).gjf (generated)

052940380.b3lyp_6-31g(d).firefly.inp (generated)

052940380.b3lyp_6-31g(d).smash.inp (generated)

052940380.b3lyp_6-31g(d).nwchem.inp (generated) 052940380.b3lyp_6-31g(d).log.xz 052940380.td-b3lyp_6-31g+(d).inp 052940380.td-b3lyp_6-31g+(d).log.xz

052940380.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940380.td-b3lyp_6-31+g(d).gjf (generated)

052940380.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940380.mol 052940380.PUBCHEM 052940380.mol (via Jmol)
052940382.b3lyp_6-31g(d).inp

052940382.b3lyp_6-31g(d).qchem.inp (generated)

052940382.b3lyp_6-31g(d).gjf (generated)

052940382.b3lyp_6-31g(d).firefly.inp (generated)

052940382.b3lyp_6-31g(d).smash.inp (generated)

052940382.b3lyp_6-31g(d).nwchem.inp (generated) 052940382.b3lyp_6-31g(d).log.xz 052940382.td-b3lyp_6-31g+(d).inp 052940382.td-b3lyp_6-31g+(d).log.xz

052940382.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940382.td-b3lyp_6-31+g(d).gjf (generated)

052940382.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940382.mol 052940382.PUBCHEM 052940382.mol (via Jmol)
052940383.b3lyp_6-31g(d).inp

052940383.b3lyp_6-31g(d).qchem.inp (generated)

052940383.b3lyp_6-31g(d).gjf (generated)

052940383.b3lyp_6-31g(d).firefly.inp (generated)

052940383.b3lyp_6-31g(d).smash.inp (generated)

052940383.b3lyp_6-31g(d).nwchem.inp (generated) 052940383.b3lyp_6-31g(d).log.xz 052940383.td-b3lyp_6-31g+(d).inp 052940383.td-b3lyp_6-31g+(d).log.xz

052940383.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940383.td-b3lyp_6-31+g(d).gjf (generated)

052940383.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940383.mol 052940383.PUBCHEM 052940383.mol (via Jmol)
052940385.b3lyp_6-31g(d).inp

052940385.b3lyp_6-31g(d).qchem.inp (generated)

052940385.b3lyp_6-31g(d).gjf (generated)

052940385.b3lyp_6-31g(d).firefly.inp (generated)

052940385.b3lyp_6-31g(d).smash.inp (generated)

052940385.b3lyp_6-31g(d).nwchem.inp (generated) 052940385.b3lyp_6-31g(d).log.xz 052940385.mol 052940385.PUBCHEM 052940385.mol (via Jmol)
052940386.b3lyp_6-31g(d).inp

052940386.b3lyp_6-31g(d).qchem.inp (generated)

052940386.b3lyp_6-31g(d).gjf (generated)

052940386.b3lyp_6-31g(d).firefly.inp (generated)

052940386.b3lyp_6-31g(d).smash.inp (generated)

052940386.b3lyp_6-31g(d).nwchem.inp (generated) 052940386.b3lyp_6-31g(d).log.xz 052940386.td-b3lyp_6-31g+(d).inp 052940386.td-b3lyp_6-31g+(d).log.xz

052940386.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940386.td-b3lyp_6-31+g(d).gjf (generated)

052940386.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940386.mol 052940386.PUBCHEM 052940386.mol (via Jmol)
052940387.b3lyp_6-31g(d).inp

052940387.b3lyp_6-31g(d).qchem.inp (generated)

052940387.b3lyp_6-31g(d).gjf (generated)

052940387.b3lyp_6-31g(d).firefly.inp (generated)

052940387.b3lyp_6-31g(d).smash.inp (generated)

052940387.b3lyp_6-31g(d).nwchem.inp (generated) 052940387.b3lyp_6-31g(d).log.xz 052940387.td-b3lyp_6-31g+(d).inp 052940387.td-b3lyp_6-31g+(d).log.xz

052940387.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940387.td-b3lyp_6-31+g(d).gjf (generated)

052940387.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940387.mol 052940387.PUBCHEM 052940387.mol (via Jmol)
052940388.b3lyp_6-31g(d).inp

052940388.b3lyp_6-31g(d).qchem.inp (generated)

052940388.b3lyp_6-31g(d).gjf (generated)

052940388.b3lyp_6-31g(d).firefly.inp (generated)

052940388.b3lyp_6-31g(d).smash.inp (generated)

052940388.b3lyp_6-31g(d).nwchem.inp (generated) 052940388.b3lyp_6-31g(d).log.xz 052940388.td-b3lyp_6-31g+(d).inp 052940388.td-b3lyp_6-31g+(d).log.xz

052940388.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940388.td-b3lyp_6-31+g(d).gjf (generated)

052940388.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940388.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940388.mol 052940388.PUBCHEM 052940388.mol (via Jmol)
052940389.b3lyp_6-31g(d).inp

052940389.b3lyp_6-31g(d).qchem.inp (generated)

052940389.b3lyp_6-31g(d).gjf (generated)

052940389.b3lyp_6-31g(d).firefly.inp (generated)

052940389.b3lyp_6-31g(d).smash.inp (generated)

052940389.b3lyp_6-31g(d).nwchem.inp (generated) 052940389.b3lyp_6-31g(d).log.xz 052940389.td-b3lyp_6-31g+(d).inp 052940389.td-b3lyp_6-31g+(d).log.xz

052940389.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940389.td-b3lyp_6-31+g(d).gjf (generated)

052940389.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940389.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940389.mol 052940389.PUBCHEM 052940389.mol (via Jmol)
052940390.b3lyp_6-31g(d).inp

052940390.b3lyp_6-31g(d).qchem.inp (generated)

052940390.b3lyp_6-31g(d).gjf (generated)

052940390.b3lyp_6-31g(d).firefly.inp (generated)

052940390.b3lyp_6-31g(d).smash.inp (generated)

052940390.b3lyp_6-31g(d).nwchem.inp (generated) 052940390.b3lyp_6-31g(d).log.xz 052940390.mol 052940390.PUBCHEM 052940390.mol (via Jmol)
052940391.b3lyp_6-31g(d).inp

052940391.b3lyp_6-31g(d).qchem.inp (generated)

052940391.b3lyp_6-31g(d).gjf (generated)

052940391.b3lyp_6-31g(d).firefly.inp (generated)

052940391.b3lyp_6-31g(d).smash.inp (generated)

052940391.b3lyp_6-31g(d).nwchem.inp (generated) 052940391.b3lyp_6-31g(d).log.xz 052940391.td-b3lyp_6-31g+(d).inp 052940391.td-b3lyp_6-31g+(d).log.xz

052940391.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940391.td-b3lyp_6-31+g(d).gjf (generated)

052940391.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940391.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940391.mol 052940391.PUBCHEM 052940391.mol (via Jmol)
052940392.b3lyp_6-31g(d).inp

052940392.b3lyp_6-31g(d).qchem.inp (generated)

052940392.b3lyp_6-31g(d).gjf (generated)

052940392.b3lyp_6-31g(d).firefly.inp (generated)

052940392.b3lyp_6-31g(d).smash.inp (generated)

052940392.b3lyp_6-31g(d).nwchem.inp (generated) 052940392.b3lyp_6-31g(d).log.xz 052940392.td-b3lyp_6-31g+(d).inp 052940392.td-b3lyp_6-31g+(d).log.xz

052940392.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940392.td-b3lyp_6-31+g(d).gjf (generated)

052940392.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940392.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940392.mol 052940392.PUBCHEM 052940392.mol (via Jmol)
052940393.b3lyp_6-31g(d).inp

052940393.b3lyp_6-31g(d).qchem.inp (generated)

052940393.b3lyp_6-31g(d).gjf (generated)

052940393.b3lyp_6-31g(d).firefly.inp (generated)

052940393.b3lyp_6-31g(d).smash.inp (generated)

052940393.b3lyp_6-31g(d).nwchem.inp (generated) 052940393.b3lyp_6-31g(d).log.xz 052940393.mol 052940393.PUBCHEM 052940393.mol (via Jmol)
052940394.b3lyp_6-31g(d).inp

052940394.b3lyp_6-31g(d).qchem.inp (generated)

052940394.b3lyp_6-31g(d).gjf (generated)

052940394.b3lyp_6-31g(d).firefly.inp (generated)

052940394.b3lyp_6-31g(d).smash.inp (generated)

052940394.b3lyp_6-31g(d).nwchem.inp (generated) 052940394.b3lyp_6-31g(d).log.xz 052940394.td-b3lyp_6-31g+(d).inp 052940394.td-b3lyp_6-31g+(d).log.xz

052940394.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940394.td-b3lyp_6-31+g(d).gjf (generated)

052940394.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940394.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940394.mol 052940394.PUBCHEM 052940394.mol (via Jmol)
052940395.b3lyp_6-31g(d).inp

052940395.b3lyp_6-31g(d).qchem.inp (generated)

052940395.b3lyp_6-31g(d).gjf (generated)

052940395.b3lyp_6-31g(d).firefly.inp (generated)

052940395.b3lyp_6-31g(d).smash.inp (generated)

052940395.b3lyp_6-31g(d).nwchem.inp (generated) 052940395.b3lyp_6-31g(d).log.xz 052940395.td-b3lyp_6-31g+(d).inp 052940395.td-b3lyp_6-31g+(d).log.xz

052940395.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940395.td-b3lyp_6-31+g(d).gjf (generated)

052940395.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940395.mol 052940395.PUBCHEM 052940395.mol (via Jmol)
052940396.b3lyp_6-31g(d).inp

052940396.b3lyp_6-31g(d).qchem.inp (generated)

052940396.b3lyp_6-31g(d).gjf (generated)

052940396.b3lyp_6-31g(d).firefly.inp (generated)

052940396.b3lyp_6-31g(d).smash.inp (generated)

052940396.b3lyp_6-31g(d).nwchem.inp (generated) 052940396.b3lyp_6-31g(d).log.xz 052940396.mol 052940396.PUBCHEM 052940396.mol (via Jmol)
052940397.b3lyp_6-31g(d).inp

052940397.b3lyp_6-31g(d).qchem.inp (generated)

052940397.b3lyp_6-31g(d).gjf (generated)

052940397.b3lyp_6-31g(d).firefly.inp (generated)

052940397.b3lyp_6-31g(d).smash.inp (generated)

052940397.b3lyp_6-31g(d).nwchem.inp (generated) 052940397.b3lyp_6-31g(d).log.xz 052940397.td-b3lyp_6-31g+(d).inp 052940397.td-b3lyp_6-31g+(d).log.xz

052940397.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940397.td-b3lyp_6-31+g(d).gjf (generated)

052940397.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940397.mol 052940397.PUBCHEM 052940397.mol (via Jmol)
052940398.b3lyp_6-31g(d).inp

052940398.b3lyp_6-31g(d).qchem.inp (generated)

052940398.b3lyp_6-31g(d).gjf (generated)

052940398.b3lyp_6-31g(d).firefly.inp (generated)

052940398.b3lyp_6-31g(d).smash.inp (generated)

052940398.b3lyp_6-31g(d).nwchem.inp (generated) 052940398.b3lyp_6-31g(d).log.xz 052940398.mol 052940398.PUBCHEM 052940398.mol (via Jmol)
052940399.b3lyp_6-31g(d).inp

052940399.b3lyp_6-31g(d).qchem.inp (generated)

052940399.b3lyp_6-31g(d).gjf (generated)

052940399.b3lyp_6-31g(d).firefly.inp (generated)

052940399.b3lyp_6-31g(d).smash.inp (generated)

052940399.b3lyp_6-31g(d).nwchem.inp (generated) 052940399.b3lyp_6-31g(d).log.xz 052940399.mol 052940399.PUBCHEM 052940399.mol (via Jmol)
052940400.b3lyp_6-31g(d).inp

052940400.b3lyp_6-31g(d).qchem.inp (generated)

052940400.b3lyp_6-31g(d).gjf (generated)

052940400.b3lyp_6-31g(d).firefly.inp (generated)

052940400.b3lyp_6-31g(d).smash.inp (generated)

052940400.b3lyp_6-31g(d).nwchem.inp (generated) 052940400.b3lyp_6-31g(d).log.xz 052940400.td-b3lyp_6-31g+(d).inp 052940400.td-b3lyp_6-31g+(d).log.xz

052940400.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940400.td-b3lyp_6-31+g(d).gjf (generated)

052940400.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940400.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940400.mol 052940400.PUBCHEM 052940400.mol (via Jmol)
052940403.b3lyp_6-31g(d).inp

052940403.b3lyp_6-31g(d).qchem.inp (generated)

052940403.b3lyp_6-31g(d).gjf (generated)

052940403.b3lyp_6-31g(d).firefly.inp (generated)

052940403.b3lyp_6-31g(d).smash.inp (generated)

052940403.b3lyp_6-31g(d).nwchem.inp (generated) 052940403.b3lyp_6-31g(d).log.xz 052940403.td-b3lyp_6-31g+(d).inp 052940403.td-b3lyp_6-31g+(d).log.xz

052940403.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940403.td-b3lyp_6-31+g(d).gjf (generated)

052940403.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940403.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940403.mol 052940403.PUBCHEM 052940403.mol (via Jmol)
052940404.b3lyp_6-31g(d).inp

052940404.b3lyp_6-31g(d).qchem.inp (generated)

052940404.b3lyp_6-31g(d).gjf (generated)

052940404.b3lyp_6-31g(d).firefly.inp (generated)

052940404.b3lyp_6-31g(d).smash.inp (generated)

052940404.b3lyp_6-31g(d).nwchem.inp (generated) 052940404.b3lyp_6-31g(d).log.xz 052940404.mol 052940404.PUBCHEM 052940404.mol (via Jmol)
052940405.b3lyp_6-31g(d).inp

052940405.b3lyp_6-31g(d).qchem.inp (generated)

052940405.b3lyp_6-31g(d).gjf (generated)

052940405.b3lyp_6-31g(d).firefly.inp (generated)

052940405.b3lyp_6-31g(d).smash.inp (generated)

052940405.b3lyp_6-31g(d).nwchem.inp (generated) 052940405.b3lyp_6-31g(d).log.xz 052940405.mol 052940405.PUBCHEM 052940405.mol (via Jmol)
052940407.b3lyp_6-31g(d).inp

052940407.b3lyp_6-31g(d).qchem.inp (generated)

052940407.b3lyp_6-31g(d).gjf (generated)

052940407.b3lyp_6-31g(d).firefly.inp (generated)

052940407.b3lyp_6-31g(d).smash.inp (generated)

052940407.b3lyp_6-31g(d).nwchem.inp (generated) 052940407.b3lyp_6-31g(d).log.xz 052940407.td-b3lyp_6-31g+(d).inp 052940407.td-b3lyp_6-31g+(d).log.xz

052940407.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940407.td-b3lyp_6-31+g(d).gjf (generated)

052940407.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940407.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940407.mol 052940407.PUBCHEM 052940407.mol (via Jmol)
052940408.b3lyp_6-31g(d).inp

052940408.b3lyp_6-31g(d).qchem.inp (generated)

052940408.b3lyp_6-31g(d).gjf (generated)

052940408.b3lyp_6-31g(d).firefly.inp (generated)

052940408.b3lyp_6-31g(d).smash.inp (generated)

052940408.b3lyp_6-31g(d).nwchem.inp (generated) 052940408.b3lyp_6-31g(d).log.xz 052940408.td-b3lyp_6-31g+(d).inp 052940408.td-b3lyp_6-31g+(d).log.xz

052940408.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940408.td-b3lyp_6-31+g(d).gjf (generated)

052940408.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940408.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940408.mol 052940408.PUBCHEM 052940408.mol (via Jmol)
052940417.b3lyp_6-31g(d).inp

052940417.b3lyp_6-31g(d).qchem.inp (generated)

052940417.b3lyp_6-31g(d).gjf (generated)

052940417.b3lyp_6-31g(d).firefly.inp (generated)

052940417.b3lyp_6-31g(d).smash.inp (generated)

052940417.b3lyp_6-31g(d).nwchem.inp (generated) 052940417.b3lyp_6-31g(d).log.xz 052940417.td-b3lyp_6-31g+(d).inp 052940417.td-b3lyp_6-31g+(d).log.xz

052940417.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940417.td-b3lyp_6-31+g(d).gjf (generated)

052940417.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940417.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940417.mol 052940417.PUBCHEM 052940417.mol (via Jmol)
052940428.b3lyp_6-31g(d).inp

052940428.b3lyp_6-31g(d).qchem.inp (generated)

052940428.b3lyp_6-31g(d).gjf (generated)

052940428.b3lyp_6-31g(d).firefly.inp (generated)

052940428.b3lyp_6-31g(d).smash.inp (generated)

052940428.b3lyp_6-31g(d).nwchem.inp (generated) 052940428.b3lyp_6-31g(d).log.xz 052940428.td-b3lyp_6-31g+(d).inp 052940428.td-b3lyp_6-31g+(d).log.xz

052940428.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940428.td-b3lyp_6-31+g(d).gjf (generated)

052940428.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940428.mol 052940428.PUBCHEM 052940428.mol (via Jmol)
052940433.b3lyp_6-31g(d).inp

052940433.b3lyp_6-31g(d).qchem.inp (generated)

052940433.b3lyp_6-31g(d).gjf (generated)

052940433.b3lyp_6-31g(d).firefly.inp (generated)

052940433.b3lyp_6-31g(d).smash.inp (generated)

052940433.b3lyp_6-31g(d).nwchem.inp (generated) 052940433.b3lyp_6-31g(d).log.xz 052940433.td-b3lyp_6-31g+(d).inp 052940433.td-b3lyp_6-31g+(d).log.xz

052940433.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940433.td-b3lyp_6-31+g(d).gjf (generated)

052940433.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940433.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940433.mol 052940433.PUBCHEM 052940433.mol (via Jmol)
052940443.b3lyp_6-31g(d).inp

052940443.b3lyp_6-31g(d).qchem.inp (generated)

052940443.b3lyp_6-31g(d).gjf (generated)

052940443.b3lyp_6-31g(d).firefly.inp (generated)

052940443.b3lyp_6-31g(d).smash.inp (generated)

052940443.b3lyp_6-31g(d).nwchem.inp (generated) 052940443.b3lyp_6-31g(d).log.xz 052940443.td-b3lyp_6-31g+(d).inp 052940443.td-b3lyp_6-31g+(d).log.xz

052940443.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940443.td-b3lyp_6-31+g(d).gjf (generated)

052940443.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940443.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940443.mol 052940443.PUBCHEM 052940443.mol (via Jmol)
052940546.b3lyp_6-31g(d).inp

052940546.b3lyp_6-31g(d).qchem.inp (generated)

052940546.b3lyp_6-31g(d).gjf (generated)

052940546.b3lyp_6-31g(d).firefly.inp (generated)

052940546.b3lyp_6-31g(d).smash.inp (generated)

052940546.b3lyp_6-31g(d).nwchem.inp (generated) 052940546.b3lyp_6-31g(d).log.xz 052940546.td-b3lyp_6-31g+(d).inp 052940546.td-b3lyp_6-31g+(d).log.xz

052940546.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940546.td-b3lyp_6-31+g(d).gjf (generated)

052940546.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940546.mol 052940546.PUBCHEM 052940546.mol (via Jmol)
052940672.b3lyp_6-31g(d).inp

052940672.b3lyp_6-31g(d).qchem.inp (generated)

052940672.b3lyp_6-31g(d).gjf (generated)

052940672.b3lyp_6-31g(d).firefly.inp (generated)

052940672.b3lyp_6-31g(d).smash.inp (generated)

052940672.b3lyp_6-31g(d).nwchem.inp (generated) 052940672.b3lyp_6-31g(d).log.xz 052940672.td-b3lyp_6-31g+(d).inp 052940672.td-b3lyp_6-31g+(d).log.xz

052940672.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940672.td-b3lyp_6-31+g(d).gjf (generated)

052940672.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940672.mol 052940672.PUBCHEM 052940672.mol (via Jmol)
052940771.b3lyp_6-31g(d).inp

052940771.b3lyp_6-31g(d).qchem.inp (generated)

052940771.b3lyp_6-31g(d).gjf (generated)

052940771.b3lyp_6-31g(d).firefly.inp (generated)

052940771.b3lyp_6-31g(d).smash.inp (generated)

052940771.b3lyp_6-31g(d).nwchem.inp (generated) 052940771.b3lyp_6-31g(d).log.xz 052940771.td-b3lyp_6-31g+(d).inp 052940771.td-b3lyp_6-31g+(d).log.xz

052940771.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940771.td-b3lyp_6-31+g(d).gjf (generated)

052940771.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940771.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940771.mol 052940771.PUBCHEM 052940771.mol (via Jmol)
052940829.b3lyp_6-31g(d).inp

052940829.b3lyp_6-31g(d).qchem.inp (generated)

052940829.b3lyp_6-31g(d).gjf (generated)

052940829.b3lyp_6-31g(d).firefly.inp (generated)

052940829.b3lyp_6-31g(d).smash.inp (generated)

052940829.b3lyp_6-31g(d).nwchem.inp (generated) 052940829.b3lyp_6-31g(d).log.xz 052940829.td-b3lyp_6-31g+(d).inp 052940829.td-b3lyp_6-31g+(d).log.xz

052940829.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940829.td-b3lyp_6-31+g(d).gjf (generated)

052940829.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940829.mol 052940829.PUBCHEM 052940829.mol (via Jmol)
052940830.b3lyp_6-31g(d).inp

052940830.b3lyp_6-31g(d).qchem.inp (generated)

052940830.b3lyp_6-31g(d).gjf (generated)

052940830.b3lyp_6-31g(d).firefly.inp (generated)

052940830.b3lyp_6-31g(d).smash.inp (generated)

052940830.b3lyp_6-31g(d).nwchem.inp (generated) 052940830.b3lyp_6-31g(d).log.xz 052940830.mol 052940830.PUBCHEM 052940830.mol (via Jmol)
052940850.b3lyp_6-31g(d).inp

052940850.b3lyp_6-31g(d).qchem.inp (generated)

052940850.b3lyp_6-31g(d).gjf (generated)

052940850.b3lyp_6-31g(d).firefly.inp (generated)

052940850.b3lyp_6-31g(d).smash.inp (generated)

052940850.b3lyp_6-31g(d).nwchem.inp (generated) 052940850.b3lyp_6-31g(d).log.xz 052940850.mol 052940850.PUBCHEM 052940850.mol (via Jmol)
052940854.b3lyp_6-31g(d).inp

052940854.b3lyp_6-31g(d).qchem.inp (generated)

052940854.b3lyp_6-31g(d).gjf (generated)

052940854.b3lyp_6-31g(d).firefly.inp (generated)

052940854.b3lyp_6-31g(d).smash.inp (generated)

052940854.b3lyp_6-31g(d).nwchem.inp (generated) 052940854.b3lyp_6-31g(d).log.xz 052940854.td-b3lyp_6-31g+(d).inp 052940854.td-b3lyp_6-31g+(d).log.xz

052940854.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940854.td-b3lyp_6-31+g(d).gjf (generated)

052940854.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940854.mol 052940854.PUBCHEM 052940854.mol (via Jmol)
052940958.b3lyp_6-31g(d).inp

052940958.b3lyp_6-31g(d).qchem.inp (generated)

052940958.b3lyp_6-31g(d).gjf (generated)

052940958.b3lyp_6-31g(d).firefly.inp (generated)

052940958.b3lyp_6-31g(d).smash.inp (generated)

052940958.b3lyp_6-31g(d).nwchem.inp (generated) 052940958.b3lyp_6-31g(d).log.xz 052940958.td-b3lyp_6-31g+(d).inp 052940958.td-b3lyp_6-31g+(d).log.xz

052940958.td-b3lyp_6-31+g(d).qchem.inp (generated)

052940958.td-b3lyp_6-31+g(d).gjf (generated)

052940958.td-b3lyp_6-31+g(d).firefly.inp (generated)

052940958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052940958.mol 052940958.PUBCHEM 052940958.mol (via Jmol)
052941113.b3lyp_6-31g(d).inp

052941113.b3lyp_6-31g(d).qchem.inp (generated)

052941113.b3lyp_6-31g(d).gjf (generated)

052941113.b3lyp_6-31g(d).firefly.inp (generated)

052941113.b3lyp_6-31g(d).smash.inp (generated)

052941113.b3lyp_6-31g(d).nwchem.inp (generated) 052941113.b3lyp_6-31g(d).log.xz 052941113.td-b3lyp_6-31g+(d).inp 052941113.td-b3lyp_6-31g+(d).log.xz

052941113.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941113.td-b3lyp_6-31+g(d).gjf (generated)

052941113.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941113.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941113.mol 052941113.PUBCHEM 052941113.mol (via Jmol)
052941143.b3lyp_6-31g(d).inp

052941143.b3lyp_6-31g(d).qchem.inp (generated)

052941143.b3lyp_6-31g(d).gjf (generated)

052941143.b3lyp_6-31g(d).firefly.inp (generated)

052941143.b3lyp_6-31g(d).smash.inp (generated)

052941143.b3lyp_6-31g(d).nwchem.inp (generated) 052941143.b3lyp_6-31g(d).log.xz 052941143.td-b3lyp_6-31g+(d).inp 052941143.td-b3lyp_6-31g+(d).log.xz

052941143.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941143.td-b3lyp_6-31+g(d).gjf (generated)

052941143.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941143.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941143.mol 052941143.PUBCHEM 052941143.mol (via Jmol)
052941336.b3lyp_6-31g(d).inp

052941336.b3lyp_6-31g(d).qchem.inp (generated)

052941336.b3lyp_6-31g(d).gjf (generated)

052941336.b3lyp_6-31g(d).firefly.inp (generated)

052941336.b3lyp_6-31g(d).smash.inp (generated)

052941336.b3lyp_6-31g(d).nwchem.inp (generated) 052941336.b3lyp_6-31g(d).log.xz 052941336.td-b3lyp_6-31g+(d).inp 052941336.td-b3lyp_6-31g+(d).log.xz

052941336.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941336.td-b3lyp_6-31+g(d).gjf (generated)

052941336.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941336.mol 052941336.PUBCHEM 052941336.mol (via Jmol)
052941386.b3lyp_6-31g(d).inp

052941386.b3lyp_6-31g(d).qchem.inp (generated)

052941386.b3lyp_6-31g(d).gjf (generated)

052941386.b3lyp_6-31g(d).firefly.inp (generated)

052941386.b3lyp_6-31g(d).smash.inp (generated)

052941386.b3lyp_6-31g(d).nwchem.inp (generated) 052941386.b3lyp_6-31g(d).log.xz 052941386.td-b3lyp_6-31g+(d).inp 052941386.td-b3lyp_6-31g+(d).log.xz

052941386.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941386.td-b3lyp_6-31+g(d).gjf (generated)

052941386.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941386.mol 052941386.PUBCHEM 052941386.mol (via Jmol)
052941387.b3lyp_6-31g(d).inp

052941387.b3lyp_6-31g(d).qchem.inp (generated)

052941387.b3lyp_6-31g(d).gjf (generated)

052941387.b3lyp_6-31g(d).firefly.inp (generated)

052941387.b3lyp_6-31g(d).smash.inp (generated)

052941387.b3lyp_6-31g(d).nwchem.inp (generated) 052941387.b3lyp_6-31g(d).log.xz 052941387.td-b3lyp_6-31g+(d).inp 052941387.td-b3lyp_6-31g+(d).log.xz

052941387.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941387.td-b3lyp_6-31+g(d).gjf (generated)

052941387.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941387.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941387.mol 052941387.PUBCHEM 052941387.mol (via Jmol)
052941485.b3lyp_6-31g(d).inp

052941485.b3lyp_6-31g(d).qchem.inp (generated)

052941485.b3lyp_6-31g(d).gjf (generated)

052941485.b3lyp_6-31g(d).firefly.inp (generated)

052941485.b3lyp_6-31g(d).smash.inp (generated)

052941485.b3lyp_6-31g(d).nwchem.inp (generated) 052941485.b3lyp_6-31g(d).log.xz 052941485.td-b3lyp_6-31g+(d).inp 052941485.td-b3lyp_6-31g+(d).log.xz

052941485.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941485.td-b3lyp_6-31+g(d).gjf (generated)

052941485.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941485.mol 052941485.PUBCHEM 052941485.mol (via Jmol)
052941611.b3lyp_6-31g(d).inp

052941611.b3lyp_6-31g(d).qchem.inp (generated)

052941611.b3lyp_6-31g(d).gjf (generated)

052941611.b3lyp_6-31g(d).firefly.inp (generated)

052941611.b3lyp_6-31g(d).smash.inp (generated)

052941611.b3lyp_6-31g(d).nwchem.inp (generated) 052941611.b3lyp_6-31g(d).log.xz 052941611.td-b3lyp_6-31g+(d).inp 052941611.td-b3lyp_6-31g+(d).log.xz

052941611.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941611.td-b3lyp_6-31+g(d).gjf (generated)

052941611.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941611.mol 052941611.PUBCHEM 052941611.mol (via Jmol)
052941702.b3lyp_6-31g(d).inp

052941702.b3lyp_6-31g(d).qchem.inp (generated)

052941702.b3lyp_6-31g(d).gjf (generated)

052941702.b3lyp_6-31g(d).firefly.inp (generated)

052941702.b3lyp_6-31g(d).smash.inp (generated)

052941702.b3lyp_6-31g(d).nwchem.inp (generated) 052941702.b3lyp_6-31g(d).log.xz 052941702.td-b3lyp_6-31g+(d).inp 052941702.td-b3lyp_6-31g+(d).log.xz

052941702.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941702.td-b3lyp_6-31+g(d).gjf (generated)

052941702.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941702.mol 052941702.PUBCHEM 052941702.mol (via Jmol)
052941768.b3lyp_6-31g(d).inp

052941768.b3lyp_6-31g(d).qchem.inp (generated)

052941768.b3lyp_6-31g(d).gjf (generated)

052941768.b3lyp_6-31g(d).firefly.inp (generated)

052941768.b3lyp_6-31g(d).smash.inp (generated)

052941768.b3lyp_6-31g(d).nwchem.inp (generated) 052941768.b3lyp_6-31g(d).log.xz 052941768.td-b3lyp_6-31g+(d).inp 052941768.td-b3lyp_6-31g+(d).log.xz

052941768.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941768.td-b3lyp_6-31+g(d).gjf (generated)

052941768.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941768.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941768.mol 052941768.PUBCHEM 052941768.mol (via Jmol)
052941769.b3lyp_6-31g(d).inp

052941769.b3lyp_6-31g(d).qchem.inp (generated)

052941769.b3lyp_6-31g(d).gjf (generated)

052941769.b3lyp_6-31g(d).firefly.inp (generated)

052941769.b3lyp_6-31g(d).smash.inp (generated)

052941769.b3lyp_6-31g(d).nwchem.inp (generated) 052941769.b3lyp_6-31g(d).log.xz 052941769.td-b3lyp_6-31g+(d).inp 052941769.td-b3lyp_6-31g+(d).log.xz

052941769.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941769.td-b3lyp_6-31+g(d).gjf (generated)

052941769.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941769.mol 052941769.PUBCHEM 052941769.mol (via Jmol)
052941816.b3lyp_6-31g(d).inp

052941816.b3lyp_6-31g(d).qchem.inp (generated)

052941816.b3lyp_6-31g(d).gjf (generated)

052941816.b3lyp_6-31g(d).firefly.inp (generated)

052941816.b3lyp_6-31g(d).smash.inp (generated)

052941816.b3lyp_6-31g(d).nwchem.inp (generated) 052941816.b3lyp_6-31g(d).log.xz 052941816.td-b3lyp_6-31g+(d).inp 052941816.td-b3lyp_6-31g+(d).log.xz

052941816.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941816.td-b3lyp_6-31+g(d).gjf (generated)

052941816.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941816.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941816.mol 052941816.PUBCHEM 052941816.mol (via Jmol)
052941965.b3lyp_6-31g(d).inp

052941965.b3lyp_6-31g(d).qchem.inp (generated)

052941965.b3lyp_6-31g(d).gjf (generated)

052941965.b3lyp_6-31g(d).firefly.inp (generated)

052941965.b3lyp_6-31g(d).smash.inp (generated)

052941965.b3lyp_6-31g(d).nwchem.inp (generated) 052941965.b3lyp_6-31g(d).log.xz 052941965.td-b3lyp_6-31g+(d).inp 052941965.td-b3lyp_6-31g+(d).log.xz

052941965.td-b3lyp_6-31+g(d).qchem.inp (generated)

052941965.td-b3lyp_6-31+g(d).gjf (generated)

052941965.td-b3lyp_6-31+g(d).firefly.inp (generated)

052941965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052941965.mol 052941965.PUBCHEM 052941965.mol (via Jmol)
052942037.b3lyp_6-31g(d).inp

052942037.b3lyp_6-31g(d).qchem.inp (generated)

052942037.b3lyp_6-31g(d).gjf (generated)

052942037.b3lyp_6-31g(d).firefly.inp (generated)

052942037.b3lyp_6-31g(d).smash.inp (generated)

052942037.b3lyp_6-31g(d).nwchem.inp (generated) 052942037.b3lyp_6-31g(d).log.xz 052942037.td-b3lyp_6-31g+(d).inp 052942037.td-b3lyp_6-31g+(d).log.xz

052942037.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942037.td-b3lyp_6-31+g(d).gjf (generated)

052942037.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942037.mol 052942037.PUBCHEM 052942037.mol (via Jmol)
052942294.b3lyp_6-31g(d).inp

052942294.b3lyp_6-31g(d).qchem.inp (generated)

052942294.b3lyp_6-31g(d).gjf (generated)

052942294.b3lyp_6-31g(d).firefly.inp (generated)

052942294.b3lyp_6-31g(d).smash.inp (generated)

052942294.b3lyp_6-31g(d).nwchem.inp (generated) 052942294.b3lyp_6-31g(d).log.xz 052942294.td-b3lyp_6-31g+(d).inp 052942294.td-b3lyp_6-31g+(d).log.xz

052942294.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942294.td-b3lyp_6-31+g(d).gjf (generated)

052942294.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942294.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942294.mol 052942294.PUBCHEM 052942294.mol (via Jmol)
052942323.b3lyp_6-31g(d).inp

052942323.b3lyp_6-31g(d).qchem.inp (generated)

052942323.b3lyp_6-31g(d).gjf (generated)

052942323.b3lyp_6-31g(d).firefly.inp (generated)

052942323.b3lyp_6-31g(d).smash.inp (generated)

052942323.b3lyp_6-31g(d).nwchem.inp (generated) 052942323.b3lyp_6-31g(d).log.xz 052942323.td-b3lyp_6-31g+(d).inp 052942323.td-b3lyp_6-31g+(d).log.xz

052942323.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942323.td-b3lyp_6-31+g(d).gjf (generated)

052942323.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942323.mol 052942323.PUBCHEM 052942323.mol (via Jmol)
052942389.b3lyp_6-31g(d).inp

052942389.b3lyp_6-31g(d).qchem.inp (generated)

052942389.b3lyp_6-31g(d).gjf (generated)

052942389.b3lyp_6-31g(d).firefly.inp (generated)

052942389.b3lyp_6-31g(d).smash.inp (generated)

052942389.b3lyp_6-31g(d).nwchem.inp (generated) 052942389.b3lyp_6-31g(d).log.xz 052942389.mol 052942389.PUBCHEM 052942389.mol (via Jmol)
052942418.b3lyp_6-31g(d).inp

052942418.b3lyp_6-31g(d).qchem.inp (generated)

052942418.b3lyp_6-31g(d).gjf (generated)

052942418.b3lyp_6-31g(d).firefly.inp (generated)

052942418.b3lyp_6-31g(d).smash.inp (generated)

052942418.b3lyp_6-31g(d).nwchem.inp (generated) 052942418.b3lyp_6-31g(d).log.xz 052942418.td-b3lyp_6-31g+(d).inp 052942418.td-b3lyp_6-31g+(d).log.xz

052942418.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942418.td-b3lyp_6-31+g(d).gjf (generated)

052942418.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942418.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942418.mol 052942418.PUBCHEM 052942418.mol (via Jmol)
052942719.b3lyp_6-31g(d).inp

052942719.b3lyp_6-31g(d).qchem.inp (generated)

052942719.b3lyp_6-31g(d).gjf (generated)

052942719.b3lyp_6-31g(d).firefly.inp (generated)

052942719.b3lyp_6-31g(d).smash.inp (generated)

052942719.b3lyp_6-31g(d).nwchem.inp (generated) 052942719.b3lyp_6-31g(d).log.xz 052942719.td-b3lyp_6-31g+(d).inp 052942719.td-b3lyp_6-31g+(d).log.xz

052942719.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942719.td-b3lyp_6-31+g(d).gjf (generated)

052942719.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942719.mol 052942719.PUBCHEM 052942719.mol (via Jmol)
052942724.b3lyp_6-31g(d).inp

052942724.b3lyp_6-31g(d).qchem.inp (generated)

052942724.b3lyp_6-31g(d).gjf (generated)

052942724.b3lyp_6-31g(d).firefly.inp (generated)

052942724.b3lyp_6-31g(d).smash.inp (generated)

052942724.b3lyp_6-31g(d).nwchem.inp (generated) 052942724.b3lyp_6-31g(d).log.xz 052942724.td-b3lyp_6-31g+(d).inp 052942724.td-b3lyp_6-31g+(d).log.xz

052942724.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942724.td-b3lyp_6-31+g(d).gjf (generated)

052942724.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942724.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942724.mol 052942724.PUBCHEM 052942724.mol (via Jmol)
052942802.b3lyp_6-31g(d).inp

052942802.b3lyp_6-31g(d).qchem.inp (generated)

052942802.b3lyp_6-31g(d).gjf (generated)

052942802.b3lyp_6-31g(d).firefly.inp (generated)

052942802.b3lyp_6-31g(d).smash.inp (generated)

052942802.b3lyp_6-31g(d).nwchem.inp (generated) 052942802.b3lyp_6-31g(d).log.xz 052942802.td-b3lyp_6-31g+(d).inp 052942802.td-b3lyp_6-31g+(d).log.xz

052942802.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942802.td-b3lyp_6-31+g(d).gjf (generated)

052942802.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942802.mol 052942802.PUBCHEM 052942802.mol (via Jmol)
052942966.b3lyp_6-31g(d).inp

052942966.b3lyp_6-31g(d).qchem.inp (generated)

052942966.b3lyp_6-31g(d).gjf (generated)

052942966.b3lyp_6-31g(d).firefly.inp (generated)

052942966.b3lyp_6-31g(d).smash.inp (generated)

052942966.b3lyp_6-31g(d).nwchem.inp (generated) 052942966.b3lyp_6-31g(d).log.xz 052942966.td-b3lyp_6-31g+(d).inp 052942966.td-b3lyp_6-31g+(d).log.xz

052942966.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942966.td-b3lyp_6-31+g(d).gjf (generated)

052942966.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942966.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942966.mol 052942966.PUBCHEM 052942966.mol (via Jmol)
052942975.b3lyp_6-31g(d).inp

052942975.b3lyp_6-31g(d).qchem.inp (generated)

052942975.b3lyp_6-31g(d).gjf (generated)

052942975.b3lyp_6-31g(d).firefly.inp (generated)

052942975.b3lyp_6-31g(d).smash.inp (generated)

052942975.b3lyp_6-31g(d).nwchem.inp (generated) 052942975.b3lyp_6-31g(d).log.xz 052942975.td-b3lyp_6-31g+(d).inp 052942975.td-b3lyp_6-31g+(d).log.xz

052942975.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942975.td-b3lyp_6-31+g(d).gjf (generated)

052942975.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942975.mol 052942975.PUBCHEM 052942975.mol (via Jmol)
052942976.b3lyp_6-31g(d).inp

052942976.b3lyp_6-31g(d).qchem.inp (generated)

052942976.b3lyp_6-31g(d).gjf (generated)

052942976.b3lyp_6-31g(d).firefly.inp (generated)

052942976.b3lyp_6-31g(d).smash.inp (generated)

052942976.b3lyp_6-31g(d).nwchem.inp (generated) 052942976.b3lyp_6-31g(d).log.xz 052942976.td-b3lyp_6-31g+(d).inp 052942976.td-b3lyp_6-31g+(d).log.xz

052942976.td-b3lyp_6-31+g(d).qchem.inp (generated)

052942976.td-b3lyp_6-31+g(d).gjf (generated)

052942976.td-b3lyp_6-31+g(d).firefly.inp (generated)

052942976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052942976.mol 052942976.PUBCHEM 052942976.mol (via Jmol)
052943041.b3lyp_6-31g(d).inp

052943041.b3lyp_6-31g(d).qchem.inp (generated)

052943041.b3lyp_6-31g(d).gjf (generated)

052943041.b3lyp_6-31g(d).firefly.inp (generated)

052943041.b3lyp_6-31g(d).smash.inp (generated)

052943041.b3lyp_6-31g(d).nwchem.inp (generated) 052943041.b3lyp_6-31g(d).log.xz 052943041.td-b3lyp_6-31g+(d).inp 052943041.td-b3lyp_6-31g+(d).log.xz

052943041.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943041.td-b3lyp_6-31+g(d).gjf (generated)

052943041.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943041.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943041.mol 052943041.PUBCHEM 052943041.mol (via Jmol)
052943043.b3lyp_6-31g(d).inp

052943043.b3lyp_6-31g(d).qchem.inp (generated)

052943043.b3lyp_6-31g(d).gjf (generated)

052943043.b3lyp_6-31g(d).firefly.inp (generated)

052943043.b3lyp_6-31g(d).smash.inp (generated)

052943043.b3lyp_6-31g(d).nwchem.inp (generated) 052943043.b3lyp_6-31g(d).log.xz 052943043.td-b3lyp_6-31g+(d).inp 052943043.td-b3lyp_6-31g+(d).log.xz

052943043.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943043.td-b3lyp_6-31+g(d).gjf (generated)

052943043.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943043.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943043.mol 052943043.PUBCHEM 052943043.mol (via Jmol)
052943048.b3lyp_6-31g(d).inp

052943048.b3lyp_6-31g(d).qchem.inp (generated)

052943048.b3lyp_6-31g(d).gjf (generated)

052943048.b3lyp_6-31g(d).firefly.inp (generated)

052943048.b3lyp_6-31g(d).smash.inp (generated)

052943048.b3lyp_6-31g(d).nwchem.inp (generated) 052943048.b3lyp_6-31g(d).log.xz 052943048.td-b3lyp_6-31g+(d).inp 052943048.td-b3lyp_6-31g+(d).log.xz

052943048.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943048.td-b3lyp_6-31+g(d).gjf (generated)

052943048.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943048.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943048.mol 052943048.PUBCHEM 052943048.mol (via Jmol)
052943064.b3lyp_6-31g(d).inp

052943064.b3lyp_6-31g(d).qchem.inp (generated)

052943064.b3lyp_6-31g(d).gjf (generated)

052943064.b3lyp_6-31g(d).firefly.inp (generated)

052943064.b3lyp_6-31g(d).smash.inp (generated)

052943064.b3lyp_6-31g(d).nwchem.inp (generated) 052943064.b3lyp_6-31g(d).log.xz 052943064.td-b3lyp_6-31g+(d).inp 052943064.td-b3lyp_6-31g+(d).log.xz

052943064.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943064.td-b3lyp_6-31+g(d).gjf (generated)

052943064.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943064.mol 052943064.PUBCHEM 052943064.mol (via Jmol)
052943158.b3lyp_6-31g(d).inp

052943158.b3lyp_6-31g(d).qchem.inp (generated)

052943158.b3lyp_6-31g(d).gjf (generated)

052943158.b3lyp_6-31g(d).firefly.inp (generated)

052943158.b3lyp_6-31g(d).smash.inp (generated)

052943158.b3lyp_6-31g(d).nwchem.inp (generated) 052943158.b3lyp_6-31g(d).log.xz 052943158.mol 052943158.PUBCHEM 052943158.mol (via Jmol)
052943164.b3lyp_6-31g(d).inp

052943164.b3lyp_6-31g(d).qchem.inp (generated)

052943164.b3lyp_6-31g(d).gjf (generated)

052943164.b3lyp_6-31g(d).firefly.inp (generated)

052943164.b3lyp_6-31g(d).smash.inp (generated)

052943164.b3lyp_6-31g(d).nwchem.inp (generated) 052943164.b3lyp_6-31g(d).log.xz 052943164.td-b3lyp_6-31g+(d).inp 052943164.td-b3lyp_6-31g+(d).log.xz

052943164.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943164.td-b3lyp_6-31+g(d).gjf (generated)

052943164.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943164.mol 052943164.PUBCHEM 052943164.mol (via Jmol)
052943237.b3lyp_6-31g(d).inp

052943237.b3lyp_6-31g(d).qchem.inp (generated)

052943237.b3lyp_6-31g(d).gjf (generated)

052943237.b3lyp_6-31g(d).firefly.inp (generated)

052943237.b3lyp_6-31g(d).smash.inp (generated)

052943237.b3lyp_6-31g(d).nwchem.inp (generated) 052943237.b3lyp_6-31g(d).log.xz 052943237.td-b3lyp_6-31g+(d).inp 052943237.td-b3lyp_6-31g+(d).log.xz

052943237.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943237.td-b3lyp_6-31+g(d).gjf (generated)

052943237.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943237.mol 052943237.PUBCHEM 052943237.mol (via Jmol)
052943526.b3lyp_6-31g(d).inp

052943526.b3lyp_6-31g(d).qchem.inp (generated)

052943526.b3lyp_6-31g(d).gjf (generated)

052943526.b3lyp_6-31g(d).firefly.inp (generated)

052943526.b3lyp_6-31g(d).smash.inp (generated)

052943526.b3lyp_6-31g(d).nwchem.inp (generated) 052943526.b3lyp_6-31g(d).log.xz 052943526.td-b3lyp_6-31g+(d).inp 052943526.td-b3lyp_6-31g+(d).log.xz

052943526.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943526.td-b3lyp_6-31+g(d).gjf (generated)

052943526.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943526.mol 052943526.PUBCHEM 052943526.mol (via Jmol)
052943554.b3lyp_6-31g(d).inp

052943554.b3lyp_6-31g(d).qchem.inp (generated)

052943554.b3lyp_6-31g(d).gjf (generated)

052943554.b3lyp_6-31g(d).firefly.inp (generated)

052943554.b3lyp_6-31g(d).smash.inp (generated)

052943554.b3lyp_6-31g(d).nwchem.inp (generated) 052943554.b3lyp_6-31g(d).log.xz 052943554.mol 052943554.PUBCHEM 052943554.mol (via Jmol)
052943736.b3lyp_6-31g(d).inp

052943736.b3lyp_6-31g(d).qchem.inp (generated)

052943736.b3lyp_6-31g(d).gjf (generated)

052943736.b3lyp_6-31g(d).firefly.inp (generated)

052943736.b3lyp_6-31g(d).smash.inp (generated)

052943736.b3lyp_6-31g(d).nwchem.inp (generated) 052943736.b3lyp_6-31g(d).log.xz 052943736.td-b3lyp_6-31g+(d).inp 052943736.td-b3lyp_6-31g+(d).log.xz

052943736.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943736.td-b3lyp_6-31+g(d).gjf (generated)

052943736.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943736.mol 052943736.PUBCHEM 052943736.mol (via Jmol)
052943738.b3lyp_6-31g(d).inp

052943738.b3lyp_6-31g(d).qchem.inp (generated)

052943738.b3lyp_6-31g(d).gjf (generated)

052943738.b3lyp_6-31g(d).firefly.inp (generated)

052943738.b3lyp_6-31g(d).smash.inp (generated)

052943738.b3lyp_6-31g(d).nwchem.inp (generated) 052943738.b3lyp_6-31g(d).log.xz 052943738.td-b3lyp_6-31g+(d).inp 052943738.td-b3lyp_6-31g+(d).log.xz

052943738.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943738.td-b3lyp_6-31+g(d).gjf (generated)

052943738.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943738.mol 052943738.PUBCHEM 052943738.mol (via Jmol)
052943739.b3lyp_6-31g(d).inp

052943739.b3lyp_6-31g(d).qchem.inp (generated)

052943739.b3lyp_6-31g(d).gjf (generated)

052943739.b3lyp_6-31g(d).firefly.inp (generated)

052943739.b3lyp_6-31g(d).smash.inp (generated)

052943739.b3lyp_6-31g(d).nwchem.inp (generated) 052943739.b3lyp_6-31g(d).log.xz 052943739.td-b3lyp_6-31g+(d).inp 052943739.td-b3lyp_6-31g+(d).log.xz

052943739.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943739.td-b3lyp_6-31+g(d).gjf (generated)

052943739.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943739.mol 052943739.PUBCHEM 052943739.mol (via Jmol)
052943795.b3lyp_6-31g(d).inp

052943795.b3lyp_6-31g(d).qchem.inp (generated)

052943795.b3lyp_6-31g(d).gjf (generated)

052943795.b3lyp_6-31g(d).firefly.inp (generated)

052943795.b3lyp_6-31g(d).smash.inp (generated)

052943795.b3lyp_6-31g(d).nwchem.inp (generated) 052943795.b3lyp_6-31g(d).log.xz 052943795.td-b3lyp_6-31g+(d).inp 052943795.td-b3lyp_6-31g+(d).log.xz

052943795.td-b3lyp_6-31+g(d).qchem.inp (generated)

052943795.td-b3lyp_6-31+g(d).gjf (generated)

052943795.td-b3lyp_6-31+g(d).firefly.inp (generated)

052943795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052943795.mol 052943795.PUBCHEM 052943795.mol (via Jmol)
052943996.b3lyp_6-31g(d).inp

052943996.b3lyp_6-31g(d).qchem.inp (generated)

052943996.b3lyp_6-31g(d).gjf (generated)

052943996.b3lyp_6-31g(d).firefly.inp (generated)

052943996.b3lyp_6-31g(d).smash.inp (generated)

052943996.b3lyp_6-31g(d).nwchem.inp (generated) 052943996.b3lyp_6-31g(d).log.xz 052943996.mol 052943996.PUBCHEM 052943996.mol (via Jmol)
052944004.b3lyp_6-31g(d).inp

052944004.b3lyp_6-31g(d).qchem.inp (generated)

052944004.b3lyp_6-31g(d).gjf (generated)

052944004.b3lyp_6-31g(d).firefly.inp (generated)

052944004.b3lyp_6-31g(d).smash.inp (generated)

052944004.b3lyp_6-31g(d).nwchem.inp (generated) 052944004.b3lyp_6-31g(d).log.xz 052944004.td-b3lyp_6-31g+(d).inp 052944004.td-b3lyp_6-31g+(d).log.xz

052944004.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944004.td-b3lyp_6-31+g(d).gjf (generated)

052944004.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944004.mol 052944004.PUBCHEM 052944004.mol (via Jmol)
052944005.b3lyp_6-31g(d).inp

052944005.b3lyp_6-31g(d).qchem.inp (generated)

052944005.b3lyp_6-31g(d).gjf (generated)

052944005.b3lyp_6-31g(d).firefly.inp (generated)

052944005.b3lyp_6-31g(d).smash.inp (generated)

052944005.b3lyp_6-31g(d).nwchem.inp (generated) 052944005.b3lyp_6-31g(d).log.xz 052944005.td-b3lyp_6-31g+(d).inp 052944005.td-b3lyp_6-31g+(d).log.xz

052944005.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944005.td-b3lyp_6-31+g(d).gjf (generated)

052944005.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944005.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944005.mol 052944005.PUBCHEM 052944005.mol (via Jmol)
052944081.b3lyp_6-31g(d).inp

052944081.b3lyp_6-31g(d).qchem.inp (generated)

052944081.b3lyp_6-31g(d).gjf (generated)

052944081.b3lyp_6-31g(d).firefly.inp (generated)

052944081.b3lyp_6-31g(d).smash.inp (generated)

052944081.b3lyp_6-31g(d).nwchem.inp (generated) 052944081.b3lyp_6-31g(d).log.xz 052944081.mol 052944081.PUBCHEM 052944081.mol (via Jmol)
052944183.b3lyp_6-31g(d).inp

052944183.b3lyp_6-31g(d).qchem.inp (generated)

052944183.b3lyp_6-31g(d).gjf (generated)

052944183.b3lyp_6-31g(d).firefly.inp (generated)

052944183.b3lyp_6-31g(d).smash.inp (generated)

052944183.b3lyp_6-31g(d).nwchem.inp (generated) 052944183.b3lyp_6-31g(d).log.xz 052944183.td-b3lyp_6-31g+(d).inp 052944183.td-b3lyp_6-31g+(d).log.xz

052944183.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944183.td-b3lyp_6-31+g(d).gjf (generated)

052944183.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944183.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944183.mol 052944183.PUBCHEM 052944183.mol (via Jmol)
052944219.b3lyp_6-31g(d).inp

052944219.b3lyp_6-31g(d).qchem.inp (generated)

052944219.b3lyp_6-31g(d).gjf (generated)

052944219.b3lyp_6-31g(d).firefly.inp (generated)

052944219.b3lyp_6-31g(d).smash.inp (generated)

052944219.b3lyp_6-31g(d).nwchem.inp (generated) 052944219.b3lyp_6-31g(d).log.xz 052944219.td-b3lyp_6-31g+(d).inp 052944219.td-b3lyp_6-31g+(d).log.xz

052944219.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944219.td-b3lyp_6-31+g(d).gjf (generated)

052944219.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944219.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944219.mol 052944219.PUBCHEM 052944219.mol (via Jmol)
052944245.b3lyp_6-31g(d).inp

052944245.b3lyp_6-31g(d).qchem.inp (generated)

052944245.b3lyp_6-31g(d).gjf (generated)

052944245.b3lyp_6-31g(d).firefly.inp (generated)

052944245.b3lyp_6-31g(d).smash.inp (generated)

052944245.b3lyp_6-31g(d).nwchem.inp (generated) 052944245.b3lyp_6-31g(d).log.xz 052944245.td-b3lyp_6-31g+(d).inp 052944245.td-b3lyp_6-31g+(d).log.xz

052944245.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944245.td-b3lyp_6-31+g(d).gjf (generated)

052944245.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944245.mol 052944245.PUBCHEM 052944245.mol (via Jmol)
052944249.b3lyp_6-31g(d).inp

052944249.b3lyp_6-31g(d).qchem.inp (generated)

052944249.b3lyp_6-31g(d).gjf (generated)

052944249.b3lyp_6-31g(d).firefly.inp (generated)

052944249.b3lyp_6-31g(d).smash.inp (generated)

052944249.b3lyp_6-31g(d).nwchem.inp (generated) 052944249.b3lyp_6-31g(d).log.xz 052944249.td-b3lyp_6-31g+(d).inp 052944249.td-b3lyp_6-31g+(d).log.xz

052944249.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944249.td-b3lyp_6-31+g(d).gjf (generated)

052944249.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944249.mol 052944249.PUBCHEM 052944249.mol (via Jmol)
052944251.b3lyp_6-31g(d).inp

052944251.b3lyp_6-31g(d).qchem.inp (generated)

052944251.b3lyp_6-31g(d).gjf (generated)

052944251.b3lyp_6-31g(d).firefly.inp (generated)

052944251.b3lyp_6-31g(d).smash.inp (generated)

052944251.b3lyp_6-31g(d).nwchem.inp (generated) 052944251.b3lyp_6-31g(d).log.xz 052944251.td-b3lyp_6-31g+(d).inp 052944251.td-b3lyp_6-31g+(d).log.xz

052944251.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944251.td-b3lyp_6-31+g(d).gjf (generated)

052944251.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944251.mol 052944251.PUBCHEM 052944251.mol (via Jmol)
052944340.b3lyp_6-31g(d).inp

052944340.b3lyp_6-31g(d).qchem.inp (generated)

052944340.b3lyp_6-31g(d).gjf (generated)

052944340.b3lyp_6-31g(d).firefly.inp (generated)

052944340.b3lyp_6-31g(d).smash.inp (generated)

052944340.b3lyp_6-31g(d).nwchem.inp (generated) 052944340.b3lyp_6-31g(d).log.xz 052944340.td-b3lyp_6-31g+(d).inp 052944340.td-b3lyp_6-31g+(d).log.xz

052944340.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944340.td-b3lyp_6-31+g(d).gjf (generated)

052944340.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944340.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944340.mol 052944340.PUBCHEM 052944340.mol (via Jmol)
052944377.b3lyp_6-31g(d).inp

052944377.b3lyp_6-31g(d).qchem.inp (generated)

052944377.b3lyp_6-31g(d).gjf (generated)

052944377.b3lyp_6-31g(d).firefly.inp (generated)

052944377.b3lyp_6-31g(d).smash.inp (generated)

052944377.b3lyp_6-31g(d).nwchem.inp (generated) 052944377.b3lyp_6-31g(d).log.xz 052944377.mol 052944377.PUBCHEM 052944377.mol (via Jmol)
052944544.b3lyp_6-31g(d).inp

052944544.b3lyp_6-31g(d).qchem.inp (generated)

052944544.b3lyp_6-31g(d).gjf (generated)

052944544.b3lyp_6-31g(d).firefly.inp (generated)

052944544.b3lyp_6-31g(d).smash.inp (generated)

052944544.b3lyp_6-31g(d).nwchem.inp (generated) 052944544.b3lyp_6-31g(d).log.xz 052944544.td-b3lyp_6-31g+(d).inp 052944544.td-b3lyp_6-31g+(d).log.xz

052944544.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944544.td-b3lyp_6-31+g(d).gjf (generated)

052944544.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944544.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944544.mol 052944544.PUBCHEM 052944544.mol (via Jmol)
052944781.b3lyp_6-31g(d).inp

052944781.b3lyp_6-31g(d).qchem.inp (generated)

052944781.b3lyp_6-31g(d).gjf (generated)

052944781.b3lyp_6-31g(d).firefly.inp (generated)

052944781.b3lyp_6-31g(d).smash.inp (generated)

052944781.b3lyp_6-31g(d).nwchem.inp (generated) 052944781.b3lyp_6-31g(d).log.xz 052944781.td-b3lyp_6-31g+(d).inp 052944781.td-b3lyp_6-31g+(d).log.xz

052944781.td-b3lyp_6-31+g(d).qchem.inp (generated)

052944781.td-b3lyp_6-31+g(d).gjf (generated)

052944781.td-b3lyp_6-31+g(d).firefly.inp (generated)

052944781.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052944781.mol 052944781.PUBCHEM 052944781.mol (via Jmol)
052945044.b3lyp_6-31g(d).inp

052945044.b3lyp_6-31g(d).qchem.inp (generated)

052945044.b3lyp_6-31g(d).gjf (generated)

052945044.b3lyp_6-31g(d).firefly.inp (generated)

052945044.b3lyp_6-31g(d).smash.inp (generated)

052945044.b3lyp_6-31g(d).nwchem.inp (generated) 052945044.b3lyp_6-31g(d).log.xz 052945044.td-b3lyp_6-31g+(d).inp 052945044.td-b3lyp_6-31g+(d).log.xz

052945044.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945044.td-b3lyp_6-31+g(d).gjf (generated)

052945044.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945044.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945044.mol 052945044.PUBCHEM 052945044.mol (via Jmol)
052945244.b3lyp_6-31g(d).inp

052945244.b3lyp_6-31g(d).qchem.inp (generated)

052945244.b3lyp_6-31g(d).gjf (generated)

052945244.b3lyp_6-31g(d).firefly.inp (generated)

052945244.b3lyp_6-31g(d).smash.inp (generated)

052945244.b3lyp_6-31g(d).nwchem.inp (generated) 052945244.b3lyp_6-31g(d).log.xz 052945244.td-b3lyp_6-31g+(d).inp 052945244.td-b3lyp_6-31g+(d).log.xz

052945244.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945244.td-b3lyp_6-31+g(d).gjf (generated)

052945244.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945244.mol 052945244.PUBCHEM 052945244.mol (via Jmol)
052945325.b3lyp_6-31g(d).inp

052945325.b3lyp_6-31g(d).qchem.inp (generated)

052945325.b3lyp_6-31g(d).gjf (generated)

052945325.b3lyp_6-31g(d).firefly.inp (generated)

052945325.b3lyp_6-31g(d).smash.inp (generated)

052945325.b3lyp_6-31g(d).nwchem.inp (generated) 052945325.b3lyp_6-31g(d).log.xz 052945325.td-b3lyp_6-31g+(d).inp 052945325.td-b3lyp_6-31g+(d).log.xz

052945325.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945325.td-b3lyp_6-31+g(d).gjf (generated)

052945325.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945325.mol 052945325.PUBCHEM 052945325.mol (via Jmol)
052945455.b3lyp_6-31g(d).inp

052945455.b3lyp_6-31g(d).qchem.inp (generated)

052945455.b3lyp_6-31g(d).gjf (generated)

052945455.b3lyp_6-31g(d).firefly.inp (generated)

052945455.b3lyp_6-31g(d).smash.inp (generated)

052945455.b3lyp_6-31g(d).nwchem.inp (generated) 052945455.b3lyp_6-31g(d).log.xz 052945455.td-b3lyp_6-31g+(d).inp 052945455.td-b3lyp_6-31g+(d).log.xz

052945455.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945455.td-b3lyp_6-31+g(d).gjf (generated)

052945455.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945455.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945455.mol 052945455.PUBCHEM 052945455.mol (via Jmol)
052945459.b3lyp_6-31g(d).inp

052945459.b3lyp_6-31g(d).qchem.inp (generated)

052945459.b3lyp_6-31g(d).gjf (generated)

052945459.b3lyp_6-31g(d).firefly.inp (generated)

052945459.b3lyp_6-31g(d).smash.inp (generated)

052945459.b3lyp_6-31g(d).nwchem.inp (generated) 052945459.b3lyp_6-31g(d).log.xz 052945459.td-b3lyp_6-31g+(d).inp 052945459.td-b3lyp_6-31g+(d).log.xz

052945459.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945459.td-b3lyp_6-31+g(d).gjf (generated)

052945459.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945459.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945459.mol 052945459.PUBCHEM 052945459.mol (via Jmol)
052945483.b3lyp_6-31g(d).inp

052945483.b3lyp_6-31g(d).qchem.inp (generated)

052945483.b3lyp_6-31g(d).gjf (generated)

052945483.b3lyp_6-31g(d).firefly.inp (generated)

052945483.b3lyp_6-31g(d).smash.inp (generated)

052945483.b3lyp_6-31g(d).nwchem.inp (generated) 052945483.b3lyp_6-31g(d).log.xz 052945483.td-b3lyp_6-31g+(d).inp 052945483.td-b3lyp_6-31g+(d).log.xz

052945483.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945483.td-b3lyp_6-31+g(d).gjf (generated)

052945483.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945483.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945483.mol 052945483.PUBCHEM 052945483.mol (via Jmol)
052945578.b3lyp_6-31g(d).inp

052945578.b3lyp_6-31g(d).qchem.inp (generated)

052945578.b3lyp_6-31g(d).gjf (generated)

052945578.b3lyp_6-31g(d).firefly.inp (generated)

052945578.b3lyp_6-31g(d).smash.inp (generated)

052945578.b3lyp_6-31g(d).nwchem.inp (generated) 052945578.b3lyp_6-31g(d).log.xz 052945578.td-b3lyp_6-31g+(d).inp 052945578.td-b3lyp_6-31g+(d).log.xz

052945578.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945578.td-b3lyp_6-31+g(d).gjf (generated)

052945578.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945578.mol 052945578.PUBCHEM 052945578.mol (via Jmol)
052945684.b3lyp_6-31g(d).inp

052945684.b3lyp_6-31g(d).qchem.inp (generated)

052945684.b3lyp_6-31g(d).gjf (generated)

052945684.b3lyp_6-31g(d).firefly.inp (generated)

052945684.b3lyp_6-31g(d).smash.inp (generated)

052945684.b3lyp_6-31g(d).nwchem.inp (generated) 052945684.b3lyp_6-31g(d).log.xz 052945684.td-b3lyp_6-31g+(d).inp 052945684.td-b3lyp_6-31g+(d).log.xz

052945684.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945684.td-b3lyp_6-31+g(d).gjf (generated)

052945684.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945684.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945684.mol 052945684.PUBCHEM 052945684.mol (via Jmol)
052945868.b3lyp_6-31g(d).inp

052945868.b3lyp_6-31g(d).qchem.inp (generated)

052945868.b3lyp_6-31g(d).gjf (generated)

052945868.b3lyp_6-31g(d).firefly.inp (generated)

052945868.b3lyp_6-31g(d).smash.inp (generated)

052945868.b3lyp_6-31g(d).nwchem.inp (generated) 052945868.b3lyp_6-31g(d).log.xz 052945868.td-b3lyp_6-31g+(d).inp 052945868.td-b3lyp_6-31g+(d).log.xz

052945868.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945868.td-b3lyp_6-31+g(d).gjf (generated)

052945868.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945868.mol 052945868.PUBCHEM 052945868.mol (via Jmol)
052945992.b3lyp_6-31g(d).inp

052945992.b3lyp_6-31g(d).qchem.inp (generated)

052945992.b3lyp_6-31g(d).gjf (generated)

052945992.b3lyp_6-31g(d).firefly.inp (generated)

052945992.b3lyp_6-31g(d).smash.inp (generated)

052945992.b3lyp_6-31g(d).nwchem.inp (generated) 052945992.b3lyp_6-31g(d).log.xz 052945992.td-b3lyp_6-31g+(d).inp 052945992.td-b3lyp_6-31g+(d).log.xz

052945992.td-b3lyp_6-31+g(d).qchem.inp (generated)

052945992.td-b3lyp_6-31+g(d).gjf (generated)

052945992.td-b3lyp_6-31+g(d).firefly.inp (generated)

052945992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052945992.mol 052945992.PUBCHEM 052945992.mol (via Jmol)
052946004.b3lyp_6-31g(d).inp

052946004.b3lyp_6-31g(d).qchem.inp (generated)

052946004.b3lyp_6-31g(d).gjf (generated)

052946004.b3lyp_6-31g(d).firefly.inp (generated)

052946004.b3lyp_6-31g(d).smash.inp (generated)

052946004.b3lyp_6-31g(d).nwchem.inp (generated) 052946004.b3lyp_6-31g(d).log.xz 052946004.td-b3lyp_6-31g+(d).inp 052946004.td-b3lyp_6-31g+(d).log.xz

052946004.td-b3lyp_6-31+g(d).qchem.inp (generated)

052946004.td-b3lyp_6-31+g(d).gjf (generated)

052946004.td-b3lyp_6-31+g(d).firefly.inp (generated)

052946004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052946004.mol 052946004.PUBCHEM 052946004.mol (via Jmol)
052946663.b3lyp_6-31g(d).inp

052946663.b3lyp_6-31g(d).qchem.inp (generated)

052946663.b3lyp_6-31g(d).gjf (generated)

052946663.b3lyp_6-31g(d).firefly.inp (generated)

052946663.b3lyp_6-31g(d).smash.inp (generated)

052946663.b3lyp_6-31g(d).nwchem.inp (generated) 052946663.b3lyp_6-31g(d).log.xz 052946663.td-b3lyp_6-31g+(d).inp 052946663.td-b3lyp_6-31g+(d).log.xz

052946663.td-b3lyp_6-31+g(d).qchem.inp (generated)

052946663.td-b3lyp_6-31+g(d).gjf (generated)

052946663.td-b3lyp_6-31+g(d).firefly.inp (generated)

052946663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052946663.mol 052946663.PUBCHEM 052946663.mol (via Jmol)
052946693.b3lyp_6-31g(d).inp

052946693.b3lyp_6-31g(d).qchem.inp (generated)

052946693.b3lyp_6-31g(d).gjf (generated)

052946693.b3lyp_6-31g(d).firefly.inp (generated)

052946693.b3lyp_6-31g(d).smash.inp (generated)

052946693.b3lyp_6-31g(d).nwchem.inp (generated) 052946693.b3lyp_6-31g(d).log.xz 052946693.td-b3lyp_6-31g+(d).inp 052946693.td-b3lyp_6-31g+(d).log.xz

052946693.td-b3lyp_6-31+g(d).qchem.inp (generated)

052946693.td-b3lyp_6-31+g(d).gjf (generated)

052946693.td-b3lyp_6-31+g(d).firefly.inp (generated)

052946693.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052946693.mol 052946693.PUBCHEM 052946693.mol (via Jmol)
052946794.b3lyp_6-31g(d).inp

052946794.b3lyp_6-31g(d).qchem.inp (generated)

052946794.b3lyp_6-31g(d).gjf (generated)

052946794.b3lyp_6-31g(d).firefly.inp (generated)

052946794.b3lyp_6-31g(d).smash.inp (generated)

052946794.b3lyp_6-31g(d).nwchem.inp (generated) 052946794.b3lyp_6-31g(d).log.xz 052946794.td-b3lyp_6-31g+(d).inp 052946794.td-b3lyp_6-31g+(d).log.xz

052946794.td-b3lyp_6-31+g(d).qchem.inp (generated)

052946794.td-b3lyp_6-31+g(d).gjf (generated)

052946794.td-b3lyp_6-31+g(d).firefly.inp (generated)

052946794.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052946794.mol 052946794.PUBCHEM 052946794.mol (via Jmol)
052946806.b3lyp_6-31g(d).inp

052946806.b3lyp_6-31g(d).qchem.inp (generated)

052946806.b3lyp_6-31g(d).gjf (generated)

052946806.b3lyp_6-31g(d).firefly.inp (generated)

052946806.b3lyp_6-31g(d).smash.inp (generated)

052946806.b3lyp_6-31g(d).nwchem.inp (generated) 052946806.b3lyp_6-31g(d).log.xz 052946806.td-b3lyp_6-31g+(d).inp 052946806.td-b3lyp_6-31g+(d).log.xz

052946806.td-b3lyp_6-31+g(d).qchem.inp (generated)

052946806.td-b3lyp_6-31+g(d).gjf (generated)

052946806.td-b3lyp_6-31+g(d).firefly.inp (generated)

052946806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052946806.mol 052946806.PUBCHEM 052946806.mol (via Jmol)
052947032.b3lyp_6-31g(d).inp

052947032.b3lyp_6-31g(d).qchem.inp (generated)

052947032.b3lyp_6-31g(d).gjf (generated)

052947032.b3lyp_6-31g(d).firefly.inp (generated)

052947032.b3lyp_6-31g(d).smash.inp (generated)

052947032.b3lyp_6-31g(d).nwchem.inp (generated) 052947032.b3lyp_6-31g(d).log.xz 052947032.td-b3lyp_6-31g+(d).inp 052947032.td-b3lyp_6-31g+(d).log.xz

052947032.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947032.td-b3lyp_6-31+g(d).gjf (generated)

052947032.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947032.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947032.mol 052947032.PUBCHEM 052947032.mol (via Jmol)
052947062.b3lyp_6-31g(d).inp

052947062.b3lyp_6-31g(d).qchem.inp (generated)

052947062.b3lyp_6-31g(d).gjf (generated)

052947062.b3lyp_6-31g(d).firefly.inp (generated)

052947062.b3lyp_6-31g(d).smash.inp (generated)

052947062.b3lyp_6-31g(d).nwchem.inp (generated) 052947062.b3lyp_6-31g(d).log.xz 052947062.mol 052947062.PUBCHEM 052947062.mol (via Jmol)
052947151.b3lyp_6-31g(d).inp

052947151.b3lyp_6-31g(d).qchem.inp (generated)

052947151.b3lyp_6-31g(d).gjf (generated)

052947151.b3lyp_6-31g(d).firefly.inp (generated)

052947151.b3lyp_6-31g(d).smash.inp (generated)

052947151.b3lyp_6-31g(d).nwchem.inp (generated) 052947151.b3lyp_6-31g(d).log.xz 052947151.td-b3lyp_6-31g+(d).inp 052947151.td-b3lyp_6-31g+(d).log.xz

052947151.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947151.td-b3lyp_6-31+g(d).gjf (generated)

052947151.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947151.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947151.mol 052947151.PUBCHEM 052947151.mol (via Jmol)
052947449.b3lyp_6-31g(d).inp

052947449.b3lyp_6-31g(d).qchem.inp (generated)

052947449.b3lyp_6-31g(d).gjf (generated)

052947449.b3lyp_6-31g(d).firefly.inp (generated)

052947449.b3lyp_6-31g(d).smash.inp (generated)

052947449.b3lyp_6-31g(d).nwchem.inp (generated) 052947449.b3lyp_6-31g(d).log.xz 052947449.td-b3lyp_6-31g+(d).inp 052947449.td-b3lyp_6-31g+(d).log.xz

052947449.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947449.td-b3lyp_6-31+g(d).gjf (generated)

052947449.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947449.mol 052947449.PUBCHEM 052947449.mol (via Jmol)
052947474.b3lyp_6-31g(d).inp

052947474.b3lyp_6-31g(d).qchem.inp (generated)

052947474.b3lyp_6-31g(d).gjf (generated)

052947474.b3lyp_6-31g(d).firefly.inp (generated)

052947474.b3lyp_6-31g(d).smash.inp (generated)

052947474.b3lyp_6-31g(d).nwchem.inp (generated) 052947474.b3lyp_6-31g(d).log.xz 052947474.mol 052947474.PUBCHEM 052947474.mol (via Jmol)
052947499.b3lyp_6-31g(d).inp

052947499.b3lyp_6-31g(d).qchem.inp (generated)

052947499.b3lyp_6-31g(d).gjf (generated)

052947499.b3lyp_6-31g(d).firefly.inp (generated)

052947499.b3lyp_6-31g(d).smash.inp (generated)

052947499.b3lyp_6-31g(d).nwchem.inp (generated) 052947499.b3lyp_6-31g(d).log.xz 052947499.td-b3lyp_6-31g+(d).inp 052947499.td-b3lyp_6-31g+(d).log.xz

052947499.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947499.td-b3lyp_6-31+g(d).gjf (generated)

052947499.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947499.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947499.mol 052947499.PUBCHEM 052947499.mol (via Jmol)
052947572.b3lyp_6-31g(d).inp

052947572.b3lyp_6-31g(d).qchem.inp (generated)

052947572.b3lyp_6-31g(d).gjf (generated)

052947572.b3lyp_6-31g(d).firefly.inp (generated)

052947572.b3lyp_6-31g(d).smash.inp (generated)

052947572.b3lyp_6-31g(d).nwchem.inp (generated) 052947572.b3lyp_6-31g(d).log.xz 052947572.td-b3lyp_6-31g+(d).inp 052947572.td-b3lyp_6-31g+(d).log.xz

052947572.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947572.td-b3lyp_6-31+g(d).gjf (generated)

052947572.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947572.mol 052947572.PUBCHEM 052947572.mol (via Jmol)
052947679.b3lyp_6-31g(d).inp

052947679.b3lyp_6-31g(d).qchem.inp (generated)

052947679.b3lyp_6-31g(d).gjf (generated)

052947679.b3lyp_6-31g(d).firefly.inp (generated)

052947679.b3lyp_6-31g(d).smash.inp (generated)

052947679.b3lyp_6-31g(d).nwchem.inp (generated) 052947679.b3lyp_6-31g(d).log.xz 052947679.td-b3lyp_6-31g+(d).inp 052947679.td-b3lyp_6-31g+(d).log.xz

052947679.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947679.td-b3lyp_6-31+g(d).gjf (generated)

052947679.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947679.mol 052947679.PUBCHEM 052947679.mol (via Jmol)
052947807.b3lyp_6-31g(d).inp

052947807.b3lyp_6-31g(d).qchem.inp (generated)

052947807.b3lyp_6-31g(d).gjf (generated)

052947807.b3lyp_6-31g(d).firefly.inp (generated)

052947807.b3lyp_6-31g(d).smash.inp (generated)

052947807.b3lyp_6-31g(d).nwchem.inp (generated) 052947807.b3lyp_6-31g(d).log.xz 052947807.td-b3lyp_6-31g+(d).inp 052947807.td-b3lyp_6-31g+(d).log.xz

052947807.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947807.td-b3lyp_6-31+g(d).gjf (generated)

052947807.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947807.mol 052947807.PUBCHEM 052947807.mol (via Jmol)
052947808.b3lyp_6-31g(d).inp

052947808.b3lyp_6-31g(d).qchem.inp (generated)

052947808.b3lyp_6-31g(d).gjf (generated)

052947808.b3lyp_6-31g(d).firefly.inp (generated)

052947808.b3lyp_6-31g(d).smash.inp (generated)

052947808.b3lyp_6-31g(d).nwchem.inp (generated) 052947808.b3lyp_6-31g(d).log.xz 052947808.td-b3lyp_6-31g+(d).inp 052947808.td-b3lyp_6-31g+(d).log.xz

052947808.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947808.td-b3lyp_6-31+g(d).gjf (generated)

052947808.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947808.mol 052947808.PUBCHEM 052947808.mol (via Jmol)
052947892.b3lyp_6-31g(d).inp

052947892.b3lyp_6-31g(d).qchem.inp (generated)

052947892.b3lyp_6-31g(d).gjf (generated)

052947892.b3lyp_6-31g(d).firefly.inp (generated)

052947892.b3lyp_6-31g(d).smash.inp (generated)

052947892.b3lyp_6-31g(d).nwchem.inp (generated) 052947892.b3lyp_6-31g(d).log.xz 052947892.td-b3lyp_6-31g+(d).inp 052947892.td-b3lyp_6-31g+(d).log.xz

052947892.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947892.td-b3lyp_6-31+g(d).gjf (generated)

052947892.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947892.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947892.mol 052947892.PUBCHEM 052947892.mol (via Jmol)
052947940.b3lyp_6-31g(d).inp

052947940.b3lyp_6-31g(d).qchem.inp (generated)

052947940.b3lyp_6-31g(d).gjf (generated)

052947940.b3lyp_6-31g(d).firefly.inp (generated)

052947940.b3lyp_6-31g(d).smash.inp (generated)

052947940.b3lyp_6-31g(d).nwchem.inp (generated) 052947940.b3lyp_6-31g(d).log.xz 052947940.td-b3lyp_6-31g+(d).inp 052947940.td-b3lyp_6-31g+(d).log.xz

052947940.td-b3lyp_6-31+g(d).qchem.inp (generated)

052947940.td-b3lyp_6-31+g(d).gjf (generated)

052947940.td-b3lyp_6-31+g(d).firefly.inp (generated)

052947940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052947940.mol 052947940.PUBCHEM 052947940.mol (via Jmol)
052948040.b3lyp_6-31g(d).inp

052948040.b3lyp_6-31g(d).qchem.inp (generated)

052948040.b3lyp_6-31g(d).gjf (generated)

052948040.b3lyp_6-31g(d).firefly.inp (generated)

052948040.b3lyp_6-31g(d).smash.inp (generated)

052948040.b3lyp_6-31g(d).nwchem.inp (generated) 052948040.b3lyp_6-31g(d).log.xz 052948040.mol 052948040.PUBCHEM 052948040.mol (via Jmol)
052948092.b3lyp_6-31g(d).inp

052948092.b3lyp_6-31g(d).qchem.inp (generated)

052948092.b3lyp_6-31g(d).gjf (generated)

052948092.b3lyp_6-31g(d).firefly.inp (generated)

052948092.b3lyp_6-31g(d).smash.inp (generated)

052948092.b3lyp_6-31g(d).nwchem.inp (generated) 052948092.b3lyp_6-31g(d).log.xz 052948092.td-b3lyp_6-31g+(d).inp 052948092.td-b3lyp_6-31g+(d).log.xz

052948092.td-b3lyp_6-31+g(d).qchem.inp (generated)

052948092.td-b3lyp_6-31+g(d).gjf (generated)

052948092.td-b3lyp_6-31+g(d).firefly.inp (generated)

052948092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052948092.mol 052948092.PUBCHEM 052948092.mol (via Jmol)
052948236.b3lyp_6-31g(d).inp

052948236.b3lyp_6-31g(d).qchem.inp (generated)

052948236.b3lyp_6-31g(d).gjf (generated)

052948236.b3lyp_6-31g(d).firefly.inp (generated)

052948236.b3lyp_6-31g(d).smash.inp (generated)

052948236.b3lyp_6-31g(d).nwchem.inp (generated) 052948236.b3lyp_6-31g(d).log.xz 052948236.td-b3lyp_6-31g+(d).inp 052948236.td-b3lyp_6-31g+(d).log.xz

052948236.td-b3lyp_6-31+g(d).qchem.inp (generated)

052948236.td-b3lyp_6-31+g(d).gjf (generated)

052948236.td-b3lyp_6-31+g(d).firefly.inp (generated)

052948236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052948236.mol 052948236.PUBCHEM 052948236.mol (via Jmol)
052948479.b3lyp_6-31g(d).inp

052948479.b3lyp_6-31g(d).qchem.inp (generated)

052948479.b3lyp_6-31g(d).gjf (generated)

052948479.b3lyp_6-31g(d).firefly.inp (generated)

052948479.b3lyp_6-31g(d).smash.inp (generated)

052948479.b3lyp_6-31g(d).nwchem.inp (generated) 052948479.b3lyp_6-31g(d).log.xz 052948479.td-b3lyp_6-31g+(d).inp 052948479.td-b3lyp_6-31g+(d).log.xz

052948479.td-b3lyp_6-31+g(d).qchem.inp (generated)

052948479.td-b3lyp_6-31+g(d).gjf (generated)

052948479.td-b3lyp_6-31+g(d).firefly.inp (generated)

052948479.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052948479.mol 052948479.PUBCHEM 052948479.mol (via Jmol)
052948753.b3lyp_6-31g(d).inp

052948753.b3lyp_6-31g(d).qchem.inp (generated)

052948753.b3lyp_6-31g(d).gjf (generated)

052948753.b3lyp_6-31g(d).firefly.inp (generated)

052948753.b3lyp_6-31g(d).smash.inp (generated)

052948753.b3lyp_6-31g(d).nwchem.inp (generated) 052948753.b3lyp_6-31g(d).log.xz 052948753.td-b3lyp_6-31g+(d).inp 052948753.td-b3lyp_6-31g+(d).log.xz

052948753.td-b3lyp_6-31+g(d).qchem.inp (generated)

052948753.td-b3lyp_6-31+g(d).gjf (generated)

052948753.td-b3lyp_6-31+g(d).firefly.inp (generated)

052948753.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052948753.mol 052948753.PUBCHEM 052948753.mol (via Jmol)
052948811.b3lyp_6-31g(d).inp

052948811.b3lyp_6-31g(d).qchem.inp (generated)

052948811.b3lyp_6-31g(d).gjf (generated)

052948811.b3lyp_6-31g(d).firefly.inp (generated)

052948811.b3lyp_6-31g(d).smash.inp (generated)

052948811.b3lyp_6-31g(d).nwchem.inp (generated) 052948811.b3lyp_6-31g(d).log.xz 052948811.mol 052948811.PUBCHEM 052948811.mol (via Jmol)
052948814.b3lyp_6-31g(d).inp

052948814.b3lyp_6-31g(d).qchem.inp (generated)

052948814.b3lyp_6-31g(d).gjf (generated)

052948814.b3lyp_6-31g(d).firefly.inp (generated)

052948814.b3lyp_6-31g(d).smash.inp (generated)

052948814.b3lyp_6-31g(d).nwchem.inp (generated) 052948814.b3lyp_6-31g(d).log.xz 052948814.mol 052948814.PUBCHEM 052948814.mol (via Jmol)
052948993.b3lyp_6-31g(d).inp

052948993.b3lyp_6-31g(d).qchem.inp (generated)

052948993.b3lyp_6-31g(d).gjf (generated)

052948993.b3lyp_6-31g(d).firefly.inp (generated)

052948993.b3lyp_6-31g(d).smash.inp (generated)

052948993.b3lyp_6-31g(d).nwchem.inp (generated) 052948993.b3lyp_6-31g(d).log.xz 052948993.td-b3lyp_6-31g+(d).inp 052948993.td-b3lyp_6-31g+(d).log.xz

052948993.td-b3lyp_6-31+g(d).qchem.inp (generated)

052948993.td-b3lyp_6-31+g(d).gjf (generated)

052948993.td-b3lyp_6-31+g(d).firefly.inp (generated)

052948993.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052948993.mol 052948993.PUBCHEM 052948993.mol (via Jmol)
052949121.b3lyp_6-31g(d).inp

052949121.b3lyp_6-31g(d).qchem.inp (generated)

052949121.b3lyp_6-31g(d).gjf (generated)

052949121.b3lyp_6-31g(d).firefly.inp (generated)

052949121.b3lyp_6-31g(d).smash.inp (generated)

052949121.b3lyp_6-31g(d).nwchem.inp (generated) 052949121.b3lyp_6-31g(d).log.xz 052949121.td-b3lyp_6-31g+(d).inp 052949121.td-b3lyp_6-31g+(d).log.xz

052949121.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949121.td-b3lyp_6-31+g(d).gjf (generated)

052949121.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949121.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949121.mol 052949121.PUBCHEM 052949121.mol (via Jmol)
052949131.b3lyp_6-31g(d).inp

052949131.b3lyp_6-31g(d).qchem.inp (generated)

052949131.b3lyp_6-31g(d).gjf (generated)

052949131.b3lyp_6-31g(d).firefly.inp (generated)

052949131.b3lyp_6-31g(d).smash.inp (generated)

052949131.b3lyp_6-31g(d).nwchem.inp (generated) 052949131.b3lyp_6-31g(d).log.xz 052949131.mol 052949131.PUBCHEM 052949131.mol (via Jmol)
052949147.b3lyp_6-31g(d).inp

052949147.b3lyp_6-31g(d).qchem.inp (generated)

052949147.b3lyp_6-31g(d).gjf (generated)

052949147.b3lyp_6-31g(d).firefly.inp (generated)

052949147.b3lyp_6-31g(d).smash.inp (generated)

052949147.b3lyp_6-31g(d).nwchem.inp (generated) 052949147.b3lyp_6-31g(d).log.xz 052949147.td-b3lyp_6-31g+(d).inp 052949147.td-b3lyp_6-31g+(d).log.xz

052949147.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949147.td-b3lyp_6-31+g(d).gjf (generated)

052949147.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949147.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949147.mol 052949147.PUBCHEM 052949147.mol (via Jmol)
052949176.b3lyp_6-31g(d).inp

052949176.b3lyp_6-31g(d).qchem.inp (generated)

052949176.b3lyp_6-31g(d).gjf (generated)

052949176.b3lyp_6-31g(d).firefly.inp (generated)

052949176.b3lyp_6-31g(d).smash.inp (generated)

052949176.b3lyp_6-31g(d).nwchem.inp (generated) 052949176.b3lyp_6-31g(d).log.xz 052949176.td-b3lyp_6-31g+(d).inp 052949176.td-b3lyp_6-31g+(d).log.xz

052949176.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949176.td-b3lyp_6-31+g(d).gjf (generated)

052949176.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949176.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949176.mol 052949176.PUBCHEM 052949176.mol (via Jmol)
052949245.b3lyp_6-31g(d).inp

052949245.b3lyp_6-31g(d).qchem.inp (generated)

052949245.b3lyp_6-31g(d).gjf (generated)

052949245.b3lyp_6-31g(d).firefly.inp (generated)

052949245.b3lyp_6-31g(d).smash.inp (generated)

052949245.b3lyp_6-31g(d).nwchem.inp (generated) 052949245.b3lyp_6-31g(d).log.xz 052949245.td-b3lyp_6-31g+(d).inp 052949245.td-b3lyp_6-31g+(d).log.xz

052949245.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949245.td-b3lyp_6-31+g(d).gjf (generated)

052949245.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949245.mol 052949245.PUBCHEM 052949245.mol (via Jmol)
052949265.b3lyp_6-31g(d).inp

052949265.b3lyp_6-31g(d).qchem.inp (generated)

052949265.b3lyp_6-31g(d).gjf (generated)

052949265.b3lyp_6-31g(d).firefly.inp (generated)

052949265.b3lyp_6-31g(d).smash.inp (generated)

052949265.b3lyp_6-31g(d).nwchem.inp (generated) 052949265.b3lyp_6-31g(d).log.xz 052949265.mol 052949265.PUBCHEM 052949265.mol (via Jmol)
052949339.b3lyp_6-31g(d).inp

052949339.b3lyp_6-31g(d).qchem.inp (generated)

052949339.b3lyp_6-31g(d).gjf (generated)

052949339.b3lyp_6-31g(d).firefly.inp (generated)

052949339.b3lyp_6-31g(d).smash.inp (generated)

052949339.b3lyp_6-31g(d).nwchem.inp (generated) 052949339.b3lyp_6-31g(d).log.xz 052949339.td-b3lyp_6-31g+(d).inp 052949339.td-b3lyp_6-31g+(d).log.xz

052949339.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949339.td-b3lyp_6-31+g(d).gjf (generated)

052949339.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949339.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949339.mol 052949339.PUBCHEM 052949339.mol (via Jmol)
052949342.b3lyp_6-31g(d).inp

052949342.b3lyp_6-31g(d).qchem.inp (generated)

052949342.b3lyp_6-31g(d).gjf (generated)

052949342.b3lyp_6-31g(d).firefly.inp (generated)

052949342.b3lyp_6-31g(d).smash.inp (generated)

052949342.b3lyp_6-31g(d).nwchem.inp (generated) 052949342.b3lyp_6-31g(d).log.xz 052949342.td-b3lyp_6-31g+(d).inp 052949342.td-b3lyp_6-31g+(d).log.xz

052949342.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949342.td-b3lyp_6-31+g(d).gjf (generated)

052949342.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949342.mol 052949342.PUBCHEM 052949342.mol (via Jmol)
052949606.b3lyp_6-31g(d).inp

052949606.b3lyp_6-31g(d).qchem.inp (generated)

052949606.b3lyp_6-31g(d).gjf (generated)

052949606.b3lyp_6-31g(d).firefly.inp (generated)

052949606.b3lyp_6-31g(d).smash.inp (generated)

052949606.b3lyp_6-31g(d).nwchem.inp (generated) 052949606.b3lyp_6-31g(d).log.xz 052949606.td-b3lyp_6-31g+(d).inp 052949606.td-b3lyp_6-31g+(d).log.xz

052949606.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949606.td-b3lyp_6-31+g(d).gjf (generated)

052949606.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949606.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949606.mol 052949606.PUBCHEM 052949606.mol (via Jmol)
052949631.b3lyp_6-31g(d).inp

052949631.b3lyp_6-31g(d).qchem.inp (generated)

052949631.b3lyp_6-31g(d).gjf (generated)

052949631.b3lyp_6-31g(d).firefly.inp (generated)

052949631.b3lyp_6-31g(d).smash.inp (generated)

052949631.b3lyp_6-31g(d).nwchem.inp (generated) 052949631.b3lyp_6-31g(d).log.xz 052949631.td-b3lyp_6-31g+(d).inp 052949631.td-b3lyp_6-31g+(d).log.xz

052949631.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949631.td-b3lyp_6-31+g(d).gjf (generated)

052949631.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949631.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949631.mol 052949631.PUBCHEM 052949631.mol (via Jmol)
052949678.b3lyp_6-31g(d).inp

052949678.b3lyp_6-31g(d).qchem.inp (generated)

052949678.b3lyp_6-31g(d).gjf (generated)

052949678.b3lyp_6-31g(d).firefly.inp (generated)

052949678.b3lyp_6-31g(d).smash.inp (generated)

052949678.b3lyp_6-31g(d).nwchem.inp (generated) 052949678.b3lyp_6-31g(d).log.xz 052949678.td-b3lyp_6-31g+(d).inp 052949678.td-b3lyp_6-31g+(d).log.xz

052949678.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949678.td-b3lyp_6-31+g(d).gjf (generated)

052949678.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949678.mol 052949678.PUBCHEM 052949678.mol (via Jmol)
052949836.b3lyp_6-31g(d).inp

052949836.b3lyp_6-31g(d).qchem.inp (generated)

052949836.b3lyp_6-31g(d).gjf (generated)

052949836.b3lyp_6-31g(d).firefly.inp (generated)

052949836.b3lyp_6-31g(d).smash.inp (generated)

052949836.b3lyp_6-31g(d).nwchem.inp (generated) 052949836.b3lyp_6-31g(d).log.xz 052949836.td-b3lyp_6-31g+(d).inp 052949836.td-b3lyp_6-31g+(d).log.xz

052949836.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949836.td-b3lyp_6-31+g(d).gjf (generated)

052949836.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949836.mol 052949836.PUBCHEM 052949836.mol (via Jmol)
052949920.b3lyp_6-31g(d).inp

052949920.b3lyp_6-31g(d).qchem.inp (generated)

052949920.b3lyp_6-31g(d).gjf (generated)

052949920.b3lyp_6-31g(d).firefly.inp (generated)

052949920.b3lyp_6-31g(d).smash.inp (generated)

052949920.b3lyp_6-31g(d).nwchem.inp (generated) 052949920.b3lyp_6-31g(d).log.xz 052949920.td-b3lyp_6-31g+(d).inp 052949920.td-b3lyp_6-31g+(d).log.xz

052949920.td-b3lyp_6-31+g(d).qchem.inp (generated)

052949920.td-b3lyp_6-31+g(d).gjf (generated)

052949920.td-b3lyp_6-31+g(d).firefly.inp (generated)

052949920.td-b3lyp_6-31+g(d).nwchem.inp (generated) 052949920.mol 052949920.PUBCHEM 052949920.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com