Index of

Last updated : Thu Aug 17 01:52:36 JST 2017
Total : 87 (66) in this page
043001605.b3lyp_6-31g(d).inp

043001605.b3lyp_6-31g(d).qchem.inp (generated)

043001605.b3lyp_6-31g(d).gjf (generated)

043001605.b3lyp_6-31g(d).firefly.inp (generated)

043001605.b3lyp_6-31g(d).smash.inp (generated)

043001605.b3lyp_6-31g(d).nwchem.inp (generated) 043001605.b3lyp_6-31g(d).log.xz 043001605.mol 043001605.PUBCHEM 043001605.mol (via Jmol)
043001606.b3lyp_6-31g(d).inp

043001606.b3lyp_6-31g(d).qchem.inp (generated)

043001606.b3lyp_6-31g(d).gjf (generated)

043001606.b3lyp_6-31g(d).firefly.inp (generated)

043001606.b3lyp_6-31g(d).smash.inp (generated)

043001606.b3lyp_6-31g(d).nwchem.inp (generated) 043001606.b3lyp_6-31g(d).log.xz 043001606.mol 043001606.PUBCHEM 043001606.mol (via Jmol)
043002209.b3lyp_6-31g(d).inp

043002209.b3lyp_6-31g(d).qchem.inp (generated)

043002209.b3lyp_6-31g(d).gjf (generated)

043002209.b3lyp_6-31g(d).firefly.inp (generated)

043002209.b3lyp_6-31g(d).smash.inp (generated)

043002209.b3lyp_6-31g(d).nwchem.inp (generated) 043002209.b3lyp_6-31g(d).log.xz 043002209.td-b3lyp_6-31g+(d).inp 043002209.td-b3lyp_6-31g+(d).log.xz

043002209.td-b3lyp_6-31+g(d).qchem.inp (generated)

043002209.td-b3lyp_6-31+g(d).gjf (generated)

043002209.td-b3lyp_6-31+g(d).firefly.inp (generated)

043002209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043002209.mol 043002209.PUBCHEM 043002209.mol (via Jmol)
043002277.b3lyp_6-31g(d).inp

043002277.b3lyp_6-31g(d).qchem.inp (generated)

043002277.b3lyp_6-31g(d).gjf (generated)

043002277.b3lyp_6-31g(d).firefly.inp (generated)

043002277.b3lyp_6-31g(d).smash.inp (generated)

043002277.b3lyp_6-31g(d).nwchem.inp (generated) 043002277.b3lyp_6-31g(d).log.xz 043002277.mol 043002277.PUBCHEM 043002277.mol (via Jmol)
043002543.b3lyp_6-31g(d).inp

043002543.b3lyp_6-31g(d).qchem.inp (generated)

043002543.b3lyp_6-31g(d).gjf (generated)

043002543.b3lyp_6-31g(d).firefly.inp (generated)

043002543.b3lyp_6-31g(d).smash.inp (generated)

043002543.b3lyp_6-31g(d).nwchem.inp (generated) 043002543.b3lyp_6-31g(d).log.xz 043002543.td-b3lyp_6-31g+(d).inp 043002543.td-b3lyp_6-31g+(d).log.xz

043002543.td-b3lyp_6-31+g(d).qchem.inp (generated)

043002543.td-b3lyp_6-31+g(d).gjf (generated)

043002543.td-b3lyp_6-31+g(d).firefly.inp (generated)

043002543.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043002543.mol 043002543.PUBCHEM 043002543.mol (via Jmol)
043002545.b3lyp_6-31g(d).inp

043002545.b3lyp_6-31g(d).qchem.inp (generated)

043002545.b3lyp_6-31g(d).gjf (generated)

043002545.b3lyp_6-31g(d).firefly.inp (generated)

043002545.b3lyp_6-31g(d).smash.inp (generated)

043002545.b3lyp_6-31g(d).nwchem.inp (generated) 043002545.b3lyp_6-31g(d).log.xz 043002545.mol 043002545.PUBCHEM 043002545.mol (via Jmol)
043002672.b3lyp_6-31g(d).inp

043002672.b3lyp_6-31g(d).qchem.inp (generated)

043002672.b3lyp_6-31g(d).gjf (generated)

043002672.b3lyp_6-31g(d).firefly.inp (generated)

043002672.b3lyp_6-31g(d).smash.inp (generated)

043002672.b3lyp_6-31g(d).nwchem.inp (generated) 043002672.b3lyp_6-31g(d).log.xz 043002672.td-b3lyp_6-31g+(d).inp 043002672.td-b3lyp_6-31g+(d).log.xz

043002672.td-b3lyp_6-31+g(d).qchem.inp (generated)

043002672.td-b3lyp_6-31+g(d).gjf (generated)

043002672.td-b3lyp_6-31+g(d).firefly.inp (generated)

043002672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043002672.mol 043002672.PUBCHEM 043002672.mol (via Jmol)
043002849.b3lyp_6-31g(d).inp

043002849.b3lyp_6-31g(d).qchem.inp (generated)

043002849.b3lyp_6-31g(d).gjf (generated)

043002849.b3lyp_6-31g(d).firefly.inp (generated)

043002849.b3lyp_6-31g(d).smash.inp (generated)

043002849.b3lyp_6-31g(d).nwchem.inp (generated) 043002849.b3lyp_6-31g(d).log.xz 043002849.td-b3lyp_6-31g+(d).inp 043002849.td-b3lyp_6-31g+(d).log.xz

043002849.td-b3lyp_6-31+g(d).qchem.inp (generated)

043002849.td-b3lyp_6-31+g(d).gjf (generated)

043002849.td-b3lyp_6-31+g(d).firefly.inp (generated)

043002849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043002849.mol 043002849.PUBCHEM 043002849.mol (via Jmol)
043002850.b3lyp_6-31g(d).inp

043002850.b3lyp_6-31g(d).qchem.inp (generated)

043002850.b3lyp_6-31g(d).gjf (generated)

043002850.b3lyp_6-31g(d).firefly.inp (generated)

043002850.b3lyp_6-31g(d).smash.inp (generated)

043002850.b3lyp_6-31g(d).nwchem.inp (generated) 043002850.b3lyp_6-31g(d).log.xz 043002850.td-b3lyp_6-31g+(d).inp 043002850.td-b3lyp_6-31g+(d).log.xz

043002850.td-b3lyp_6-31+g(d).qchem.inp (generated)

043002850.td-b3lyp_6-31+g(d).gjf (generated)

043002850.td-b3lyp_6-31+g(d).firefly.inp (generated)

043002850.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043002850.mol 043002850.PUBCHEM 043002850.mol (via Jmol)
043002989.b3lyp_6-31g(d).inp

043002989.b3lyp_6-31g(d).qchem.inp (generated)

043002989.b3lyp_6-31g(d).gjf (generated)

043002989.b3lyp_6-31g(d).firefly.inp (generated)

043002989.b3lyp_6-31g(d).smash.inp (generated)

043002989.b3lyp_6-31g(d).nwchem.inp (generated) 043002989.b3lyp_6-31g(d).log.xz 043002989.td-b3lyp_6-31g+(d).inp 043002989.td-b3lyp_6-31g+(d).log.xz

043002989.td-b3lyp_6-31+g(d).qchem.inp (generated)

043002989.td-b3lyp_6-31+g(d).gjf (generated)

043002989.td-b3lyp_6-31+g(d).firefly.inp (generated)

043002989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043002989.mol 043002989.PUBCHEM 043002989.mol (via Jmol)
043003716.b3lyp_6-31g(d).inp

043003716.b3lyp_6-31g(d).qchem.inp (generated)

043003716.b3lyp_6-31g(d).gjf (generated)

043003716.b3lyp_6-31g(d).firefly.inp (generated)

043003716.b3lyp_6-31g(d).smash.inp (generated)

043003716.b3lyp_6-31g(d).nwchem.inp (generated) 043003716.b3lyp_6-31g(d).log.xz 043003716.td-b3lyp_6-31g+(d).inp 043003716.td-b3lyp_6-31g+(d).log.xz

043003716.td-b3lyp_6-31+g(d).qchem.inp (generated)

043003716.td-b3lyp_6-31+g(d).gjf (generated)

043003716.td-b3lyp_6-31+g(d).firefly.inp (generated)

043003716.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043003716.mol 043003716.PUBCHEM 043003716.mol (via Jmol)
043004123.b3lyp_6-31g(d).inp

043004123.b3lyp_6-31g(d).qchem.inp (generated)

043004123.b3lyp_6-31g(d).gjf (generated)

043004123.b3lyp_6-31g(d).firefly.inp (generated)

043004123.b3lyp_6-31g(d).smash.inp (generated)

043004123.b3lyp_6-31g(d).nwchem.inp (generated) 043004123.b3lyp_6-31g(d).log.xz 043004123.td-b3lyp_6-31g+(d).inp 043004123.td-b3lyp_6-31g+(d).log.xz

043004123.td-b3lyp_6-31+g(d).qchem.inp (generated)

043004123.td-b3lyp_6-31+g(d).gjf (generated)

043004123.td-b3lyp_6-31+g(d).firefly.inp (generated)

043004123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043004123.mol 043004123.PUBCHEM 043004123.mol (via Jmol)
043004175.b3lyp_6-31g(d).inp

043004175.b3lyp_6-31g(d).qchem.inp (generated)

043004175.b3lyp_6-31g(d).gjf (generated)

043004175.b3lyp_6-31g(d).firefly.inp (generated)

043004175.b3lyp_6-31g(d).smash.inp (generated)

043004175.b3lyp_6-31g(d).nwchem.inp (generated) 043004175.b3lyp_6-31g(d).log.xz 043004175.td-b3lyp_6-31g+(d).inp 043004175.td-b3lyp_6-31g+(d).log.xz

043004175.td-b3lyp_6-31+g(d).qchem.inp (generated)

043004175.td-b3lyp_6-31+g(d).gjf (generated)

043004175.td-b3lyp_6-31+g(d).firefly.inp (generated)

043004175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043004175.mol 043004175.PUBCHEM 043004175.mol (via Jmol)
043004264.b3lyp_6-31g(d).inp

043004264.b3lyp_6-31g(d).qchem.inp (generated)

043004264.b3lyp_6-31g(d).gjf (generated)

043004264.b3lyp_6-31g(d).firefly.inp (generated)

043004264.b3lyp_6-31g(d).smash.inp (generated)

043004264.b3lyp_6-31g(d).nwchem.inp (generated) 043004264.b3lyp_6-31g(d).log.xz 043004264.td-b3lyp_6-31g+(d).inp 043004264.td-b3lyp_6-31g+(d).log.xz

043004264.td-b3lyp_6-31+g(d).qchem.inp (generated)

043004264.td-b3lyp_6-31+g(d).gjf (generated)

043004264.td-b3lyp_6-31+g(d).firefly.inp (generated)

043004264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043004264.mol 043004264.PUBCHEM 043004264.mol (via Jmol)
043004409.b3lyp_6-31g(d).inp

043004409.b3lyp_6-31g(d).qchem.inp (generated)

043004409.b3lyp_6-31g(d).gjf (generated)

043004409.b3lyp_6-31g(d).firefly.inp (generated)

043004409.b3lyp_6-31g(d).smash.inp (generated)

043004409.b3lyp_6-31g(d).nwchem.inp (generated) 043004409.b3lyp_6-31g(d).log.xz 043004409.td-b3lyp_6-31g+(d).inp 043004409.td-b3lyp_6-31g+(d).log.xz

043004409.td-b3lyp_6-31+g(d).qchem.inp (generated)

043004409.td-b3lyp_6-31+g(d).gjf (generated)

043004409.td-b3lyp_6-31+g(d).firefly.inp (generated)

043004409.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043004409.mol 043004409.PUBCHEM 043004409.mol (via Jmol)
043005323.b3lyp_6-31g(d).inp

043005323.b3lyp_6-31g(d).qchem.inp (generated)

043005323.b3lyp_6-31g(d).gjf (generated)

043005323.b3lyp_6-31g(d).firefly.inp (generated)

043005323.b3lyp_6-31g(d).smash.inp (generated)

043005323.b3lyp_6-31g(d).nwchem.inp (generated) 043005323.b3lyp_6-31g(d).log.xz 043005323.td-b3lyp_6-31g+(d).inp 043005323.td-b3lyp_6-31g+(d).log.xz

043005323.td-b3lyp_6-31+g(d).qchem.inp (generated)

043005323.td-b3lyp_6-31+g(d).gjf (generated)

043005323.td-b3lyp_6-31+g(d).firefly.inp (generated)

043005323.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043005323.mol 043005323.PUBCHEM 043005323.mol (via Jmol)
043005625.b3lyp_6-31g(d).inp

043005625.b3lyp_6-31g(d).qchem.inp (generated)

043005625.b3lyp_6-31g(d).gjf (generated)

043005625.b3lyp_6-31g(d).firefly.inp (generated)

043005625.b3lyp_6-31g(d).smash.inp (generated)

043005625.b3lyp_6-31g(d).nwchem.inp (generated) 043005625.b3lyp_6-31g(d).log.xz 043005625.td-b3lyp_6-31g+(d).inp 043005625.td-b3lyp_6-31g+(d).log.xz

043005625.td-b3lyp_6-31+g(d).qchem.inp (generated)

043005625.td-b3lyp_6-31+g(d).gjf (generated)

043005625.td-b3lyp_6-31+g(d).firefly.inp (generated)

043005625.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043005625.mol 043005625.PUBCHEM 043005625.mol (via Jmol)
043005642.b3lyp_6-31g(d).inp

043005642.b3lyp_6-31g(d).qchem.inp (generated)

043005642.b3lyp_6-31g(d).gjf (generated)

043005642.b3lyp_6-31g(d).firefly.inp (generated)

043005642.b3lyp_6-31g(d).smash.inp (generated)

043005642.b3lyp_6-31g(d).nwchem.inp (generated) 043005642.b3lyp_6-31g(d).log.xz 043005642.td-b3lyp_6-31g+(d).inp 043005642.td-b3lyp_6-31g+(d).log.xz

043005642.td-b3lyp_6-31+g(d).qchem.inp (generated)

043005642.td-b3lyp_6-31+g(d).gjf (generated)

043005642.td-b3lyp_6-31+g(d).firefly.inp (generated)

043005642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043005642.mol 043005642.PUBCHEM 043005642.mol (via Jmol)
043005694.b3lyp_6-31g(d).inp

043005694.b3lyp_6-31g(d).qchem.inp (generated)

043005694.b3lyp_6-31g(d).gjf (generated)

043005694.b3lyp_6-31g(d).firefly.inp (generated)

043005694.b3lyp_6-31g(d).smash.inp (generated)

043005694.b3lyp_6-31g(d).nwchem.inp (generated) 043005694.b3lyp_6-31g(d).log.xz 043005694.td-b3lyp_6-31g+(d).inp 043005694.td-b3lyp_6-31g+(d).log.xz

043005694.td-b3lyp_6-31+g(d).qchem.inp (generated)

043005694.td-b3lyp_6-31+g(d).gjf (generated)

043005694.td-b3lyp_6-31+g(d).firefly.inp (generated)

043005694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043005694.mol 043005694.PUBCHEM 043005694.mol (via Jmol)
043005932.b3lyp_6-31g(d).inp

043005932.b3lyp_6-31g(d).qchem.inp (generated)

043005932.b3lyp_6-31g(d).gjf (generated)

043005932.b3lyp_6-31g(d).firefly.inp (generated)

043005932.b3lyp_6-31g(d).smash.inp (generated)

043005932.b3lyp_6-31g(d).nwchem.inp (generated) 043005932.b3lyp_6-31g(d).log.xz 043005932.mol 043005932.PUBCHEM 043005932.mol (via Jmol)
043005952.b3lyp_6-31g(d).inp

043005952.b3lyp_6-31g(d).qchem.inp (generated)

043005952.b3lyp_6-31g(d).gjf (generated)

043005952.b3lyp_6-31g(d).firefly.inp (generated)

043005952.b3lyp_6-31g(d).smash.inp (generated)

043005952.b3lyp_6-31g(d).nwchem.inp (generated) 043005952.b3lyp_6-31g(d).log.xz 043005952.mol 043005952.PUBCHEM 043005952.mol (via Jmol)
043006081.b3lyp_6-31g(d).inp

043006081.b3lyp_6-31g(d).qchem.inp (generated)

043006081.b3lyp_6-31g(d).gjf (generated)

043006081.b3lyp_6-31g(d).firefly.inp (generated)

043006081.b3lyp_6-31g(d).smash.inp (generated)

043006081.b3lyp_6-31g(d).nwchem.inp (generated) 043006081.b3lyp_6-31g(d).log.xz 043006081.td-b3lyp_6-31g+(d).inp 043006081.td-b3lyp_6-31g+(d).log.xz

043006081.td-b3lyp_6-31+g(d).qchem.inp (generated)

043006081.td-b3lyp_6-31+g(d).gjf (generated)

043006081.td-b3lyp_6-31+g(d).firefly.inp (generated)

043006081.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043006081.mol 043006081.PUBCHEM 043006081.mol (via Jmol)
043006082.b3lyp_6-31g(d).inp

043006082.b3lyp_6-31g(d).qchem.inp (generated)

043006082.b3lyp_6-31g(d).gjf (generated)

043006082.b3lyp_6-31g(d).firefly.inp (generated)

043006082.b3lyp_6-31g(d).smash.inp (generated)

043006082.b3lyp_6-31g(d).nwchem.inp (generated) 043006082.b3lyp_6-31g(d).log.xz 043006082.td-b3lyp_6-31g+(d).inp 043006082.td-b3lyp_6-31g+(d).log.xz

043006082.td-b3lyp_6-31+g(d).qchem.inp (generated)

043006082.td-b3lyp_6-31+g(d).gjf (generated)

043006082.td-b3lyp_6-31+g(d).firefly.inp (generated)

043006082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043006082.mol 043006082.PUBCHEM 043006082.mol (via Jmol)
043006116.b3lyp_6-31g(d).inp

043006116.b3lyp_6-31g(d).qchem.inp (generated)

043006116.b3lyp_6-31g(d).gjf (generated)

043006116.b3lyp_6-31g(d).firefly.inp (generated)

043006116.b3lyp_6-31g(d).smash.inp (generated)

043006116.b3lyp_6-31g(d).nwchem.inp (generated) 043006116.b3lyp_6-31g(d).log.xz 043006116.td-b3lyp_6-31g+(d).inp 043006116.td-b3lyp_6-31g+(d).log.xz

043006116.td-b3lyp_6-31+g(d).qchem.inp (generated)

043006116.td-b3lyp_6-31+g(d).gjf (generated)

043006116.td-b3lyp_6-31+g(d).firefly.inp (generated)

043006116.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043006116.mol 043006116.PUBCHEM 043006116.mol (via Jmol)
043006881.b3lyp_6-31g(d).inp

043006881.b3lyp_6-31g(d).qchem.inp (generated)

043006881.b3lyp_6-31g(d).gjf (generated)

043006881.b3lyp_6-31g(d).firefly.inp (generated)

043006881.b3lyp_6-31g(d).smash.inp (generated)

043006881.b3lyp_6-31g(d).nwchem.inp (generated) 043006881.b3lyp_6-31g(d).log.xz 043006881.td-b3lyp_6-31g+(d).inp 043006881.td-b3lyp_6-31g+(d).log.xz

043006881.td-b3lyp_6-31+g(d).qchem.inp (generated)

043006881.td-b3lyp_6-31+g(d).gjf (generated)

043006881.td-b3lyp_6-31+g(d).firefly.inp (generated)

043006881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043006881.mol 043006881.PUBCHEM 043006881.mol (via Jmol)
043007046.b3lyp_6-31g(d).inp

043007046.b3lyp_6-31g(d).qchem.inp (generated)

043007046.b3lyp_6-31g(d).gjf (generated)

043007046.b3lyp_6-31g(d).firefly.inp (generated)

043007046.b3lyp_6-31g(d).smash.inp (generated)

043007046.b3lyp_6-31g(d).nwchem.inp (generated) 043007046.b3lyp_6-31g(d).log.xz 043007046.td-b3lyp_6-31g+(d).inp 043007046.td-b3lyp_6-31g+(d).log.xz

043007046.td-b3lyp_6-31+g(d).qchem.inp (generated)

043007046.td-b3lyp_6-31+g(d).gjf (generated)

043007046.td-b3lyp_6-31+g(d).firefly.inp (generated)

043007046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043007046.mol 043007046.PUBCHEM 043007046.mol (via Jmol)
043007179.b3lyp_6-31g(d).inp

043007179.b3lyp_6-31g(d).qchem.inp (generated)

043007179.b3lyp_6-31g(d).gjf (generated)

043007179.b3lyp_6-31g(d).firefly.inp (generated)

043007179.b3lyp_6-31g(d).smash.inp (generated)

043007179.b3lyp_6-31g(d).nwchem.inp (generated) 043007179.b3lyp_6-31g(d).log.xz 043007179.td-b3lyp_6-31g+(d).inp 043007179.td-b3lyp_6-31g+(d).log.xz

043007179.td-b3lyp_6-31+g(d).qchem.inp (generated)

043007179.td-b3lyp_6-31+g(d).gjf (generated)

043007179.td-b3lyp_6-31+g(d).firefly.inp (generated)

043007179.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043007179.mol 043007179.PUBCHEM 043007179.mol (via Jmol)
043007516.b3lyp_6-31g(d).inp

043007516.b3lyp_6-31g(d).qchem.inp (generated)

043007516.b3lyp_6-31g(d).gjf (generated)

043007516.b3lyp_6-31g(d).firefly.inp (generated)

043007516.b3lyp_6-31g(d).smash.inp (generated)

043007516.b3lyp_6-31g(d).nwchem.inp (generated) 043007516.b3lyp_6-31g(d).log.xz 043007516.td-b3lyp_6-31g+(d).inp 043007516.td-b3lyp_6-31g+(d).log.xz

043007516.td-b3lyp_6-31+g(d).qchem.inp (generated)

043007516.td-b3lyp_6-31+g(d).gjf (generated)

043007516.td-b3lyp_6-31+g(d).firefly.inp (generated)

043007516.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043007516.mol 043007516.PUBCHEM 043007516.mol (via Jmol)
043007588.b3lyp_6-31g(d).inp

043007588.b3lyp_6-31g(d).qchem.inp (generated)

043007588.b3lyp_6-31g(d).gjf (generated)

043007588.b3lyp_6-31g(d).firefly.inp (generated)

043007588.b3lyp_6-31g(d).smash.inp (generated)

043007588.b3lyp_6-31g(d).nwchem.inp (generated) 043007588.b3lyp_6-31g(d).log.xz 043007588.mol 043007588.PUBCHEM 043007588.mol (via Jmol)
043007592.b3lyp_6-31g(d).inp

043007592.b3lyp_6-31g(d).qchem.inp (generated)

043007592.b3lyp_6-31g(d).gjf (generated)

043007592.b3lyp_6-31g(d).firefly.inp (generated)

043007592.b3lyp_6-31g(d).smash.inp (generated)

043007592.b3lyp_6-31g(d).nwchem.inp (generated) 043007592.b3lyp_6-31g(d).log.xz 043007592.mol 043007592.PUBCHEM 043007592.mol (via Jmol)
043008197.b3lyp_6-31g(d).inp

043008197.b3lyp_6-31g(d).qchem.inp (generated)

043008197.b3lyp_6-31g(d).gjf (generated)

043008197.b3lyp_6-31g(d).firefly.inp (generated)

043008197.b3lyp_6-31g(d).smash.inp (generated)

043008197.b3lyp_6-31g(d).nwchem.inp (generated) 043008197.b3lyp_6-31g(d).log.xz 043008197.td-b3lyp_6-31g+(d).inp 043008197.td-b3lyp_6-31g+(d).log.xz

043008197.td-b3lyp_6-31+g(d).qchem.inp (generated)

043008197.td-b3lyp_6-31+g(d).gjf (generated)

043008197.td-b3lyp_6-31+g(d).firefly.inp (generated)

043008197.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043008197.mol 043008197.PUBCHEM 043008197.mol (via Jmol)
043008952.b3lyp_6-31g(d).inp

043008952.b3lyp_6-31g(d).qchem.inp (generated)

043008952.b3lyp_6-31g(d).gjf (generated)

043008952.b3lyp_6-31g(d).firefly.inp (generated)

043008952.b3lyp_6-31g(d).smash.inp (generated)

043008952.b3lyp_6-31g(d).nwchem.inp (generated) 043008952.b3lyp_6-31g(d).log.xz 043008952.td-b3lyp_6-31g+(d).inp 043008952.td-b3lyp_6-31g+(d).log.xz

043008952.td-b3lyp_6-31+g(d).qchem.inp (generated)

043008952.td-b3lyp_6-31+g(d).gjf (generated)

043008952.td-b3lyp_6-31+g(d).firefly.inp (generated)

043008952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043008952.mol 043008952.PUBCHEM 043008952.mol (via Jmol)
043008954.b3lyp_6-31g(d).inp

043008954.b3lyp_6-31g(d).qchem.inp (generated)

043008954.b3lyp_6-31g(d).gjf (generated)

043008954.b3lyp_6-31g(d).firefly.inp (generated)

043008954.b3lyp_6-31g(d).smash.inp (generated)

043008954.b3lyp_6-31g(d).nwchem.inp (generated) 043008954.b3lyp_6-31g(d).log.xz 043008954.td-b3lyp_6-31g+(d).inp 043008954.td-b3lyp_6-31g+(d).log.xz

043008954.td-b3lyp_6-31+g(d).qchem.inp (generated)

043008954.td-b3lyp_6-31+g(d).gjf (generated)

043008954.td-b3lyp_6-31+g(d).firefly.inp (generated)

043008954.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043008954.mol 043008954.PUBCHEM 043008954.mol (via Jmol)
043008971.b3lyp_6-31g(d).inp

043008971.b3lyp_6-31g(d).qchem.inp (generated)

043008971.b3lyp_6-31g(d).gjf (generated)

043008971.b3lyp_6-31g(d).firefly.inp (generated)

043008971.b3lyp_6-31g(d).smash.inp (generated)

043008971.b3lyp_6-31g(d).nwchem.inp (generated) 043008971.b3lyp_6-31g(d).log.xz 043008971.td-b3lyp_6-31g+(d).inp 043008971.td-b3lyp_6-31g+(d).log.xz

043008971.td-b3lyp_6-31+g(d).qchem.inp (generated)

043008971.td-b3lyp_6-31+g(d).gjf (generated)

043008971.td-b3lyp_6-31+g(d).firefly.inp (generated)

043008971.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043008971.mol 043008971.PUBCHEM 043008971.mol (via Jmol)
043010460.b3lyp_6-31g(d).inp

043010460.b3lyp_6-31g(d).qchem.inp (generated)

043010460.b3lyp_6-31g(d).gjf (generated)

043010460.b3lyp_6-31g(d).firefly.inp (generated)

043010460.b3lyp_6-31g(d).smash.inp (generated)

043010460.b3lyp_6-31g(d).nwchem.inp (generated) 043010460.b3lyp_6-31g(d).log.xz 043010460.mol 043010460.PUBCHEM 043010460.mol (via Jmol)
043010490.b3lyp_6-31g(d).inp

043010490.b3lyp_6-31g(d).qchem.inp (generated)

043010490.b3lyp_6-31g(d).gjf (generated)

043010490.b3lyp_6-31g(d).firefly.inp (generated)

043010490.b3lyp_6-31g(d).smash.inp (generated)

043010490.b3lyp_6-31g(d).nwchem.inp (generated) 043010490.b3lyp_6-31g(d).log.xz 043010490.td-b3lyp_6-31g+(d).inp 043010490.td-b3lyp_6-31g+(d).log.xz

043010490.td-b3lyp_6-31+g(d).qchem.inp (generated)

043010490.td-b3lyp_6-31+g(d).gjf (generated)

043010490.td-b3lyp_6-31+g(d).firefly.inp (generated)

043010490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043010490.mol 043010490.PUBCHEM 043010490.mol (via Jmol)
043010509.b3lyp_6-31g(d).inp

043010509.b3lyp_6-31g(d).qchem.inp (generated)

043010509.b3lyp_6-31g(d).gjf (generated)

043010509.b3lyp_6-31g(d).firefly.inp (generated)

043010509.b3lyp_6-31g(d).smash.inp (generated)

043010509.b3lyp_6-31g(d).nwchem.inp (generated) 043010509.b3lyp_6-31g(d).log.xz 043010509.td-b3lyp_6-31g+(d).inp 043010509.td-b3lyp_6-31g+(d).log.xz

043010509.td-b3lyp_6-31+g(d).qchem.inp (generated)

043010509.td-b3lyp_6-31+g(d).gjf (generated)

043010509.td-b3lyp_6-31+g(d).firefly.inp (generated)

043010509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043010509.mol 043010509.PUBCHEM 043010509.mol (via Jmol)
043010526.b3lyp_6-31g(d).inp

043010526.b3lyp_6-31g(d).qchem.inp (generated)

043010526.b3lyp_6-31g(d).gjf (generated)

043010526.b3lyp_6-31g(d).firefly.inp (generated)

043010526.b3lyp_6-31g(d).smash.inp (generated)

043010526.b3lyp_6-31g(d).nwchem.inp (generated) 043010526.b3lyp_6-31g(d).log.xz 043010526.td-b3lyp_6-31g+(d).inp 043010526.td-b3lyp_6-31g+(d).log.xz

043010526.td-b3lyp_6-31+g(d).qchem.inp (generated)

043010526.td-b3lyp_6-31+g(d).gjf (generated)

043010526.td-b3lyp_6-31+g(d).firefly.inp (generated)

043010526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043010526.mol 043010526.PUBCHEM 043010526.mol (via Jmol)
043010760.b3lyp_6-31g(d).inp

043010760.b3lyp_6-31g(d).qchem.inp (generated)

043010760.b3lyp_6-31g(d).gjf (generated)

043010760.b3lyp_6-31g(d).firefly.inp (generated)

043010760.b3lyp_6-31g(d).smash.inp (generated)

043010760.b3lyp_6-31g(d).nwchem.inp (generated) 043010760.b3lyp_6-31g(d).log.xz 043010760.mol 043010760.PUBCHEM 043010760.mol (via Jmol)
043010943.b3lyp_6-31g(d).inp

043010943.b3lyp_6-31g(d).qchem.inp (generated)

043010943.b3lyp_6-31g(d).gjf (generated)

043010943.b3lyp_6-31g(d).firefly.inp (generated)

043010943.b3lyp_6-31g(d).smash.inp (generated)

043010943.b3lyp_6-31g(d).nwchem.inp (generated) 043010943.b3lyp_6-31g(d).log.xz 043010943.td-b3lyp_6-31g+(d).inp 043010943.td-b3lyp_6-31g+(d).log.xz

043010943.td-b3lyp_6-31+g(d).qchem.inp (generated)

043010943.td-b3lyp_6-31+g(d).gjf (generated)

043010943.td-b3lyp_6-31+g(d).firefly.inp (generated)

043010943.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043010943.mol 043010943.PUBCHEM 043010943.mol (via Jmol)
043010958.b3lyp_6-31g(d).inp

043010958.b3lyp_6-31g(d).qchem.inp (generated)

043010958.b3lyp_6-31g(d).gjf (generated)

043010958.b3lyp_6-31g(d).firefly.inp (generated)

043010958.b3lyp_6-31g(d).smash.inp (generated)

043010958.b3lyp_6-31g(d).nwchem.inp (generated) 043010958.b3lyp_6-31g(d).log.xz 043010958.mol 043010958.PUBCHEM 043010958.mol (via Jmol)
043011498.b3lyp_6-31g(d).inp

043011498.b3lyp_6-31g(d).qchem.inp (generated)

043011498.b3lyp_6-31g(d).gjf (generated)

043011498.b3lyp_6-31g(d).firefly.inp (generated)

043011498.b3lyp_6-31g(d).smash.inp (generated)

043011498.b3lyp_6-31g(d).nwchem.inp (generated) 043011498.b3lyp_6-31g(d).log.xz 043011498.td-b3lyp_6-31g+(d).inp 043011498.td-b3lyp_6-31g+(d).log.xz

043011498.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011498.td-b3lyp_6-31+g(d).gjf (generated)

043011498.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011498.mol 043011498.PUBCHEM 043011498.mol (via Jmol)
043011734.b3lyp_6-31g(d).inp

043011734.b3lyp_6-31g(d).qchem.inp (generated)

043011734.b3lyp_6-31g(d).gjf (generated)

043011734.b3lyp_6-31g(d).firefly.inp (generated)

043011734.b3lyp_6-31g(d).smash.inp (generated)

043011734.b3lyp_6-31g(d).nwchem.inp (generated) 043011734.b3lyp_6-31g(d).log.xz 043011734.mol 043011734.PUBCHEM 043011734.mol (via Jmol)
043011736.b3lyp_6-31g(d).inp

043011736.b3lyp_6-31g(d).qchem.inp (generated)

043011736.b3lyp_6-31g(d).gjf (generated)

043011736.b3lyp_6-31g(d).firefly.inp (generated)

043011736.b3lyp_6-31g(d).smash.inp (generated)

043011736.b3lyp_6-31g(d).nwchem.inp (generated) 043011736.b3lyp_6-31g(d).log.xz 043011736.td-b3lyp_6-31g+(d).inp 043011736.td-b3lyp_6-31g+(d).log.xz

043011736.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011736.td-b3lyp_6-31+g(d).gjf (generated)

043011736.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011736.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011736.mol 043011736.PUBCHEM 043011736.mol (via Jmol)
043011738.b3lyp_6-31g(d).inp

043011738.b3lyp_6-31g(d).qchem.inp (generated)

043011738.b3lyp_6-31g(d).gjf (generated)

043011738.b3lyp_6-31g(d).firefly.inp (generated)

043011738.b3lyp_6-31g(d).smash.inp (generated)

043011738.b3lyp_6-31g(d).nwchem.inp (generated) 043011738.b3lyp_6-31g(d).log.xz 043011738.td-b3lyp_6-31g+(d).inp 043011738.td-b3lyp_6-31g+(d).log.xz

043011738.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011738.td-b3lyp_6-31+g(d).gjf (generated)

043011738.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011738.mol 043011738.PUBCHEM 043011738.mol (via Jmol)
043011745.b3lyp_6-31g(d).inp

043011745.b3lyp_6-31g(d).qchem.inp (generated)

043011745.b3lyp_6-31g(d).gjf (generated)

043011745.b3lyp_6-31g(d).firefly.inp (generated)

043011745.b3lyp_6-31g(d).smash.inp (generated)

043011745.b3lyp_6-31g(d).nwchem.inp (generated) 043011745.b3lyp_6-31g(d).log.xz 043011745.td-b3lyp_6-31g+(d).inp 043011745.td-b3lyp_6-31g+(d).log.xz

043011745.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011745.td-b3lyp_6-31+g(d).gjf (generated)

043011745.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011745.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011745.mol 043011745.PUBCHEM 043011745.mol (via Jmol)
043011750.b3lyp_6-31g(d).inp

043011750.b3lyp_6-31g(d).qchem.inp (generated)

043011750.b3lyp_6-31g(d).gjf (generated)

043011750.b3lyp_6-31g(d).firefly.inp (generated)

043011750.b3lyp_6-31g(d).smash.inp (generated)

043011750.b3lyp_6-31g(d).nwchem.inp (generated) 043011750.b3lyp_6-31g(d).log.xz 043011750.td-b3lyp_6-31g+(d).inp 043011750.td-b3lyp_6-31g+(d).log.xz

043011750.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011750.td-b3lyp_6-31+g(d).gjf (generated)

043011750.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011750.mol 043011750.PUBCHEM 043011750.mol (via Jmol)
043011751.b3lyp_6-31g(d).inp

043011751.b3lyp_6-31g(d).qchem.inp (generated)

043011751.b3lyp_6-31g(d).gjf (generated)

043011751.b3lyp_6-31g(d).firefly.inp (generated)

043011751.b3lyp_6-31g(d).smash.inp (generated)

043011751.b3lyp_6-31g(d).nwchem.inp (generated) 043011751.b3lyp_6-31g(d).log.xz 043011751.mol 043011751.PUBCHEM 043011751.mol (via Jmol)
043011756.b3lyp_6-31g(d).inp

043011756.b3lyp_6-31g(d).qchem.inp (generated)

043011756.b3lyp_6-31g(d).gjf (generated)

043011756.b3lyp_6-31g(d).firefly.inp (generated)

043011756.b3lyp_6-31g(d).smash.inp (generated)

043011756.b3lyp_6-31g(d).nwchem.inp (generated) 043011756.b3lyp_6-31g(d).log.xz 043011756.td-b3lyp_6-31g+(d).inp 043011756.td-b3lyp_6-31g+(d).log.xz

043011756.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011756.td-b3lyp_6-31+g(d).gjf (generated)

043011756.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011756.mol 043011756.PUBCHEM 043011756.mol (via Jmol)
043011765.b3lyp_6-31g(d).inp

043011765.b3lyp_6-31g(d).qchem.inp (generated)

043011765.b3lyp_6-31g(d).gjf (generated)

043011765.b3lyp_6-31g(d).firefly.inp (generated)

043011765.b3lyp_6-31g(d).smash.inp (generated)

043011765.b3lyp_6-31g(d).nwchem.inp (generated) 043011765.b3lyp_6-31g(d).log.xz 043011765.td-b3lyp_6-31g+(d).inp 043011765.td-b3lyp_6-31g+(d).log.xz

043011765.td-b3lyp_6-31+g(d).qchem.inp (generated)

043011765.td-b3lyp_6-31+g(d).gjf (generated)

043011765.td-b3lyp_6-31+g(d).firefly.inp (generated)

043011765.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043011765.mol 043011765.PUBCHEM 043011765.mol (via Jmol)
043012072.b3lyp_6-31g(d).inp

043012072.b3lyp_6-31g(d).qchem.inp (generated)

043012072.b3lyp_6-31g(d).gjf (generated)

043012072.b3lyp_6-31g(d).firefly.inp (generated)

043012072.b3lyp_6-31g(d).smash.inp (generated)

043012072.b3lyp_6-31g(d).nwchem.inp (generated) 043012072.b3lyp_6-31g(d).log.xz 043012072.td-b3lyp_6-31g+(d).inp 043012072.td-b3lyp_6-31g+(d).log.xz

043012072.td-b3lyp_6-31+g(d).qchem.inp (generated)

043012072.td-b3lyp_6-31+g(d).gjf (generated)

043012072.td-b3lyp_6-31+g(d).firefly.inp (generated)

043012072.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043012072.mol 043012072.PUBCHEM 043012072.mol (via Jmol)
043012073.b3lyp_6-31g(d).inp

043012073.b3lyp_6-31g(d).qchem.inp (generated)

043012073.b3lyp_6-31g(d).gjf (generated)

043012073.b3lyp_6-31g(d).firefly.inp (generated)

043012073.b3lyp_6-31g(d).smash.inp (generated)

043012073.b3lyp_6-31g(d).nwchem.inp (generated) 043012073.b3lyp_6-31g(d).log.xz 043012073.td-b3lyp_6-31g+(d).inp 043012073.td-b3lyp_6-31g+(d).log.xz

043012073.td-b3lyp_6-31+g(d).qchem.inp (generated)

043012073.td-b3lyp_6-31+g(d).gjf (generated)

043012073.td-b3lyp_6-31+g(d).firefly.inp (generated)

043012073.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043012073.mol 043012073.PUBCHEM 043012073.mol (via Jmol)
043012082.b3lyp_6-31g(d).inp

043012082.b3lyp_6-31g(d).qchem.inp (generated)

043012082.b3lyp_6-31g(d).gjf (generated)

043012082.b3lyp_6-31g(d).firefly.inp (generated)

043012082.b3lyp_6-31g(d).smash.inp (generated)

043012082.b3lyp_6-31g(d).nwchem.inp (generated) 043012082.b3lyp_6-31g(d).log.xz 043012082.td-b3lyp_6-31g+(d).inp 043012082.td-b3lyp_6-31g+(d).log.xz

043012082.td-b3lyp_6-31+g(d).qchem.inp (generated)

043012082.td-b3lyp_6-31+g(d).gjf (generated)

043012082.td-b3lyp_6-31+g(d).firefly.inp (generated)

043012082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043012082.mol 043012082.PUBCHEM 043012082.mol (via Jmol)
043012619.b3lyp_6-31g(d).inp

043012619.b3lyp_6-31g(d).qchem.inp (generated)

043012619.b3lyp_6-31g(d).gjf (generated)

043012619.b3lyp_6-31g(d).firefly.inp (generated)

043012619.b3lyp_6-31g(d).smash.inp (generated)

043012619.b3lyp_6-31g(d).nwchem.inp (generated) 043012619.b3lyp_6-31g(d).log.xz 043012619.td-b3lyp_6-31g+(d).inp 043012619.td-b3lyp_6-31g+(d).log.xz

043012619.td-b3lyp_6-31+g(d).qchem.inp (generated)

043012619.td-b3lyp_6-31+g(d).gjf (generated)

043012619.td-b3lyp_6-31+g(d).firefly.inp (generated)

043012619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043012619.mol 043012619.PUBCHEM 043012619.mol (via Jmol)
043012643.b3lyp_6-31g(d).inp

043012643.b3lyp_6-31g(d).qchem.inp (generated)

043012643.b3lyp_6-31g(d).gjf (generated)

043012643.b3lyp_6-31g(d).firefly.inp (generated)

043012643.b3lyp_6-31g(d).smash.inp (generated)

043012643.b3lyp_6-31g(d).nwchem.inp (generated) 043012643.b3lyp_6-31g(d).log.xz 043012643.mol 043012643.PUBCHEM 043012643.mol (via Jmol)
043013038.b3lyp_6-31g(d).inp

043013038.b3lyp_6-31g(d).qchem.inp (generated)

043013038.b3lyp_6-31g(d).gjf (generated)

043013038.b3lyp_6-31g(d).firefly.inp (generated)

043013038.b3lyp_6-31g(d).smash.inp (generated)

043013038.b3lyp_6-31g(d).nwchem.inp (generated) 043013038.b3lyp_6-31g(d).log.xz 043013038.mol 043013038.PUBCHEM 043013038.mol (via Jmol)
043016541.b3lyp_6-31g(d).inp

043016541.b3lyp_6-31g(d).qchem.inp (generated)

043016541.b3lyp_6-31g(d).gjf (generated)

043016541.b3lyp_6-31g(d).firefly.inp (generated)

043016541.b3lyp_6-31g(d).smash.inp (generated)

043016541.b3lyp_6-31g(d).nwchem.inp (generated) 043016541.b3lyp_6-31g(d).log.xz 043016541.td-b3lyp_6-31g+(d).inp 043016541.td-b3lyp_6-31g+(d).log.xz

043016541.td-b3lyp_6-31+g(d).qchem.inp (generated)

043016541.td-b3lyp_6-31+g(d).gjf (generated)

043016541.td-b3lyp_6-31+g(d).firefly.inp (generated)

043016541.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043016541.mol 043016541.PUBCHEM 043016541.mol (via Jmol)
043016829.b3lyp_6-31g(d).inp

043016829.b3lyp_6-31g(d).qchem.inp (generated)

043016829.b3lyp_6-31g(d).gjf (generated)

043016829.b3lyp_6-31g(d).firefly.inp (generated)

043016829.b3lyp_6-31g(d).smash.inp (generated)

043016829.b3lyp_6-31g(d).nwchem.inp (generated) 043016829.b3lyp_6-31g(d).log.xz 043016829.td-b3lyp_6-31g+(d).inp 043016829.td-b3lyp_6-31g+(d).log.xz

043016829.td-b3lyp_6-31+g(d).qchem.inp (generated)

043016829.td-b3lyp_6-31+g(d).gjf (generated)

043016829.td-b3lyp_6-31+g(d).firefly.inp (generated)

043016829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043016829.mol 043016829.PUBCHEM 043016829.mol (via Jmol)
043016925.b3lyp_6-31g(d).inp

043016925.b3lyp_6-31g(d).qchem.inp (generated)

043016925.b3lyp_6-31g(d).gjf (generated)

043016925.b3lyp_6-31g(d).firefly.inp (generated)

043016925.b3lyp_6-31g(d).smash.inp (generated)

043016925.b3lyp_6-31g(d).nwchem.inp (generated) 043016925.b3lyp_6-31g(d).log.xz 043016925.td-b3lyp_6-31g+(d).inp 043016925.td-b3lyp_6-31g+(d).log.xz

043016925.td-b3lyp_6-31+g(d).qchem.inp (generated)

043016925.td-b3lyp_6-31+g(d).gjf (generated)

043016925.td-b3lyp_6-31+g(d).firefly.inp (generated)

043016925.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043016925.mol 043016925.PUBCHEM 043016925.mol (via Jmol)
043016983.b3lyp_6-31g(d).inp

043016983.b3lyp_6-31g(d).qchem.inp (generated)

043016983.b3lyp_6-31g(d).gjf (generated)

043016983.b3lyp_6-31g(d).firefly.inp (generated)

043016983.b3lyp_6-31g(d).smash.inp (generated)

043016983.b3lyp_6-31g(d).nwchem.inp (generated) 043016983.b3lyp_6-31g(d).log.xz 043016983.td-b3lyp_6-31g+(d).inp 043016983.td-b3lyp_6-31g+(d).log.xz

043016983.td-b3lyp_6-31+g(d).qchem.inp (generated)

043016983.td-b3lyp_6-31+g(d).gjf (generated)

043016983.td-b3lyp_6-31+g(d).firefly.inp (generated)

043016983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043016983.mol 043016983.PUBCHEM 043016983.mol (via Jmol)
043017450.b3lyp_6-31g(d).inp

043017450.b3lyp_6-31g(d).qchem.inp (generated)

043017450.b3lyp_6-31g(d).gjf (generated)

043017450.b3lyp_6-31g(d).firefly.inp (generated)

043017450.b3lyp_6-31g(d).smash.inp (generated)

043017450.b3lyp_6-31g(d).nwchem.inp (generated) 043017450.b3lyp_6-31g(d).log.xz 043017450.mol 043017450.PUBCHEM 043017450.mol (via Jmol)
043017456.b3lyp_6-31g(d).inp

043017456.b3lyp_6-31g(d).qchem.inp (generated)

043017456.b3lyp_6-31g(d).gjf (generated)

043017456.b3lyp_6-31g(d).firefly.inp (generated)

043017456.b3lyp_6-31g(d).smash.inp (generated)

043017456.b3lyp_6-31g(d).nwchem.inp (generated) 043017456.b3lyp_6-31g(d).log.xz 043017456.td-b3lyp_6-31g+(d).inp 043017456.td-b3lyp_6-31g+(d).log.xz

043017456.td-b3lyp_6-31+g(d).qchem.inp (generated)

043017456.td-b3lyp_6-31+g(d).gjf (generated)

043017456.td-b3lyp_6-31+g(d).firefly.inp (generated)

043017456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043017456.mol 043017456.PUBCHEM 043017456.mol (via Jmol)
043018276.b3lyp_6-31g(d).inp

043018276.b3lyp_6-31g(d).qchem.inp (generated)

043018276.b3lyp_6-31g(d).gjf (generated)

043018276.b3lyp_6-31g(d).firefly.inp (generated)

043018276.b3lyp_6-31g(d).smash.inp (generated)

043018276.b3lyp_6-31g(d).nwchem.inp (generated) 043018276.b3lyp_6-31g(d).log.xz 043018276.td-b3lyp_6-31g+(d).inp 043018276.td-b3lyp_6-31g+(d).log.xz

043018276.td-b3lyp_6-31+g(d).qchem.inp (generated)

043018276.td-b3lyp_6-31+g(d).gjf (generated)

043018276.td-b3lyp_6-31+g(d).firefly.inp (generated)

043018276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043018276.mol 043018276.PUBCHEM 043018276.mol (via Jmol)
043019268.b3lyp_6-31g(d).inp

043019268.b3lyp_6-31g(d).qchem.inp (generated)

043019268.b3lyp_6-31g(d).gjf (generated)

043019268.b3lyp_6-31g(d).firefly.inp (generated)

043019268.b3lyp_6-31g(d).smash.inp (generated)

043019268.b3lyp_6-31g(d).nwchem.inp (generated) 043019268.b3lyp_6-31g(d).log.xz 043019268.td-b3lyp_6-31g+(d).inp 043019268.td-b3lyp_6-31g+(d).log.xz

043019268.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019268.td-b3lyp_6-31+g(d).gjf (generated)

043019268.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019268.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019268.mol 043019268.PUBCHEM 043019268.mol (via Jmol)
043019269.b3lyp_6-31g(d).inp

043019269.b3lyp_6-31g(d).qchem.inp (generated)

043019269.b3lyp_6-31g(d).gjf (generated)

043019269.b3lyp_6-31g(d).firefly.inp (generated)

043019269.b3lyp_6-31g(d).smash.inp (generated)

043019269.b3lyp_6-31g(d).nwchem.inp (generated) 043019269.b3lyp_6-31g(d).log.xz 043019269.td-b3lyp_6-31g+(d).inp 043019269.td-b3lyp_6-31g+(d).log.xz

043019269.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019269.td-b3lyp_6-31+g(d).gjf (generated)

043019269.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019269.mol 043019269.PUBCHEM 043019269.mol (via Jmol)
043019363.b3lyp_6-31g(d).inp

043019363.b3lyp_6-31g(d).qchem.inp (generated)

043019363.b3lyp_6-31g(d).gjf (generated)

043019363.b3lyp_6-31g(d).firefly.inp (generated)

043019363.b3lyp_6-31g(d).smash.inp (generated)

043019363.b3lyp_6-31g(d).nwchem.inp (generated) 043019363.b3lyp_6-31g(d).log.xz 043019363.td-b3lyp_6-31g+(d).inp 043019363.td-b3lyp_6-31g+(d).log.xz

043019363.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019363.td-b3lyp_6-31+g(d).gjf (generated)

043019363.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019363.mol 043019363.PUBCHEM 043019363.mol (via Jmol)
043019444.b3lyp_6-31g(d).inp

043019444.b3lyp_6-31g(d).qchem.inp (generated)

043019444.b3lyp_6-31g(d).gjf (generated)

043019444.b3lyp_6-31g(d).firefly.inp (generated)

043019444.b3lyp_6-31g(d).smash.inp (generated)

043019444.b3lyp_6-31g(d).nwchem.inp (generated) 043019444.b3lyp_6-31g(d).log.xz 043019444.td-b3lyp_6-31g+(d).inp 043019444.td-b3lyp_6-31g+(d).log.xz

043019444.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019444.td-b3lyp_6-31+g(d).gjf (generated)

043019444.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019444.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019444.mol 043019444.PUBCHEM 043019444.mol (via Jmol)
043019530.b3lyp_6-31g(d).inp

043019530.b3lyp_6-31g(d).qchem.inp (generated)

043019530.b3lyp_6-31g(d).gjf (generated)

043019530.b3lyp_6-31g(d).firefly.inp (generated)

043019530.b3lyp_6-31g(d).smash.inp (generated)

043019530.b3lyp_6-31g(d).nwchem.inp (generated) 043019530.b3lyp_6-31g(d).log.xz 043019530.mol 043019530.PUBCHEM 043019530.mol (via Jmol)
043019578.b3lyp_6-31g(d).inp

043019578.b3lyp_6-31g(d).qchem.inp (generated)

043019578.b3lyp_6-31g(d).gjf (generated)

043019578.b3lyp_6-31g(d).firefly.inp (generated)

043019578.b3lyp_6-31g(d).smash.inp (generated)

043019578.b3lyp_6-31g(d).nwchem.inp (generated) 043019578.b3lyp_6-31g(d).log.xz 043019578.mol 043019578.PUBCHEM 043019578.mol (via Jmol)
043019640.b3lyp_6-31g(d).inp

043019640.b3lyp_6-31g(d).qchem.inp (generated)

043019640.b3lyp_6-31g(d).gjf (generated)

043019640.b3lyp_6-31g(d).firefly.inp (generated)

043019640.b3lyp_6-31g(d).smash.inp (generated)

043019640.b3lyp_6-31g(d).nwchem.inp (generated) 043019640.b3lyp_6-31g(d).log.xz 043019640.td-b3lyp_6-31g+(d).inp 043019640.td-b3lyp_6-31g+(d).log.xz

043019640.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019640.td-b3lyp_6-31+g(d).gjf (generated)

043019640.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019640.mol 043019640.PUBCHEM 043019640.mol (via Jmol)
043019661.b3lyp_6-31g(d).inp

043019661.b3lyp_6-31g(d).qchem.inp (generated)

043019661.b3lyp_6-31g(d).gjf (generated)

043019661.b3lyp_6-31g(d).firefly.inp (generated)

043019661.b3lyp_6-31g(d).smash.inp (generated)

043019661.b3lyp_6-31g(d).nwchem.inp (generated) 043019661.b3lyp_6-31g(d).log.xz 043019661.td-b3lyp_6-31g+(d).inp 043019661.td-b3lyp_6-31g+(d).log.xz

043019661.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019661.td-b3lyp_6-31+g(d).gjf (generated)

043019661.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019661.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019661.mol 043019661.PUBCHEM 043019661.mol (via Jmol)
043019678.b3lyp_6-31g(d).inp

043019678.b3lyp_6-31g(d).qchem.inp (generated)

043019678.b3lyp_6-31g(d).gjf (generated)

043019678.b3lyp_6-31g(d).firefly.inp (generated)

043019678.b3lyp_6-31g(d).smash.inp (generated)

043019678.b3lyp_6-31g(d).nwchem.inp (generated) 043019678.b3lyp_6-31g(d).log.xz 043019678.td-b3lyp_6-31g+(d).inp 043019678.td-b3lyp_6-31g+(d).log.xz

043019678.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019678.td-b3lyp_6-31+g(d).gjf (generated)

043019678.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019678.mol 043019678.PUBCHEM 043019678.mol (via Jmol)
043019679.b3lyp_6-31g(d).inp

043019679.b3lyp_6-31g(d).qchem.inp (generated)

043019679.b3lyp_6-31g(d).gjf (generated)

043019679.b3lyp_6-31g(d).firefly.inp (generated)

043019679.b3lyp_6-31g(d).smash.inp (generated)

043019679.b3lyp_6-31g(d).nwchem.inp (generated) 043019679.b3lyp_6-31g(d).log.xz 043019679.td-b3lyp_6-31g+(d).inp 043019679.td-b3lyp_6-31g+(d).log.xz

043019679.td-b3lyp_6-31+g(d).qchem.inp (generated)

043019679.td-b3lyp_6-31+g(d).gjf (generated)

043019679.td-b3lyp_6-31+g(d).firefly.inp (generated)

043019679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043019679.mol 043019679.PUBCHEM 043019679.mol (via Jmol)
043020237.b3lyp_6-31g(d).inp

043020237.b3lyp_6-31g(d).qchem.inp (generated)

043020237.b3lyp_6-31g(d).gjf (generated)

043020237.b3lyp_6-31g(d).firefly.inp (generated)

043020237.b3lyp_6-31g(d).smash.inp (generated)

043020237.b3lyp_6-31g(d).nwchem.inp (generated) 043020237.b3lyp_6-31g(d).log.xz 043020237.mol 043020237.PUBCHEM 043020237.mol (via Jmol)
043020244.b3lyp_6-31g(d).inp

043020244.b3lyp_6-31g(d).qchem.inp (generated)

043020244.b3lyp_6-31g(d).gjf (generated)

043020244.b3lyp_6-31g(d).firefly.inp (generated)

043020244.b3lyp_6-31g(d).smash.inp (generated)

043020244.b3lyp_6-31g(d).nwchem.inp (generated) 043020244.b3lyp_6-31g(d).log.xz 043020244.td-b3lyp_6-31g+(d).inp 043020244.td-b3lyp_6-31g+(d).log.xz

043020244.td-b3lyp_6-31+g(d).qchem.inp (generated)

043020244.td-b3lyp_6-31+g(d).gjf (generated)

043020244.td-b3lyp_6-31+g(d).firefly.inp (generated)

043020244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043020244.mol 043020244.PUBCHEM 043020244.mol (via Jmol)
043020344.b3lyp_6-31g(d).inp

043020344.b3lyp_6-31g(d).qchem.inp (generated)

043020344.b3lyp_6-31g(d).gjf (generated)

043020344.b3lyp_6-31g(d).firefly.inp (generated)

043020344.b3lyp_6-31g(d).smash.inp (generated)

043020344.b3lyp_6-31g(d).nwchem.inp (generated) 043020344.b3lyp_6-31g(d).log.xz 043020344.td-b3lyp_6-31g+(d).inp 043020344.td-b3lyp_6-31g+(d).log.xz

043020344.td-b3lyp_6-31+g(d).qchem.inp (generated)

043020344.td-b3lyp_6-31+g(d).gjf (generated)

043020344.td-b3lyp_6-31+g(d).firefly.inp (generated)

043020344.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043020344.mol 043020344.PUBCHEM 043020344.mol (via Jmol)
043020420.b3lyp_6-31g(d).inp

043020420.b3lyp_6-31g(d).qchem.inp (generated)

043020420.b3lyp_6-31g(d).gjf (generated)

043020420.b3lyp_6-31g(d).firefly.inp (generated)

043020420.b3lyp_6-31g(d).smash.inp (generated)

043020420.b3lyp_6-31g(d).nwchem.inp (generated) 043020420.b3lyp_6-31g(d).log.xz 043020420.td-b3lyp_6-31g+(d).inp 043020420.td-b3lyp_6-31g+(d).log.xz

043020420.td-b3lyp_6-31+g(d).qchem.inp (generated)

043020420.td-b3lyp_6-31+g(d).gjf (generated)

043020420.td-b3lyp_6-31+g(d).firefly.inp (generated)

043020420.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043020420.mol 043020420.PUBCHEM 043020420.mol (via Jmol)
043020534.b3lyp_6-31g(d).inp

043020534.b3lyp_6-31g(d).qchem.inp (generated)

043020534.b3lyp_6-31g(d).gjf (generated)

043020534.b3lyp_6-31g(d).firefly.inp (generated)

043020534.b3lyp_6-31g(d).smash.inp (generated)

043020534.b3lyp_6-31g(d).nwchem.inp (generated) 043020534.b3lyp_6-31g(d).log.xz 043020534.mol 043020534.PUBCHEM 043020534.mol (via Jmol)
043020554.b3lyp_6-31g(d).inp

043020554.b3lyp_6-31g(d).qchem.inp (generated)

043020554.b3lyp_6-31g(d).gjf (generated)

043020554.b3lyp_6-31g(d).firefly.inp (generated)

043020554.b3lyp_6-31g(d).smash.inp (generated)

043020554.b3lyp_6-31g(d).nwchem.inp (generated) 043020554.b3lyp_6-31g(d).log.xz 043020554.td-b3lyp_6-31g+(d).inp 043020554.td-b3lyp_6-31g+(d).log.xz

043020554.td-b3lyp_6-31+g(d).qchem.inp (generated)

043020554.td-b3lyp_6-31+g(d).gjf (generated)

043020554.td-b3lyp_6-31+g(d).firefly.inp (generated)

043020554.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043020554.mol 043020554.PUBCHEM 043020554.mol (via Jmol)
043020742.b3lyp_6-31g(d).inp

043020742.b3lyp_6-31g(d).qchem.inp (generated)

043020742.b3lyp_6-31g(d).gjf (generated)

043020742.b3lyp_6-31g(d).firefly.inp (generated)

043020742.b3lyp_6-31g(d).smash.inp (generated)

043020742.b3lyp_6-31g(d).nwchem.inp (generated) 043020742.b3lyp_6-31g(d).log.xz 043020742.mol 043020742.PUBCHEM 043020742.mol (via Jmol)
043021026.b3lyp_6-31g(d).inp

043021026.b3lyp_6-31g(d).qchem.inp (generated)

043021026.b3lyp_6-31g(d).gjf (generated)

043021026.b3lyp_6-31g(d).firefly.inp (generated)

043021026.b3lyp_6-31g(d).smash.inp (generated)

043021026.b3lyp_6-31g(d).nwchem.inp (generated) 043021026.b3lyp_6-31g(d).log.xz 043021026.td-b3lyp_6-31g+(d).inp 043021026.td-b3lyp_6-31g+(d).log.xz

043021026.td-b3lyp_6-31+g(d).qchem.inp (generated)

043021026.td-b3lyp_6-31+g(d).gjf (generated)

043021026.td-b3lyp_6-31+g(d).firefly.inp (generated)

043021026.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043021026.mol 043021026.PUBCHEM 043021026.mol (via Jmol)
043021058.b3lyp_6-31g(d).inp

043021058.b3lyp_6-31g(d).qchem.inp (generated)

043021058.b3lyp_6-31g(d).gjf (generated)

043021058.b3lyp_6-31g(d).firefly.inp (generated)

043021058.b3lyp_6-31g(d).smash.inp (generated)

043021058.b3lyp_6-31g(d).nwchem.inp (generated) 043021058.b3lyp_6-31g(d).log.xz 043021058.td-b3lyp_6-31g+(d).inp 043021058.td-b3lyp_6-31g+(d).log.xz

043021058.td-b3lyp_6-31+g(d).qchem.inp (generated)

043021058.td-b3lyp_6-31+g(d).gjf (generated)

043021058.td-b3lyp_6-31+g(d).firefly.inp (generated)

043021058.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043021058.mol 043021058.PUBCHEM 043021058.mol (via Jmol)
043021450.b3lyp_6-31g(d).inp

043021450.b3lyp_6-31g(d).qchem.inp (generated)

043021450.b3lyp_6-31g(d).gjf (generated)

043021450.b3lyp_6-31g(d).firefly.inp (generated)

043021450.b3lyp_6-31g(d).smash.inp (generated)

043021450.b3lyp_6-31g(d).nwchem.inp (generated) 043021450.b3lyp_6-31g(d).log.xz 043021450.td-b3lyp_6-31g+(d).inp 043021450.td-b3lyp_6-31g+(d).log.xz

043021450.td-b3lyp_6-31+g(d).qchem.inp (generated)

043021450.td-b3lyp_6-31+g(d).gjf (generated)

043021450.td-b3lyp_6-31+g(d).firefly.inp (generated)

043021450.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043021450.mol 043021450.PUBCHEM 043021450.mol (via Jmol)
043022442.b3lyp_6-31g(d).inp

043022442.b3lyp_6-31g(d).qchem.inp (generated)

043022442.b3lyp_6-31g(d).gjf (generated)

043022442.b3lyp_6-31g(d).firefly.inp (generated)

043022442.b3lyp_6-31g(d).smash.inp (generated)

043022442.b3lyp_6-31g(d).nwchem.inp (generated) 043022442.b3lyp_6-31g(d).log.xz 043022442.td-b3lyp_6-31g+(d).inp 043022442.td-b3lyp_6-31g+(d).log.xz

043022442.td-b3lyp_6-31+g(d).qchem.inp (generated)

043022442.td-b3lyp_6-31+g(d).gjf (generated)

043022442.td-b3lyp_6-31+g(d).firefly.inp (generated)

043022442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043022442.mol 043022442.PUBCHEM 043022442.mol (via Jmol)
043022710.b3lyp_6-31g(d).inp

043022710.b3lyp_6-31g(d).qchem.inp (generated)

043022710.b3lyp_6-31g(d).gjf (generated)

043022710.b3lyp_6-31g(d).firefly.inp (generated)

043022710.b3lyp_6-31g(d).smash.inp (generated)

043022710.b3lyp_6-31g(d).nwchem.inp (generated) 043022710.b3lyp_6-31g(d).log.xz 043022710.td-b3lyp_6-31g+(d).inp 043022710.td-b3lyp_6-31g+(d).log.xz

043022710.td-b3lyp_6-31+g(d).qchem.inp (generated)

043022710.td-b3lyp_6-31+g(d).gjf (generated)

043022710.td-b3lyp_6-31+g(d).firefly.inp (generated)

043022710.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043022710.mol 043022710.PUBCHEM 043022710.mol (via Jmol)
043022844.b3lyp_6-31g(d).inp

043022844.b3lyp_6-31g(d).qchem.inp (generated)

043022844.b3lyp_6-31g(d).gjf (generated)

043022844.b3lyp_6-31g(d).firefly.inp (generated)

043022844.b3lyp_6-31g(d).smash.inp (generated)

043022844.b3lyp_6-31g(d).nwchem.inp (generated) 043022844.b3lyp_6-31g(d).log.xz 043022844.td-b3lyp_6-31g+(d).inp 043022844.td-b3lyp_6-31g+(d).log.xz

043022844.td-b3lyp_6-31+g(d).qchem.inp (generated)

043022844.td-b3lyp_6-31+g(d).gjf (generated)

043022844.td-b3lyp_6-31+g(d).firefly.inp (generated)

043022844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043022844.mol 043022844.PUBCHEM 043022844.mol (via Jmol)
043022845.b3lyp_6-31g(d).inp

043022845.b3lyp_6-31g(d).qchem.inp (generated)

043022845.b3lyp_6-31g(d).gjf (generated)

043022845.b3lyp_6-31g(d).firefly.inp (generated)

043022845.b3lyp_6-31g(d).smash.inp (generated)

043022845.b3lyp_6-31g(d).nwchem.inp (generated) 043022845.b3lyp_6-31g(d).log.xz 043022845.td-b3lyp_6-31g+(d).inp 043022845.td-b3lyp_6-31g+(d).log.xz

043022845.td-b3lyp_6-31+g(d).qchem.inp (generated)

043022845.td-b3lyp_6-31+g(d).gjf (generated)

043022845.td-b3lyp_6-31+g(d).firefly.inp (generated)

043022845.td-b3lyp_6-31+g(d).nwchem.inp (generated) 043022845.mol 043022845.PUBCHEM 043022845.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com