Index of

Last updated : Thu May 18 02:15:23 JST 2017
Total : 2516 (2029) in this page
000725029.b3lyp_6-31g(d).inp

000725029.b3lyp_6-31g(d).qchem.inp (generated)

000725029.b3lyp_6-31g(d).gjf (generated)

000725029.b3lyp_6-31g(d).firefly.inp (generated)

000725029.b3lyp_6-31g(d).smash.inp (generated)

000725029.b3lyp_6-31g(d).nwchem.inp (generated) 000725029.b3lyp_6-31g(d).log.xz 000725029.td-b3lyp_6-31g+(d).inp 000725029.td-b3lyp_6-31g+(d).log.xz

000725029.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725029.td-b3lyp_6-31+g(d).gjf (generated)

000725029.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725029.mol 000725029.PUBCHEM 000725029.mol (via Jmol)
000725084.b3lyp_6-31g(d).inp

000725084.b3lyp_6-31g(d).qchem.inp (generated)

000725084.b3lyp_6-31g(d).gjf (generated)

000725084.b3lyp_6-31g(d).firefly.inp (generated)

000725084.b3lyp_6-31g(d).smash.inp (generated)

000725084.b3lyp_6-31g(d).nwchem.inp (generated) 000725084.b3lyp_6-31g(d).log.xz 000725084.td-b3lyp_6-31g+(d).inp 000725084.td-b3lyp_6-31g+(d).log.xz

000725084.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725084.td-b3lyp_6-31+g(d).gjf (generated)

000725084.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725084.mol 000725084.PUBCHEM 000725084.mol (via Jmol)
000725114.b3lyp_6-31g(d).inp

000725114.b3lyp_6-31g(d).qchem.inp (generated)

000725114.b3lyp_6-31g(d).gjf (generated)

000725114.b3lyp_6-31g(d).firefly.inp (generated)

000725114.b3lyp_6-31g(d).smash.inp (generated)

000725114.b3lyp_6-31g(d).nwchem.inp (generated) 000725114.b3lyp_6-31g(d).log.xz 000725114.td-b3lyp_6-31g+(d).inp 000725114.td-b3lyp_6-31g+(d).log.xz

000725114.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725114.td-b3lyp_6-31+g(d).gjf (generated)

000725114.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725114.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725114.mol 000725114.PUBCHEM 000725114.mol (via Jmol)
000725279.b3lyp_6-31g(d).inp

000725279.b3lyp_6-31g(d).qchem.inp (generated)

000725279.b3lyp_6-31g(d).gjf (generated)

000725279.b3lyp_6-31g(d).firefly.inp (generated)

000725279.b3lyp_6-31g(d).smash.inp (generated)

000725279.b3lyp_6-31g(d).nwchem.inp (generated) 000725279.b3lyp_6-31g(d).log.xz 000725279.mol 000725279.PUBCHEM 000725279.mol (via Jmol)
000725318.b3lyp_6-31g(d).inp

000725318.b3lyp_6-31g(d).qchem.inp (generated)

000725318.b3lyp_6-31g(d).gjf (generated)

000725318.b3lyp_6-31g(d).firefly.inp (generated)

000725318.b3lyp_6-31g(d).smash.inp (generated)

000725318.b3lyp_6-31g(d).nwchem.inp (generated) 000725318.b3lyp_6-31g(d).log.xz 000725318.td-b3lyp_6-31g+(d).inp 000725318.td-b3lyp_6-31g+(d).log.xz

000725318.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725318.td-b3lyp_6-31+g(d).gjf (generated)

000725318.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725318.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725318.mol 000725318.PUBCHEM 000725318.mol (via Jmol)
000725322.b3lyp_6-31g(d).inp

000725322.b3lyp_6-31g(d).qchem.inp (generated)

000725322.b3lyp_6-31g(d).gjf (generated)

000725322.b3lyp_6-31g(d).firefly.inp (generated)

000725322.b3lyp_6-31g(d).smash.inp (generated)

000725322.b3lyp_6-31g(d).nwchem.inp (generated) 000725322.b3lyp_6-31g(d).log.xz 000725322.td-b3lyp_6-31g+(d).inp 000725322.td-b3lyp_6-31g+(d).log.xz

000725322.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725322.td-b3lyp_6-31+g(d).gjf (generated)

000725322.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725322.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725322.mol 000725322.PUBCHEM 000725322.mol (via Jmol)
000725334.b3lyp_6-31g(d).inp

000725334.b3lyp_6-31g(d).qchem.inp (generated)

000725334.b3lyp_6-31g(d).gjf (generated)

000725334.b3lyp_6-31g(d).firefly.inp (generated)

000725334.b3lyp_6-31g(d).smash.inp (generated)

000725334.b3lyp_6-31g(d).nwchem.inp (generated) 000725334.b3lyp_6-31g(d).log.xz 000725334.td-b3lyp_6-31g+(d).inp 000725334.td-b3lyp_6-31g+(d).log.xz

000725334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725334.td-b3lyp_6-31+g(d).gjf (generated)

000725334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725334.mol 000725334.PUBCHEM 000725334.mol (via Jmol)
000725336.b3lyp_6-31g(d).inp

000725336.b3lyp_6-31g(d).qchem.inp (generated)

000725336.b3lyp_6-31g(d).gjf (generated)

000725336.b3lyp_6-31g(d).firefly.inp (generated)

000725336.b3lyp_6-31g(d).smash.inp (generated)

000725336.b3lyp_6-31g(d).nwchem.inp (generated) 000725336.b3lyp_6-31g(d).log.xz 000725336.td-b3lyp_6-31g+(d).inp 000725336.td-b3lyp_6-31g+(d).log.xz

000725336.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725336.td-b3lyp_6-31+g(d).gjf (generated)

000725336.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725336.mol 000725336.PUBCHEM 000725336.mol (via Jmol)
000725360.b3lyp_6-31g(d).inp

000725360.b3lyp_6-31g(d).qchem.inp (generated)

000725360.b3lyp_6-31g(d).gjf (generated)

000725360.b3lyp_6-31g(d).firefly.inp (generated)

000725360.b3lyp_6-31g(d).smash.inp (generated)

000725360.b3lyp_6-31g(d).nwchem.inp (generated) 000725360.b3lyp_6-31g(d).log.xz 000725360.mol 000725360.PUBCHEM 000725360.mol (via Jmol)
000725363.b3lyp_6-31g(d).inp

000725363.b3lyp_6-31g(d).qchem.inp (generated)

000725363.b3lyp_6-31g(d).gjf (generated)

000725363.b3lyp_6-31g(d).firefly.inp (generated)

000725363.b3lyp_6-31g(d).smash.inp (generated)

000725363.b3lyp_6-31g(d).nwchem.inp (generated) 000725363.b3lyp_6-31g(d).log.xz 000725363.mol 000725363.PUBCHEM 000725363.mol (via Jmol)
000725374.b3lyp_6-31g(d).inp

000725374.b3lyp_6-31g(d).qchem.inp (generated)

000725374.b3lyp_6-31g(d).gjf (generated)

000725374.b3lyp_6-31g(d).firefly.inp (generated)

000725374.b3lyp_6-31g(d).smash.inp (generated)

000725374.b3lyp_6-31g(d).nwchem.inp (generated) 000725374.b3lyp_6-31g(d).log.xz 000725374.td-b3lyp_6-31g+(d).inp 000725374.td-b3lyp_6-31g+(d).log.xz

000725374.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725374.td-b3lyp_6-31+g(d).gjf (generated)

000725374.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725374.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725374.mol 000725374.PUBCHEM 000725374.mol (via Jmol)
000725380.b3lyp_6-31g(d).inp

000725380.b3lyp_6-31g(d).qchem.inp (generated)

000725380.b3lyp_6-31g(d).gjf (generated)

000725380.b3lyp_6-31g(d).firefly.inp (generated)

000725380.b3lyp_6-31g(d).smash.inp (generated)

000725380.b3lyp_6-31g(d).nwchem.inp (generated) 000725380.b3lyp_6-31g(d).log.xz 000725380.mol 000725380.PUBCHEM 000725380.mol (via Jmol)
000725395.b3lyp_6-31g(d).inp

000725395.b3lyp_6-31g(d).qchem.inp (generated)

000725395.b3lyp_6-31g(d).gjf (generated)

000725395.b3lyp_6-31g(d).firefly.inp (generated)

000725395.b3lyp_6-31g(d).smash.inp (generated)

000725395.b3lyp_6-31g(d).nwchem.inp (generated) 000725395.b3lyp_6-31g(d).log.xz 000725395.td-b3lyp_6-31g+(d).inp 000725395.td-b3lyp_6-31g+(d).log.xz

000725395.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725395.td-b3lyp_6-31+g(d).gjf (generated)

000725395.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725395.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725395.mol 000725395.PUBCHEM 000725395.mol (via Jmol)
000725396.b3lyp_6-31g(d).inp

000725396.b3lyp_6-31g(d).qchem.inp (generated)

000725396.b3lyp_6-31g(d).gjf (generated)

000725396.b3lyp_6-31g(d).firefly.inp (generated)

000725396.b3lyp_6-31g(d).smash.inp (generated)

000725396.b3lyp_6-31g(d).nwchem.inp (generated) 000725396.b3lyp_6-31g(d).log.xz 000725396.td-b3lyp_6-31g+(d).inp 000725396.td-b3lyp_6-31g+(d).log.xz

000725396.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725396.td-b3lyp_6-31+g(d).gjf (generated)

000725396.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725396.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725396.mol 000725396.PUBCHEM 000725396.mol (via Jmol)
000725397.b3lyp_6-31g(d).inp

000725397.b3lyp_6-31g(d).qchem.inp (generated)

000725397.b3lyp_6-31g(d).gjf (generated)

000725397.b3lyp_6-31g(d).firefly.inp (generated)

000725397.b3lyp_6-31g(d).smash.inp (generated)

000725397.b3lyp_6-31g(d).nwchem.inp (generated) 000725397.b3lyp_6-31g(d).log.xz 000725397.td-b3lyp_6-31g+(d).inp 000725397.td-b3lyp_6-31g+(d).log.xz

000725397.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725397.td-b3lyp_6-31+g(d).gjf (generated)

000725397.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725397.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725397.mol 000725397.PUBCHEM 000725397.mol (via Jmol)
000725426.b3lyp_6-31g(d).inp

000725426.b3lyp_6-31g(d).qchem.inp (generated)

000725426.b3lyp_6-31g(d).gjf (generated)

000725426.b3lyp_6-31g(d).firefly.inp (generated)

000725426.b3lyp_6-31g(d).smash.inp (generated)

000725426.b3lyp_6-31g(d).nwchem.inp (generated) 000725426.b3lyp_6-31g(d).log.xz 000725426.td-b3lyp_6-31g+(d).inp 000725426.td-b3lyp_6-31g+(d).log.xz

000725426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725426.td-b3lyp_6-31+g(d).gjf (generated)

000725426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725426.mol 000725426.PUBCHEM 000725426.mol (via Jmol)
000725431.b3lyp_6-31g(d).inp

000725431.b3lyp_6-31g(d).qchem.inp (generated)

000725431.b3lyp_6-31g(d).gjf (generated)

000725431.b3lyp_6-31g(d).firefly.inp (generated)

000725431.b3lyp_6-31g(d).smash.inp (generated)

000725431.b3lyp_6-31g(d).nwchem.inp (generated) 000725431.b3lyp_6-31g(d).log.xz 000725431.td-b3lyp_6-31g+(d).inp 000725431.td-b3lyp_6-31g+(d).log.xz

000725431.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725431.td-b3lyp_6-31+g(d).gjf (generated)

000725431.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725431.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725431.mol 000725431.PUBCHEM 000725431.mol (via Jmol)
000725436.b3lyp_6-31g(d).inp

000725436.b3lyp_6-31g(d).qchem.inp (generated)

000725436.b3lyp_6-31g(d).gjf (generated)

000725436.b3lyp_6-31g(d).firefly.inp (generated)

000725436.b3lyp_6-31g(d).smash.inp (generated)

000725436.b3lyp_6-31g(d).nwchem.inp (generated) 000725436.b3lyp_6-31g(d).log.xz 000725436.td-b3lyp_6-31g+(d).inp 000725436.td-b3lyp_6-31g+(d).log.xz

000725436.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725436.td-b3lyp_6-31+g(d).gjf (generated)

000725436.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725436.mol 000725436.PUBCHEM 000725436.mol (via Jmol)
000725466.b3lyp_6-31g(d).inp

000725466.b3lyp_6-31g(d).qchem.inp (generated)

000725466.b3lyp_6-31g(d).gjf (generated)

000725466.b3lyp_6-31g(d).firefly.inp (generated)

000725466.b3lyp_6-31g(d).smash.inp (generated)

000725466.b3lyp_6-31g(d).nwchem.inp (generated) 000725466.b3lyp_6-31g(d).log.xz 000725466.td-b3lyp_6-31g+(d).inp 000725466.td-b3lyp_6-31g+(d).log.xz

000725466.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725466.td-b3lyp_6-31+g(d).gjf (generated)

000725466.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725466.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725466.mol 000725466.PUBCHEM 000725466.mol (via Jmol)
000725468.b3lyp_6-31g(d).inp

000725468.b3lyp_6-31g(d).qchem.inp (generated)

000725468.b3lyp_6-31g(d).gjf (generated)

000725468.b3lyp_6-31g(d).firefly.inp (generated)

000725468.b3lyp_6-31g(d).smash.inp (generated)

000725468.b3lyp_6-31g(d).nwchem.inp (generated) 000725468.b3lyp_6-31g(d).log.xz 000725468.td-b3lyp_6-31g+(d).inp 000725468.td-b3lyp_6-31g+(d).log.xz

000725468.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725468.td-b3lyp_6-31+g(d).gjf (generated)

000725468.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725468.mol 000725468.PUBCHEM 000725468.mol (via Jmol)
000725477.b3lyp_6-31g(d).inp

000725477.b3lyp_6-31g(d).qchem.inp (generated)

000725477.b3lyp_6-31g(d).gjf (generated)

000725477.b3lyp_6-31g(d).firefly.inp (generated)

000725477.b3lyp_6-31g(d).smash.inp (generated)

000725477.b3lyp_6-31g(d).nwchem.inp (generated) 000725477.b3lyp_6-31g(d).log.xz 000725477.td-b3lyp_6-31g+(d).inp 000725477.td-b3lyp_6-31g+(d).log.xz

000725477.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725477.td-b3lyp_6-31+g(d).gjf (generated)

000725477.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725477.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725477.mol 000725477.PUBCHEM 000725477.mol (via Jmol)
000725478.b3lyp_6-31g(d).inp

000725478.b3lyp_6-31g(d).qchem.inp (generated)

000725478.b3lyp_6-31g(d).gjf (generated)

000725478.b3lyp_6-31g(d).firefly.inp (generated)

000725478.b3lyp_6-31g(d).smash.inp (generated)

000725478.b3lyp_6-31g(d).nwchem.inp (generated) 000725478.b3lyp_6-31g(d).log.xz 000725478.td-b3lyp_6-31g+(d).inp 000725478.td-b3lyp_6-31g+(d).log.xz

000725478.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725478.td-b3lyp_6-31+g(d).gjf (generated)

000725478.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725478.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725478.mol 000725478.PUBCHEM 000725478.mol (via Jmol)
000725507.b3lyp_6-31g(d).inp

000725507.b3lyp_6-31g(d).qchem.inp (generated)

000725507.b3lyp_6-31g(d).gjf (generated)

000725507.b3lyp_6-31g(d).firefly.inp (generated)

000725507.b3lyp_6-31g(d).smash.inp (generated)

000725507.b3lyp_6-31g(d).nwchem.inp (generated) 000725507.b3lyp_6-31g(d).log.xz 000725507.td-b3lyp_6-31g+(d).inp 000725507.td-b3lyp_6-31g+(d).log.xz

000725507.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725507.td-b3lyp_6-31+g(d).gjf (generated)

000725507.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725507.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725507.mol 000725507.PUBCHEM 000725507.mol (via Jmol)
000725509.b3lyp_6-31g(d).inp

000725509.b3lyp_6-31g(d).qchem.inp (generated)

000725509.b3lyp_6-31g(d).gjf (generated)

000725509.b3lyp_6-31g(d).firefly.inp (generated)

000725509.b3lyp_6-31g(d).smash.inp (generated)

000725509.b3lyp_6-31g(d).nwchem.inp (generated) 000725509.b3lyp_6-31g(d).log.xz 000725509.td-b3lyp_6-31g+(d).inp 000725509.td-b3lyp_6-31g+(d).log.xz

000725509.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725509.td-b3lyp_6-31+g(d).gjf (generated)

000725509.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725509.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725509.mol 000725509.PUBCHEM 000725509.mol (via Jmol)
000725526.b3lyp_6-31g(d).inp

000725526.b3lyp_6-31g(d).qchem.inp (generated)

000725526.b3lyp_6-31g(d).gjf (generated)

000725526.b3lyp_6-31g(d).firefly.inp (generated)

000725526.b3lyp_6-31g(d).smash.inp (generated)

000725526.b3lyp_6-31g(d).nwchem.inp (generated) 000725526.b3lyp_6-31g(d).log.xz 000725526.td-b3lyp_6-31g+(d).inp 000725526.td-b3lyp_6-31g+(d).log.xz

000725526.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725526.td-b3lyp_6-31+g(d).gjf (generated)

000725526.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725526.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725526.mol 000725526.PUBCHEM 000725526.mol (via Jmol)
000725539.b3lyp_6-31g(d).inp

000725539.b3lyp_6-31g(d).qchem.inp (generated)

000725539.b3lyp_6-31g(d).gjf (generated)

000725539.b3lyp_6-31g(d).firefly.inp (generated)

000725539.b3lyp_6-31g(d).smash.inp (generated)

000725539.b3lyp_6-31g(d).nwchem.inp (generated) 000725539.b3lyp_6-31g(d).log.xz 000725539.td-b3lyp_6-31g+(d).inp 000725539.td-b3lyp_6-31g+(d).log.xz

000725539.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725539.td-b3lyp_6-31+g(d).gjf (generated)

000725539.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725539.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725539.mol 000725539.PUBCHEM 000725539.mol (via Jmol)
000725540.b3lyp_6-31g(d).inp

000725540.b3lyp_6-31g(d).qchem.inp (generated)

000725540.b3lyp_6-31g(d).gjf (generated)

000725540.b3lyp_6-31g(d).firefly.inp (generated)

000725540.b3lyp_6-31g(d).smash.inp (generated)

000725540.b3lyp_6-31g(d).nwchem.inp (generated) 000725540.b3lyp_6-31g(d).log.xz 000725540.td-b3lyp_6-31g+(d).inp 000725540.td-b3lyp_6-31g+(d).log.xz

000725540.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725540.td-b3lyp_6-31+g(d).gjf (generated)

000725540.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725540.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725540.mol 000725540.PUBCHEM 000725540.mol (via Jmol)
000725542.b3lyp_6-31g(d).inp

000725542.b3lyp_6-31g(d).qchem.inp (generated)

000725542.b3lyp_6-31g(d).gjf (generated)

000725542.b3lyp_6-31g(d).firefly.inp (generated)

000725542.b3lyp_6-31g(d).smash.inp (generated)

000725542.b3lyp_6-31g(d).nwchem.inp (generated) 000725542.b3lyp_6-31g(d).log.xz 000725542.mol 000725542.PUBCHEM 000725542.mol (via Jmol)
000725576.b3lyp_6-31g(d).inp

000725576.b3lyp_6-31g(d).qchem.inp (generated)

000725576.b3lyp_6-31g(d).gjf (generated)

000725576.b3lyp_6-31g(d).firefly.inp (generated)

000725576.b3lyp_6-31g(d).smash.inp (generated)

000725576.b3lyp_6-31g(d).nwchem.inp (generated) 000725576.b3lyp_6-31g(d).log.xz 000725576.mol 000725576.PUBCHEM 000725576.mol (via Jmol)
000725585.b3lyp_6-31g(d).inp

000725585.b3lyp_6-31g(d).qchem.inp (generated)

000725585.b3lyp_6-31g(d).gjf (generated)

000725585.b3lyp_6-31g(d).firefly.inp (generated)

000725585.b3lyp_6-31g(d).smash.inp (generated)

000725585.b3lyp_6-31g(d).nwchem.inp (generated) 000725585.b3lyp_6-31g(d).log.xz 000725585.td-b3lyp_6-31g+(d).inp 000725585.td-b3lyp_6-31g+(d).log.xz

000725585.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725585.td-b3lyp_6-31+g(d).gjf (generated)

000725585.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725585.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725585.mol 000725585.PUBCHEM 000725585.mol (via Jmol)
000725586.b3lyp_6-31g(d).inp

000725586.b3lyp_6-31g(d).qchem.inp (generated)

000725586.b3lyp_6-31g(d).gjf (generated)

000725586.b3lyp_6-31g(d).firefly.inp (generated)

000725586.b3lyp_6-31g(d).smash.inp (generated)

000725586.b3lyp_6-31g(d).nwchem.inp (generated) 000725586.b3lyp_6-31g(d).log.xz 000725586.td-b3lyp_6-31g+(d).inp 000725586.td-b3lyp_6-31g+(d).log.xz

000725586.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725586.td-b3lyp_6-31+g(d).gjf (generated)

000725586.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725586.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725586.mol 000725586.PUBCHEM 000725586.mol (via Jmol)
000725592.b3lyp_6-31g(d).inp

000725592.b3lyp_6-31g(d).qchem.inp (generated)

000725592.b3lyp_6-31g(d).gjf (generated)

000725592.b3lyp_6-31g(d).firefly.inp (generated)

000725592.b3lyp_6-31g(d).smash.inp (generated)

000725592.b3lyp_6-31g(d).nwchem.inp (generated) 000725592.b3lyp_6-31g(d).log.xz 000725592.mol 000725592.PUBCHEM 000725592.mol (via Jmol)
000725639.b3lyp_6-31g(d).inp

000725639.b3lyp_6-31g(d).qchem.inp (generated)

000725639.b3lyp_6-31g(d).gjf (generated)

000725639.b3lyp_6-31g(d).firefly.inp (generated)

000725639.b3lyp_6-31g(d).smash.inp (generated)

000725639.b3lyp_6-31g(d).nwchem.inp (generated) 000725639.b3lyp_6-31g(d).log.xz 000725639.td-b3lyp_6-31g+(d).inp 000725639.td-b3lyp_6-31g+(d).log.xz

000725639.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725639.td-b3lyp_6-31+g(d).gjf (generated)

000725639.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725639.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725639.mol 000725639.PUBCHEM 000725639.mol (via Jmol)
000725658.b3lyp_6-31g(d).inp

000725658.b3lyp_6-31g(d).qchem.inp (generated)

000725658.b3lyp_6-31g(d).gjf (generated)

000725658.b3lyp_6-31g(d).firefly.inp (generated)

000725658.b3lyp_6-31g(d).smash.inp (generated)

000725658.b3lyp_6-31g(d).nwchem.inp (generated) 000725658.b3lyp_6-31g(d).log.xz 000725658.td-b3lyp_6-31g+(d).inp 000725658.td-b3lyp_6-31g+(d).log.xz

000725658.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725658.td-b3lyp_6-31+g(d).gjf (generated)

000725658.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725658.mol 000725658.PUBCHEM 000725658.mol (via Jmol)
000725681.b3lyp_6-31g(d).inp

000725681.b3lyp_6-31g(d).qchem.inp (generated)

000725681.b3lyp_6-31g(d).gjf (generated)

000725681.b3lyp_6-31g(d).firefly.inp (generated)

000725681.b3lyp_6-31g(d).smash.inp (generated)

000725681.b3lyp_6-31g(d).nwchem.inp (generated) 000725681.b3lyp_6-31g(d).log.xz 000725681.td-b3lyp_6-31g+(d).inp 000725681.td-b3lyp_6-31g+(d).log.xz

000725681.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725681.td-b3lyp_6-31+g(d).gjf (generated)

000725681.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725681.mol 000725681.PUBCHEM 000725681.mol (via Jmol)
000725692.b3lyp_6-31g(d).inp

000725692.b3lyp_6-31g(d).qchem.inp (generated)

000725692.b3lyp_6-31g(d).gjf (generated)

000725692.b3lyp_6-31g(d).firefly.inp (generated)

000725692.b3lyp_6-31g(d).smash.inp (generated)

000725692.b3lyp_6-31g(d).nwchem.inp (generated) 000725692.b3lyp_6-31g(d).log.xz 000725692.td-b3lyp_6-31g+(d).inp 000725692.td-b3lyp_6-31g+(d).log.xz

000725692.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725692.td-b3lyp_6-31+g(d).gjf (generated)

000725692.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725692.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725692.mol 000725692.PUBCHEM 000725692.mol (via Jmol)
000725709.b3lyp_6-31g(d).inp

000725709.b3lyp_6-31g(d).qchem.inp (generated)

000725709.b3lyp_6-31g(d).gjf (generated)

000725709.b3lyp_6-31g(d).firefly.inp (generated)

000725709.b3lyp_6-31g(d).smash.inp (generated)

000725709.b3lyp_6-31g(d).nwchem.inp (generated) 000725709.b3lyp_6-31g(d).log.xz 000725709.mol 000725709.PUBCHEM 000725709.mol (via Jmol)
000725711.b3lyp_6-31g(d).inp

000725711.b3lyp_6-31g(d).qchem.inp (generated)

000725711.b3lyp_6-31g(d).gjf (generated)

000725711.b3lyp_6-31g(d).firefly.inp (generated)

000725711.b3lyp_6-31g(d).smash.inp (generated)

000725711.b3lyp_6-31g(d).nwchem.inp (generated) 000725711.b3lyp_6-31g(d).log.xz 000725711.td-b3lyp_6-31g+(d).inp 000725711.td-b3lyp_6-31g+(d).log.xz

000725711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725711.td-b3lyp_6-31+g(d).gjf (generated)

000725711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725711.mol 000725711.PUBCHEM 000725711.mol (via Jmol)
000725738.b3lyp_6-31g(d).inp

000725738.b3lyp_6-31g(d).qchem.inp (generated)

000725738.b3lyp_6-31g(d).gjf (generated)

000725738.b3lyp_6-31g(d).firefly.inp (generated)

000725738.b3lyp_6-31g(d).smash.inp (generated)

000725738.b3lyp_6-31g(d).nwchem.inp (generated) 000725738.b3lyp_6-31g(d).log.xz 000725738.td-b3lyp_6-31g+(d).inp 000725738.td-b3lyp_6-31g+(d).log.xz

000725738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725738.td-b3lyp_6-31+g(d).gjf (generated)

000725738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725738.mol 000725738.PUBCHEM 000725738.mol (via Jmol)
000725767.b3lyp_6-31g(d).inp

000725767.b3lyp_6-31g(d).qchem.inp (generated)

000725767.b3lyp_6-31g(d).gjf (generated)

000725767.b3lyp_6-31g(d).firefly.inp (generated)

000725767.b3lyp_6-31g(d).smash.inp (generated)

000725767.b3lyp_6-31g(d).nwchem.inp (generated) 000725767.b3lyp_6-31g(d).log.xz 000725767.td-b3lyp_6-31g+(d).inp 000725767.td-b3lyp_6-31g+(d).log.xz

000725767.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725767.td-b3lyp_6-31+g(d).gjf (generated)

000725767.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725767.mol 000725767.PUBCHEM 000725767.mol (via Jmol)
000725778.b3lyp_6-31g(d).inp

000725778.b3lyp_6-31g(d).qchem.inp (generated)

000725778.b3lyp_6-31g(d).gjf (generated)

000725778.b3lyp_6-31g(d).firefly.inp (generated)

000725778.b3lyp_6-31g(d).smash.inp (generated)

000725778.b3lyp_6-31g(d).nwchem.inp (generated) 000725778.b3lyp_6-31g(d).log.xz 000725778.td-b3lyp_6-31g+(d).inp 000725778.td-b3lyp_6-31g+(d).log.xz

000725778.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725778.td-b3lyp_6-31+g(d).gjf (generated)

000725778.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725778.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725778.mol 000725778.PUBCHEM 000725778.mol (via Jmol)
000725779.b3lyp_6-31g(d).inp

000725779.b3lyp_6-31g(d).qchem.inp (generated)

000725779.b3lyp_6-31g(d).gjf (generated)

000725779.b3lyp_6-31g(d).firefly.inp (generated)

000725779.b3lyp_6-31g(d).smash.inp (generated)

000725779.b3lyp_6-31g(d).nwchem.inp (generated) 000725779.b3lyp_6-31g(d).log.xz 000725779.td-b3lyp_6-31g+(d).inp 000725779.td-b3lyp_6-31g+(d).log.xz

000725779.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725779.td-b3lyp_6-31+g(d).gjf (generated)

000725779.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725779.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725779.mol 000725779.PUBCHEM 000725779.mol (via Jmol)
000725799.b3lyp_6-31g(d).inp

000725799.b3lyp_6-31g(d).qchem.inp (generated)

000725799.b3lyp_6-31g(d).gjf (generated)

000725799.b3lyp_6-31g(d).firefly.inp (generated)

000725799.b3lyp_6-31g(d).smash.inp (generated)

000725799.b3lyp_6-31g(d).nwchem.inp (generated) 000725799.b3lyp_6-31g(d).log.xz 000725799.td-b3lyp_6-31g+(d).inp 000725799.td-b3lyp_6-31g+(d).log.xz

000725799.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725799.td-b3lyp_6-31+g(d).gjf (generated)

000725799.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725799.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725799.mol 000725799.PUBCHEM 000725799.mol (via Jmol)
000725820.b3lyp_6-31g(d).inp

000725820.b3lyp_6-31g(d).qchem.inp (generated)

000725820.b3lyp_6-31g(d).gjf (generated)

000725820.b3lyp_6-31g(d).firefly.inp (generated)

000725820.b3lyp_6-31g(d).smash.inp (generated)

000725820.b3lyp_6-31g(d).nwchem.inp (generated) 000725820.b3lyp_6-31g(d).log.xz 000725820.td-b3lyp_6-31g+(d).inp 000725820.td-b3lyp_6-31g+(d).log.xz

000725820.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725820.td-b3lyp_6-31+g(d).gjf (generated)

000725820.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725820.mol 000725820.PUBCHEM 000725820.mol (via Jmol)
000725856.b3lyp_6-31g(d).inp

000725856.b3lyp_6-31g(d).qchem.inp (generated)

000725856.b3lyp_6-31g(d).gjf (generated)

000725856.b3lyp_6-31g(d).firefly.inp (generated)

000725856.b3lyp_6-31g(d).smash.inp (generated)

000725856.b3lyp_6-31g(d).nwchem.inp (generated) 000725856.b3lyp_6-31g(d).log.xz 000725856.td-b3lyp_6-31g+(d).inp 000725856.td-b3lyp_6-31g+(d).log.xz

000725856.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725856.td-b3lyp_6-31+g(d).gjf (generated)

000725856.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725856.mol 000725856.PUBCHEM 000725856.mol (via Jmol)
000725903.b3lyp_6-31g(d).inp

000725903.b3lyp_6-31g(d).qchem.inp (generated)

000725903.b3lyp_6-31g(d).gjf (generated)

000725903.b3lyp_6-31g(d).firefly.inp (generated)

000725903.b3lyp_6-31g(d).smash.inp (generated)

000725903.b3lyp_6-31g(d).nwchem.inp (generated) 000725903.b3lyp_6-31g(d).log.xz 000725903.td-b3lyp_6-31g+(d).inp 000725903.td-b3lyp_6-31g+(d).log.xz

000725903.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725903.td-b3lyp_6-31+g(d).gjf (generated)

000725903.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725903.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725903.mol 000725903.PUBCHEM 000725903.mol (via Jmol)
000725906.b3lyp_6-31g(d).inp

000725906.b3lyp_6-31g(d).qchem.inp (generated)

000725906.b3lyp_6-31g(d).gjf (generated)

000725906.b3lyp_6-31g(d).firefly.inp (generated)

000725906.b3lyp_6-31g(d).smash.inp (generated)

000725906.b3lyp_6-31g(d).nwchem.inp (generated) 000725906.b3lyp_6-31g(d).log.xz 000725906.td-b3lyp_6-31g+(d).inp 000725906.td-b3lyp_6-31g+(d).log.xz

000725906.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725906.td-b3lyp_6-31+g(d).gjf (generated)

000725906.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725906.mol 000725906.PUBCHEM 000725906.mol (via Jmol)
000725907.b3lyp_6-31g(d).inp

000725907.b3lyp_6-31g(d).qchem.inp (generated)

000725907.b3lyp_6-31g(d).gjf (generated)

000725907.b3lyp_6-31g(d).firefly.inp (generated)

000725907.b3lyp_6-31g(d).smash.inp (generated)

000725907.b3lyp_6-31g(d).nwchem.inp (generated) 000725907.b3lyp_6-31g(d).log.xz 000725907.mol 000725907.PUBCHEM 000725907.mol (via Jmol)
000725961.b3lyp_6-31g(d).inp

000725961.b3lyp_6-31g(d).qchem.inp (generated)

000725961.b3lyp_6-31g(d).gjf (generated)

000725961.b3lyp_6-31g(d).firefly.inp (generated)

000725961.b3lyp_6-31g(d).smash.inp (generated)

000725961.b3lyp_6-31g(d).nwchem.inp (generated) 000725961.b3lyp_6-31g(d).log.xz 000725961.td-b3lyp_6-31g+(d).inp 000725961.td-b3lyp_6-31g+(d).log.xz

000725961.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725961.td-b3lyp_6-31+g(d).gjf (generated)

000725961.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725961.mol 000725961.PUBCHEM 000725961.mol (via Jmol)
000725982.b3lyp_6-31g(d).inp

000725982.b3lyp_6-31g(d).qchem.inp (generated)

000725982.b3lyp_6-31g(d).gjf (generated)

000725982.b3lyp_6-31g(d).firefly.inp (generated)

000725982.b3lyp_6-31g(d).smash.inp (generated)

000725982.b3lyp_6-31g(d).nwchem.inp (generated) 000725982.b3lyp_6-31g(d).log.xz 000725982.td-b3lyp_6-31g+(d).inp 000725982.td-b3lyp_6-31g+(d).log.xz

000725982.td-b3lyp_6-31+g(d).qchem.inp (generated)

000725982.td-b3lyp_6-31+g(d).gjf (generated)

000725982.td-b3lyp_6-31+g(d).firefly.inp (generated)

000725982.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000725982.mol 000725982.PUBCHEM 000725982.mol (via Jmol)
000726011.b3lyp_6-31g(d).inp

000726011.b3lyp_6-31g(d).qchem.inp (generated)

000726011.b3lyp_6-31g(d).gjf (generated)

000726011.b3lyp_6-31g(d).firefly.inp (generated)

000726011.b3lyp_6-31g(d).smash.inp (generated)

000726011.b3lyp_6-31g(d).nwchem.inp (generated) 000726011.b3lyp_6-31g(d).log.xz 000726011.td-b3lyp_6-31g+(d).inp 000726011.td-b3lyp_6-31g+(d).log.xz

000726011.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726011.td-b3lyp_6-31+g(d).gjf (generated)

000726011.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726011.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726011.mol 000726011.PUBCHEM 000726011.mol (via Jmol)
000726037.b3lyp_6-31g(d).inp

000726037.b3lyp_6-31g(d).qchem.inp (generated)

000726037.b3lyp_6-31g(d).gjf (generated)

000726037.b3lyp_6-31g(d).firefly.inp (generated)

000726037.b3lyp_6-31g(d).smash.inp (generated)

000726037.b3lyp_6-31g(d).nwchem.inp (generated) 000726037.b3lyp_6-31g(d).log.xz 000726037.mol 000726037.PUBCHEM 000726037.mol (via Jmol)
000726041.b3lyp_6-31g(d).inp

000726041.b3lyp_6-31g(d).qchem.inp (generated)

000726041.b3lyp_6-31g(d).gjf (generated)

000726041.b3lyp_6-31g(d).firefly.inp (generated)

000726041.b3lyp_6-31g(d).smash.inp (generated)

000726041.b3lyp_6-31g(d).nwchem.inp (generated) 000726041.b3lyp_6-31g(d).log.xz 000726041.mol 000726041.PUBCHEM 000726041.mol (via Jmol)
000726062.b3lyp_6-31g(d).inp

000726062.b3lyp_6-31g(d).qchem.inp (generated)

000726062.b3lyp_6-31g(d).gjf (generated)

000726062.b3lyp_6-31g(d).firefly.inp (generated)

000726062.b3lyp_6-31g(d).smash.inp (generated)

000726062.b3lyp_6-31g(d).nwchem.inp (generated) 000726062.b3lyp_6-31g(d).log.xz 000726062.td-b3lyp_6-31g+(d).inp 000726062.td-b3lyp_6-31g+(d).log.xz

000726062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726062.td-b3lyp_6-31+g(d).gjf (generated)

000726062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726062.mol 000726062.PUBCHEM 000726062.mol (via Jmol)
000726105.b3lyp_6-31g(d).inp

000726105.b3lyp_6-31g(d).qchem.inp (generated)

000726105.b3lyp_6-31g(d).gjf (generated)

000726105.b3lyp_6-31g(d).firefly.inp (generated)

000726105.b3lyp_6-31g(d).smash.inp (generated)

000726105.b3lyp_6-31g(d).nwchem.inp (generated) 000726105.b3lyp_6-31g(d).log.xz 000726105.td-b3lyp_6-31g+(d).inp 000726105.td-b3lyp_6-31g+(d).log.xz

000726105.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726105.td-b3lyp_6-31+g(d).gjf (generated)

000726105.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726105.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726105.mol 000726105.PUBCHEM 000726105.mol (via Jmol)
000726117.b3lyp_6-31g(d).inp

000726117.b3lyp_6-31g(d).qchem.inp (generated)

000726117.b3lyp_6-31g(d).gjf (generated)

000726117.b3lyp_6-31g(d).firefly.inp (generated)

000726117.b3lyp_6-31g(d).smash.inp (generated)

000726117.b3lyp_6-31g(d).nwchem.inp (generated) 000726117.b3lyp_6-31g(d).log.xz 000726117.mol 000726117.PUBCHEM 000726117.mol (via Jmol)
000726119.b3lyp_6-31g(d).inp

000726119.b3lyp_6-31g(d).qchem.inp (generated)

000726119.b3lyp_6-31g(d).gjf (generated)

000726119.b3lyp_6-31g(d).firefly.inp (generated)

000726119.b3lyp_6-31g(d).smash.inp (generated)

000726119.b3lyp_6-31g(d).nwchem.inp (generated) 000726119.b3lyp_6-31g(d).log.xz 000726119.td-b3lyp_6-31g+(d).inp 000726119.td-b3lyp_6-31g+(d).log.xz

000726119.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726119.td-b3lyp_6-31+g(d).gjf (generated)

000726119.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726119.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726119.mol 000726119.PUBCHEM 000726119.mol (via Jmol)
000726127.b3lyp_6-31g(d).inp

000726127.b3lyp_6-31g(d).qchem.inp (generated)

000726127.b3lyp_6-31g(d).gjf (generated)

000726127.b3lyp_6-31g(d).firefly.inp (generated)

000726127.b3lyp_6-31g(d).smash.inp (generated)

000726127.b3lyp_6-31g(d).nwchem.inp (generated) 000726127.b3lyp_6-31g(d).log.xz 000726127.mol 000726127.PUBCHEM 000726127.mol (via Jmol)
000726153.b3lyp_6-31g(d).inp

000726153.b3lyp_6-31g(d).qchem.inp (generated)

000726153.b3lyp_6-31g(d).gjf (generated)

000726153.b3lyp_6-31g(d).firefly.inp (generated)

000726153.b3lyp_6-31g(d).smash.inp (generated)

000726153.b3lyp_6-31g(d).nwchem.inp (generated) 000726153.b3lyp_6-31g(d).log.xz 000726153.td-b3lyp_6-31g+(d).inp 000726153.td-b3lyp_6-31g+(d).log.xz

000726153.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726153.td-b3lyp_6-31+g(d).gjf (generated)

000726153.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726153.mol 000726153.PUBCHEM 000726153.mol (via Jmol)
000726154.b3lyp_6-31g(d).inp

000726154.b3lyp_6-31g(d).qchem.inp (generated)

000726154.b3lyp_6-31g(d).gjf (generated)

000726154.b3lyp_6-31g(d).firefly.inp (generated)

000726154.b3lyp_6-31g(d).smash.inp (generated)

000726154.b3lyp_6-31g(d).nwchem.inp (generated) 000726154.b3lyp_6-31g(d).log.xz 000726154.td-b3lyp_6-31g+(d).inp 000726154.td-b3lyp_6-31g+(d).log.xz

000726154.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726154.td-b3lyp_6-31+g(d).gjf (generated)

000726154.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726154.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726154.mol 000726154.PUBCHEM 000726154.mol (via Jmol)
000726157.b3lyp_6-31g(d).inp

000726157.b3lyp_6-31g(d).qchem.inp (generated)

000726157.b3lyp_6-31g(d).gjf (generated)

000726157.b3lyp_6-31g(d).firefly.inp (generated)

000726157.b3lyp_6-31g(d).smash.inp (generated)

000726157.b3lyp_6-31g(d).nwchem.inp (generated) 000726157.b3lyp_6-31g(d).log.xz 000726157.td-b3lyp_6-31g+(d).inp 000726157.td-b3lyp_6-31g+(d).log.xz

000726157.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726157.td-b3lyp_6-31+g(d).gjf (generated)

000726157.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726157.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726157.mol 000726157.PUBCHEM 000726157.mol (via Jmol)
000726159.b3lyp_6-31g(d).inp

000726159.b3lyp_6-31g(d).qchem.inp (generated)

000726159.b3lyp_6-31g(d).gjf (generated)

000726159.b3lyp_6-31g(d).firefly.inp (generated)

000726159.b3lyp_6-31g(d).smash.inp (generated)

000726159.b3lyp_6-31g(d).nwchem.inp (generated) 000726159.b3lyp_6-31g(d).log.xz 000726159.td-b3lyp_6-31g+(d).inp 000726159.td-b3lyp_6-31g+(d).log.xz

000726159.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726159.td-b3lyp_6-31+g(d).gjf (generated)

000726159.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726159.mol 000726159.PUBCHEM 000726159.mol (via Jmol)
000726161.b3lyp_6-31g(d).inp

000726161.b3lyp_6-31g(d).qchem.inp (generated)

000726161.b3lyp_6-31g(d).gjf (generated)

000726161.b3lyp_6-31g(d).firefly.inp (generated)

000726161.b3lyp_6-31g(d).smash.inp (generated)

000726161.b3lyp_6-31g(d).nwchem.inp (generated) 000726161.b3lyp_6-31g(d).log.xz 000726161.td-b3lyp_6-31g+(d).inp 000726161.td-b3lyp_6-31g+(d).log.xz

000726161.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726161.td-b3lyp_6-31+g(d).gjf (generated)

000726161.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726161.mol 000726161.PUBCHEM 000726161.mol (via Jmol)
000726163.b3lyp_6-31g(d).inp

000726163.b3lyp_6-31g(d).qchem.inp (generated)

000726163.b3lyp_6-31g(d).gjf (generated)

000726163.b3lyp_6-31g(d).firefly.inp (generated)

000726163.b3lyp_6-31g(d).smash.inp (generated)

000726163.b3lyp_6-31g(d).nwchem.inp (generated) 000726163.b3lyp_6-31g(d).log.xz 000726163.td-b3lyp_6-31g+(d).inp 000726163.td-b3lyp_6-31g+(d).log.xz

000726163.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726163.td-b3lyp_6-31+g(d).gjf (generated)

000726163.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726163.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726163.mol 000726163.PUBCHEM 000726163.mol (via Jmol)
000726172.b3lyp_6-31g(d).inp

000726172.b3lyp_6-31g(d).qchem.inp (generated)

000726172.b3lyp_6-31g(d).gjf (generated)

000726172.b3lyp_6-31g(d).firefly.inp (generated)

000726172.b3lyp_6-31g(d).smash.inp (generated)

000726172.b3lyp_6-31g(d).nwchem.inp (generated) 000726172.b3lyp_6-31g(d).log.xz 000726172.td-b3lyp_6-31g+(d).inp 000726172.td-b3lyp_6-31g+(d).log.xz

000726172.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726172.td-b3lyp_6-31+g(d).gjf (generated)

000726172.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726172.mol 000726172.PUBCHEM 000726172.mol (via Jmol)
000726175.b3lyp_6-31g(d).inp

000726175.b3lyp_6-31g(d).qchem.inp (generated)

000726175.b3lyp_6-31g(d).gjf (generated)

000726175.b3lyp_6-31g(d).firefly.inp (generated)

000726175.b3lyp_6-31g(d).smash.inp (generated)

000726175.b3lyp_6-31g(d).nwchem.inp (generated) 000726175.b3lyp_6-31g(d).log.xz 000726175.td-b3lyp_6-31g+(d).inp 000726175.td-b3lyp_6-31g+(d).log.xz

000726175.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726175.td-b3lyp_6-31+g(d).gjf (generated)

000726175.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726175.mol 000726175.PUBCHEM 000726175.mol (via Jmol)
000726177.b3lyp_6-31g(d).inp

000726177.b3lyp_6-31g(d).qchem.inp (generated)

000726177.b3lyp_6-31g(d).gjf (generated)

000726177.b3lyp_6-31g(d).firefly.inp (generated)

000726177.b3lyp_6-31g(d).smash.inp (generated)

000726177.b3lyp_6-31g(d).nwchem.inp (generated) 000726177.b3lyp_6-31g(d).log.xz 000726177.td-b3lyp_6-31g+(d).inp 000726177.td-b3lyp_6-31g+(d).log.xz

000726177.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726177.td-b3lyp_6-31+g(d).gjf (generated)

000726177.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726177.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726177.mol 000726177.PUBCHEM 000726177.mol (via Jmol)
000726178.b3lyp_6-31g(d).inp

000726178.b3lyp_6-31g(d).qchem.inp (generated)

000726178.b3lyp_6-31g(d).gjf (generated)

000726178.b3lyp_6-31g(d).firefly.inp (generated)

000726178.b3lyp_6-31g(d).smash.inp (generated)

000726178.b3lyp_6-31g(d).nwchem.inp (generated) 000726178.b3lyp_6-31g(d).log.xz 000726178.td-b3lyp_6-31g+(d).inp 000726178.td-b3lyp_6-31g+(d).log.xz

000726178.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726178.td-b3lyp_6-31+g(d).gjf (generated)

000726178.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726178.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726178.mol 000726178.PUBCHEM 000726178.mol (via Jmol)
000726180.b3lyp_6-31g(d).inp

000726180.b3lyp_6-31g(d).qchem.inp (generated)

000726180.b3lyp_6-31g(d).gjf (generated)

000726180.b3lyp_6-31g(d).firefly.inp (generated)

000726180.b3lyp_6-31g(d).smash.inp (generated)

000726180.b3lyp_6-31g(d).nwchem.inp (generated) 000726180.b3lyp_6-31g(d).log.xz 000726180.td-b3lyp_6-31g+(d).inp 000726180.td-b3lyp_6-31g+(d).log.xz

000726180.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726180.td-b3lyp_6-31+g(d).gjf (generated)

000726180.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726180.mol 000726180.PUBCHEM 000726180.mol (via Jmol)
000726188.b3lyp_6-31g(d).inp

000726188.b3lyp_6-31g(d).qchem.inp (generated)

000726188.b3lyp_6-31g(d).gjf (generated)

000726188.b3lyp_6-31g(d).firefly.inp (generated)

000726188.b3lyp_6-31g(d).smash.inp (generated)

000726188.b3lyp_6-31g(d).nwchem.inp (generated) 000726188.b3lyp_6-31g(d).log.xz 000726188.td-b3lyp_6-31g+(d).inp 000726188.td-b3lyp_6-31g+(d).log.xz

000726188.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726188.td-b3lyp_6-31+g(d).gjf (generated)

000726188.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726188.mol 000726188.PUBCHEM 000726188.mol (via Jmol)
000726190.b3lyp_6-31g(d).inp

000726190.b3lyp_6-31g(d).qchem.inp (generated)

000726190.b3lyp_6-31g(d).gjf (generated)

000726190.b3lyp_6-31g(d).firefly.inp (generated)

000726190.b3lyp_6-31g(d).smash.inp (generated)

000726190.b3lyp_6-31g(d).nwchem.inp (generated) 000726190.b3lyp_6-31g(d).log.xz 000726190.td-b3lyp_6-31g+(d).inp 000726190.td-b3lyp_6-31g+(d).log.xz

000726190.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726190.td-b3lyp_6-31+g(d).gjf (generated)

000726190.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726190.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726190.mol 000726190.PUBCHEM 000726190.mol (via Jmol)
000726192.b3lyp_6-31g(d).inp

000726192.b3lyp_6-31g(d).qchem.inp (generated)

000726192.b3lyp_6-31g(d).gjf (generated)

000726192.b3lyp_6-31g(d).firefly.inp (generated)

000726192.b3lyp_6-31g(d).smash.inp (generated)

000726192.b3lyp_6-31g(d).nwchem.inp (generated) 000726192.b3lyp_6-31g(d).log.xz 000726192.mol 000726192.PUBCHEM 000726192.mol (via Jmol)
000726193.b3lyp_6-31g(d).inp

000726193.b3lyp_6-31g(d).qchem.inp (generated)

000726193.b3lyp_6-31g(d).gjf (generated)

000726193.b3lyp_6-31g(d).firefly.inp (generated)

000726193.b3lyp_6-31g(d).smash.inp (generated)

000726193.b3lyp_6-31g(d).nwchem.inp (generated) 000726193.b3lyp_6-31g(d).log.xz 000726193.mol 000726193.PUBCHEM 000726193.mol (via Jmol)
000726194.b3lyp_6-31g(d).inp

000726194.b3lyp_6-31g(d).qchem.inp (generated)

000726194.b3lyp_6-31g(d).gjf (generated)

000726194.b3lyp_6-31g(d).firefly.inp (generated)

000726194.b3lyp_6-31g(d).smash.inp (generated)

000726194.b3lyp_6-31g(d).nwchem.inp (generated) 000726194.b3lyp_6-31g(d).log.xz 000726194.mol 000726194.PUBCHEM 000726194.mol (via Jmol)
000726228.b3lyp_6-31g(d).inp

000726228.b3lyp_6-31g(d).qchem.inp (generated)

000726228.b3lyp_6-31g(d).gjf (generated)

000726228.b3lyp_6-31g(d).firefly.inp (generated)

000726228.b3lyp_6-31g(d).smash.inp (generated)

000726228.b3lyp_6-31g(d).nwchem.inp (generated) 000726228.b3lyp_6-31g(d).log.xz 000726228.td-b3lyp_6-31g+(d).inp 000726228.td-b3lyp_6-31g+(d).log.xz

000726228.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726228.td-b3lyp_6-31+g(d).gjf (generated)

000726228.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726228.mol 000726228.PUBCHEM 000726228.mol (via Jmol)
000726247.b3lyp_6-31g(d).inp

000726247.b3lyp_6-31g(d).qchem.inp (generated)

000726247.b3lyp_6-31g(d).gjf (generated)

000726247.b3lyp_6-31g(d).firefly.inp (generated)

000726247.b3lyp_6-31g(d).smash.inp (generated)

000726247.b3lyp_6-31g(d).nwchem.inp (generated) 000726247.b3lyp_6-31g(d).log.xz 000726247.td-b3lyp_6-31g+(d).inp 000726247.td-b3lyp_6-31g+(d).log.xz

000726247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726247.td-b3lyp_6-31+g(d).gjf (generated)

000726247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726247.mol 000726247.PUBCHEM 000726247.mol (via Jmol)
000726271.b3lyp_6-31g(d).inp

000726271.b3lyp_6-31g(d).qchem.inp (generated)

000726271.b3lyp_6-31g(d).gjf (generated)

000726271.b3lyp_6-31g(d).firefly.inp (generated)

000726271.b3lyp_6-31g(d).smash.inp (generated)

000726271.b3lyp_6-31g(d).nwchem.inp (generated) 000726271.b3lyp_6-31g(d).log.xz 000726271.mol 000726271.PUBCHEM 000726271.mol (via Jmol)
000726276.b3lyp_6-31g(d).inp

000726276.b3lyp_6-31g(d).qchem.inp (generated)

000726276.b3lyp_6-31g(d).gjf (generated)

000726276.b3lyp_6-31g(d).firefly.inp (generated)

000726276.b3lyp_6-31g(d).smash.inp (generated)

000726276.b3lyp_6-31g(d).nwchem.inp (generated) 000726276.b3lyp_6-31g(d).log.xz 000726276.td-b3lyp_6-31g+(d).inp 000726276.td-b3lyp_6-31g+(d).log.xz

000726276.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726276.td-b3lyp_6-31+g(d).gjf (generated)

000726276.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726276.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726276.mol 000726276.PUBCHEM 000726276.mol (via Jmol)
000726315.b3lyp_6-31g(d).inp

000726315.b3lyp_6-31g(d).qchem.inp (generated)

000726315.b3lyp_6-31g(d).gjf (generated)

000726315.b3lyp_6-31g(d).firefly.inp (generated)

000726315.b3lyp_6-31g(d).smash.inp (generated)

000726315.b3lyp_6-31g(d).nwchem.inp (generated) 000726315.b3lyp_6-31g(d).log.xz 000726315.td-b3lyp_6-31g+(d).inp 000726315.td-b3lyp_6-31g+(d).log.xz

000726315.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726315.td-b3lyp_6-31+g(d).gjf (generated)

000726315.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726315.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726315.mol 000726315.PUBCHEM 000726315.mol (via Jmol)
000726316.b3lyp_6-31g(d).inp

000726316.b3lyp_6-31g(d).qchem.inp (generated)

000726316.b3lyp_6-31g(d).gjf (generated)

000726316.b3lyp_6-31g(d).firefly.inp (generated)

000726316.b3lyp_6-31g(d).smash.inp (generated)

000726316.b3lyp_6-31g(d).nwchem.inp (generated) 000726316.b3lyp_6-31g(d).log.xz 000726316.td-b3lyp_6-31g+(d).inp 000726316.td-b3lyp_6-31g+(d).log.xz

000726316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726316.td-b3lyp_6-31+g(d).gjf (generated)

000726316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726316.mol 000726316.PUBCHEM 000726316.mol (via Jmol)
000726324.b3lyp_6-31g(d).inp

000726324.b3lyp_6-31g(d).qchem.inp (generated)

000726324.b3lyp_6-31g(d).gjf (generated)

000726324.b3lyp_6-31g(d).firefly.inp (generated)

000726324.b3lyp_6-31g(d).smash.inp (generated)

000726324.b3lyp_6-31g(d).nwchem.inp (generated) 000726324.b3lyp_6-31g(d).log.xz 000726324.td-b3lyp_6-31g+(d).inp 000726324.td-b3lyp_6-31g+(d).log.xz

000726324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726324.td-b3lyp_6-31+g(d).gjf (generated)

000726324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726324.mol 000726324.PUBCHEM 000726324.mol (via Jmol)
000726325.b3lyp_6-31g(d).inp

000726325.b3lyp_6-31g(d).qchem.inp (generated)

000726325.b3lyp_6-31g(d).gjf (generated)

000726325.b3lyp_6-31g(d).firefly.inp (generated)

000726325.b3lyp_6-31g(d).smash.inp (generated)

000726325.b3lyp_6-31g(d).nwchem.inp (generated) 000726325.b3lyp_6-31g(d).log.xz 000726325.td-b3lyp_6-31g+(d).inp 000726325.td-b3lyp_6-31g+(d).log.xz

000726325.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726325.td-b3lyp_6-31+g(d).gjf (generated)

000726325.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726325.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726325.mol 000726325.PUBCHEM 000726325.mol (via Jmol)
000726326.b3lyp_6-31g(d).inp

000726326.b3lyp_6-31g(d).qchem.inp (generated)

000726326.b3lyp_6-31g(d).gjf (generated)

000726326.b3lyp_6-31g(d).firefly.inp (generated)

000726326.b3lyp_6-31g(d).smash.inp (generated)

000726326.b3lyp_6-31g(d).nwchem.inp (generated) 000726326.b3lyp_6-31g(d).log.xz 000726326.td-b3lyp_6-31g+(d).inp 000726326.td-b3lyp_6-31g+(d).log.xz

000726326.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726326.td-b3lyp_6-31+g(d).gjf (generated)

000726326.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726326.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726326.mol 000726326.PUBCHEM 000726326.mol (via Jmol)
000726338.b3lyp_6-31g(d).inp

000726338.b3lyp_6-31g(d).qchem.inp (generated)

000726338.b3lyp_6-31g(d).gjf (generated)

000726338.b3lyp_6-31g(d).firefly.inp (generated)

000726338.b3lyp_6-31g(d).smash.inp (generated)

000726338.b3lyp_6-31g(d).nwchem.inp (generated) 000726338.b3lyp_6-31g(d).log.xz 000726338.mol 000726338.PUBCHEM 000726338.mol (via Jmol)
000726343.b3lyp_6-31g(d).inp

000726343.b3lyp_6-31g(d).qchem.inp (generated)

000726343.b3lyp_6-31g(d).gjf (generated)

000726343.b3lyp_6-31g(d).firefly.inp (generated)

000726343.b3lyp_6-31g(d).smash.inp (generated)

000726343.b3lyp_6-31g(d).nwchem.inp (generated) 000726343.b3lyp_6-31g(d).log.xz 000726343.td-b3lyp_6-31g+(d).inp 000726343.td-b3lyp_6-31g+(d).log.xz

000726343.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726343.td-b3lyp_6-31+g(d).gjf (generated)

000726343.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726343.mol 000726343.PUBCHEM 000726343.mol (via Jmol)
000726345.b3lyp_6-31g(d).inp

000726345.b3lyp_6-31g(d).qchem.inp (generated)

000726345.b3lyp_6-31g(d).gjf (generated)

000726345.b3lyp_6-31g(d).firefly.inp (generated)

000726345.b3lyp_6-31g(d).smash.inp (generated)

000726345.b3lyp_6-31g(d).nwchem.inp (generated) 000726345.b3lyp_6-31g(d).log.xz 000726345.td-b3lyp_6-31g+(d).inp 000726345.td-b3lyp_6-31g+(d).log.xz

000726345.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726345.td-b3lyp_6-31+g(d).gjf (generated)

000726345.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726345.mol 000726345.PUBCHEM 000726345.mol (via Jmol)
000726354.b3lyp_6-31g(d).inp

000726354.b3lyp_6-31g(d).qchem.inp (generated)

000726354.b3lyp_6-31g(d).gjf (generated)

000726354.b3lyp_6-31g(d).firefly.inp (generated)

000726354.b3lyp_6-31g(d).smash.inp (generated)

000726354.b3lyp_6-31g(d).nwchem.inp (generated) 000726354.b3lyp_6-31g(d).log.xz 000726354.mol 000726354.PUBCHEM 000726354.mol (via Jmol)
000726380.b3lyp_6-31g(d).inp

000726380.b3lyp_6-31g(d).qchem.inp (generated)

000726380.b3lyp_6-31g(d).gjf (generated)

000726380.b3lyp_6-31g(d).firefly.inp (generated)

000726380.b3lyp_6-31g(d).smash.inp (generated)

000726380.b3lyp_6-31g(d).nwchem.inp (generated) 000726380.b3lyp_6-31g(d).log.xz 000726380.td-b3lyp_6-31g+(d).inp 000726380.td-b3lyp_6-31g+(d).log.xz

000726380.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726380.td-b3lyp_6-31+g(d).gjf (generated)

000726380.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726380.mol 000726380.PUBCHEM 000726380.mol (via Jmol)
000726381.b3lyp_6-31g(d).inp

000726381.b3lyp_6-31g(d).qchem.inp (generated)

000726381.b3lyp_6-31g(d).gjf (generated)

000726381.b3lyp_6-31g(d).firefly.inp (generated)

000726381.b3lyp_6-31g(d).smash.inp (generated)

000726381.b3lyp_6-31g(d).nwchem.inp (generated) 000726381.b3lyp_6-31g(d).log.xz 000726381.td-b3lyp_6-31g+(d).inp 000726381.td-b3lyp_6-31g+(d).log.xz

000726381.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726381.td-b3lyp_6-31+g(d).gjf (generated)

000726381.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726381.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726381.mol 000726381.PUBCHEM 000726381.mol (via Jmol)
000726383.b3lyp_6-31g(d).inp

000726383.b3lyp_6-31g(d).qchem.inp (generated)

000726383.b3lyp_6-31g(d).gjf (generated)

000726383.b3lyp_6-31g(d).firefly.inp (generated)

000726383.b3lyp_6-31g(d).smash.inp (generated)

000726383.b3lyp_6-31g(d).nwchem.inp (generated) 000726383.b3lyp_6-31g(d).log.xz 000726383.td-b3lyp_6-31g+(d).inp 000726383.td-b3lyp_6-31g+(d).log.xz

000726383.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726383.td-b3lyp_6-31+g(d).gjf (generated)

000726383.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726383.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726383.mol 000726383.PUBCHEM 000726383.mol (via Jmol)
000726385.b3lyp_6-31g(d).inp

000726385.b3lyp_6-31g(d).qchem.inp (generated)

000726385.b3lyp_6-31g(d).gjf (generated)

000726385.b3lyp_6-31g(d).firefly.inp (generated)

000726385.b3lyp_6-31g(d).smash.inp (generated)

000726385.b3lyp_6-31g(d).nwchem.inp (generated) 000726385.b3lyp_6-31g(d).log.xz 000726385.td-b3lyp_6-31g+(d).inp 000726385.td-b3lyp_6-31g+(d).log.xz

000726385.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726385.td-b3lyp_6-31+g(d).gjf (generated)

000726385.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726385.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726385.mol 000726385.PUBCHEM 000726385.mol (via Jmol)
000726386.b3lyp_6-31g(d).inp

000726386.b3lyp_6-31g(d).qchem.inp (generated)

000726386.b3lyp_6-31g(d).gjf (generated)

000726386.b3lyp_6-31g(d).firefly.inp (generated)

000726386.b3lyp_6-31g(d).smash.inp (generated)

000726386.b3lyp_6-31g(d).nwchem.inp (generated) 000726386.b3lyp_6-31g(d).log.xz 000726386.td-b3lyp_6-31g+(d).inp 000726386.td-b3lyp_6-31g+(d).log.xz

000726386.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726386.td-b3lyp_6-31+g(d).gjf (generated)

000726386.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726386.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726386.mol 000726386.PUBCHEM 000726386.mol (via Jmol)
000726412.b3lyp_6-31g(d).inp

000726412.b3lyp_6-31g(d).qchem.inp (generated)

000726412.b3lyp_6-31g(d).gjf (generated)

000726412.b3lyp_6-31g(d).firefly.inp (generated)

000726412.b3lyp_6-31g(d).smash.inp (generated)

000726412.b3lyp_6-31g(d).nwchem.inp (generated) 000726412.b3lyp_6-31g(d).log.xz 000726412.td-b3lyp_6-31g+(d).inp 000726412.td-b3lyp_6-31g+(d).log.xz

000726412.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726412.td-b3lyp_6-31+g(d).gjf (generated)

000726412.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726412.mol 000726412.PUBCHEM 000726412.mol (via Jmol)
000726426.b3lyp_6-31g(d).inp

000726426.b3lyp_6-31g(d).qchem.inp (generated)

000726426.b3lyp_6-31g(d).gjf (generated)

000726426.b3lyp_6-31g(d).firefly.inp (generated)

000726426.b3lyp_6-31g(d).smash.inp (generated)

000726426.b3lyp_6-31g(d).nwchem.inp (generated) 000726426.b3lyp_6-31g(d).log.xz 000726426.td-b3lyp_6-31g+(d).inp 000726426.td-b3lyp_6-31g+(d).log.xz

000726426.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726426.td-b3lyp_6-31+g(d).gjf (generated)

000726426.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726426.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726426.mol 000726426.PUBCHEM 000726426.mol (via Jmol)
000726428.b3lyp_6-31g(d).inp

000726428.b3lyp_6-31g(d).qchem.inp (generated)

000726428.b3lyp_6-31g(d).gjf (generated)

000726428.b3lyp_6-31g(d).firefly.inp (generated)

000726428.b3lyp_6-31g(d).smash.inp (generated)

000726428.b3lyp_6-31g(d).nwchem.inp (generated) 000726428.b3lyp_6-31g(d).log.xz 000726428.td-b3lyp_6-31g+(d).inp 000726428.td-b3lyp_6-31g+(d).log.xz

000726428.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726428.td-b3lyp_6-31+g(d).gjf (generated)

000726428.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726428.mol 000726428.PUBCHEM 000726428.mol (via Jmol)
000726444.b3lyp_6-31g(d).inp

000726444.b3lyp_6-31g(d).qchem.inp (generated)

000726444.b3lyp_6-31g(d).gjf (generated)

000726444.b3lyp_6-31g(d).firefly.inp (generated)

000726444.b3lyp_6-31g(d).smash.inp (generated)

000726444.b3lyp_6-31g(d).nwchem.inp (generated) 000726444.b3lyp_6-31g(d).log.xz 000726444.mol 000726444.PUBCHEM 000726444.mol (via Jmol)
000726446.b3lyp_6-31g(d).inp

000726446.b3lyp_6-31g(d).qchem.inp (generated)

000726446.b3lyp_6-31g(d).gjf (generated)

000726446.b3lyp_6-31g(d).firefly.inp (generated)

000726446.b3lyp_6-31g(d).smash.inp (generated)

000726446.b3lyp_6-31g(d).nwchem.inp (generated) 000726446.b3lyp_6-31g(d).log.xz 000726446.td-b3lyp_6-31g+(d).inp 000726446.td-b3lyp_6-31g+(d).log.xz

000726446.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726446.td-b3lyp_6-31+g(d).gjf (generated)

000726446.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726446.mol 000726446.PUBCHEM 000726446.mol (via Jmol)
000726447.b3lyp_6-31g(d).inp

000726447.b3lyp_6-31g(d).qchem.inp (generated)

000726447.b3lyp_6-31g(d).gjf (generated)

000726447.b3lyp_6-31g(d).firefly.inp (generated)

000726447.b3lyp_6-31g(d).smash.inp (generated)

000726447.b3lyp_6-31g(d).nwchem.inp (generated) 000726447.b3lyp_6-31g(d).log.xz 000726447.td-b3lyp_6-31g+(d).inp 000726447.td-b3lyp_6-31g+(d).log.xz

000726447.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726447.td-b3lyp_6-31+g(d).gjf (generated)

000726447.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726447.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726447.mol 000726447.PUBCHEM 000726447.mol (via Jmol)
000726449.b3lyp_6-31g(d).inp

000726449.b3lyp_6-31g(d).qchem.inp (generated)

000726449.b3lyp_6-31g(d).gjf (generated)

000726449.b3lyp_6-31g(d).firefly.inp (generated)

000726449.b3lyp_6-31g(d).smash.inp (generated)

000726449.b3lyp_6-31g(d).nwchem.inp (generated) 000726449.b3lyp_6-31g(d).log.xz 000726449.td-b3lyp_6-31g+(d).inp 000726449.td-b3lyp_6-31g+(d).log.xz

000726449.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726449.td-b3lyp_6-31+g(d).gjf (generated)

000726449.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726449.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726449.mol 000726449.PUBCHEM 000726449.mol (via Jmol)
000726452.b3lyp_6-31g(d).inp

000726452.b3lyp_6-31g(d).qchem.inp (generated)

000726452.b3lyp_6-31g(d).gjf (generated)

000726452.b3lyp_6-31g(d).firefly.inp (generated)

000726452.b3lyp_6-31g(d).smash.inp (generated)

000726452.b3lyp_6-31g(d).nwchem.inp (generated) 000726452.b3lyp_6-31g(d).log.xz 000726452.td-b3lyp_6-31g+(d).inp 000726452.td-b3lyp_6-31g+(d).log.xz

000726452.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726452.td-b3lyp_6-31+g(d).gjf (generated)

000726452.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726452.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726452.mol 000726452.PUBCHEM 000726452.mol (via Jmol)
000726456.b3lyp_6-31g(d).inp

000726456.b3lyp_6-31g(d).qchem.inp (generated)

000726456.b3lyp_6-31g(d).gjf (generated)

000726456.b3lyp_6-31g(d).firefly.inp (generated)

000726456.b3lyp_6-31g(d).smash.inp (generated)

000726456.b3lyp_6-31g(d).nwchem.inp (generated) 000726456.b3lyp_6-31g(d).log.xz 000726456.td-b3lyp_6-31g+(d).inp 000726456.td-b3lyp_6-31g+(d).log.xz

000726456.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726456.td-b3lyp_6-31+g(d).gjf (generated)

000726456.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726456.mol 000726456.PUBCHEM 000726456.mol (via Jmol)
000726481.b3lyp_6-31g(d).inp

000726481.b3lyp_6-31g(d).qchem.inp (generated)

000726481.b3lyp_6-31g(d).gjf (generated)

000726481.b3lyp_6-31g(d).firefly.inp (generated)

000726481.b3lyp_6-31g(d).smash.inp (generated)

000726481.b3lyp_6-31g(d).nwchem.inp (generated) 000726481.b3lyp_6-31g(d).log.xz 000726481.td-b3lyp_6-31g+(d).inp 000726481.td-b3lyp_6-31g+(d).log.xz

000726481.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726481.td-b3lyp_6-31+g(d).gjf (generated)

000726481.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726481.mol 000726481.PUBCHEM 000726481.mol (via Jmol)
000726491.b3lyp_6-31g(d).inp

000726491.b3lyp_6-31g(d).qchem.inp (generated)

000726491.b3lyp_6-31g(d).gjf (generated)

000726491.b3lyp_6-31g(d).firefly.inp (generated)

000726491.b3lyp_6-31g(d).smash.inp (generated)

000726491.b3lyp_6-31g(d).nwchem.inp (generated) 000726491.b3lyp_6-31g(d).log.xz 000726491.mol 000726491.PUBCHEM 000726491.mol (via Jmol)
000726545.b3lyp_6-31g(d).inp

000726545.b3lyp_6-31g(d).qchem.inp (generated)

000726545.b3lyp_6-31g(d).gjf (generated)

000726545.b3lyp_6-31g(d).firefly.inp (generated)

000726545.b3lyp_6-31g(d).smash.inp (generated)

000726545.b3lyp_6-31g(d).nwchem.inp (generated) 000726545.b3lyp_6-31g(d).log.xz 000726545.mol 000726545.PUBCHEM 000726545.mol (via Jmol)
000726546.b3lyp_6-31g(d).inp

000726546.b3lyp_6-31g(d).qchem.inp (generated)

000726546.b3lyp_6-31g(d).gjf (generated)

000726546.b3lyp_6-31g(d).firefly.inp (generated)

000726546.b3lyp_6-31g(d).smash.inp (generated)

000726546.b3lyp_6-31g(d).nwchem.inp (generated) 000726546.b3lyp_6-31g(d).log.xz 000726546.td-b3lyp_6-31g+(d).inp 000726546.td-b3lyp_6-31g+(d).log.xz

000726546.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726546.td-b3lyp_6-31+g(d).gjf (generated)

000726546.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726546.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726546.mol 000726546.PUBCHEM 000726546.mol (via Jmol)
000726572.b3lyp_6-31g(d).inp

000726572.b3lyp_6-31g(d).qchem.inp (generated)

000726572.b3lyp_6-31g(d).gjf (generated)

000726572.b3lyp_6-31g(d).firefly.inp (generated)

000726572.b3lyp_6-31g(d).smash.inp (generated)

000726572.b3lyp_6-31g(d).nwchem.inp (generated) 000726572.b3lyp_6-31g(d).log.xz 000726572.td-b3lyp_6-31g+(d).inp 000726572.td-b3lyp_6-31g+(d).log.xz

000726572.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726572.td-b3lyp_6-31+g(d).gjf (generated)

000726572.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726572.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726572.mol 000726572.PUBCHEM 000726572.mol (via Jmol)
000726575.b3lyp_6-31g(d).inp

000726575.b3lyp_6-31g(d).qchem.inp (generated)

000726575.b3lyp_6-31g(d).gjf (generated)

000726575.b3lyp_6-31g(d).firefly.inp (generated)

000726575.b3lyp_6-31g(d).smash.inp (generated)

000726575.b3lyp_6-31g(d).nwchem.inp (generated) 000726575.b3lyp_6-31g(d).log.xz 000726575.mol 000726575.PUBCHEM 000726575.mol (via Jmol)
000726597.b3lyp_6-31g(d).inp

000726597.b3lyp_6-31g(d).qchem.inp (generated)

000726597.b3lyp_6-31g(d).gjf (generated)

000726597.b3lyp_6-31g(d).firefly.inp (generated)

000726597.b3lyp_6-31g(d).smash.inp (generated)

000726597.b3lyp_6-31g(d).nwchem.inp (generated) 000726597.b3lyp_6-31g(d).log.xz 000726597.td-b3lyp_6-31g+(d).inp 000726597.td-b3lyp_6-31g+(d).log.xz

000726597.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726597.td-b3lyp_6-31+g(d).gjf (generated)

000726597.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726597.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726597.mol 000726597.PUBCHEM 000726597.mol (via Jmol)
000726600.b3lyp_6-31g(d).inp

000726600.b3lyp_6-31g(d).qchem.inp (generated)

000726600.b3lyp_6-31g(d).gjf (generated)

000726600.b3lyp_6-31g(d).firefly.inp (generated)

000726600.b3lyp_6-31g(d).smash.inp (generated)

000726600.b3lyp_6-31g(d).nwchem.inp (generated) 000726600.b3lyp_6-31g(d).log.xz 000726600.td-b3lyp_6-31g+(d).inp 000726600.td-b3lyp_6-31g+(d).log.xz

000726600.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726600.td-b3lyp_6-31+g(d).gjf (generated)

000726600.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726600.mol 000726600.PUBCHEM 000726600.mol (via Jmol)
000726608.b3lyp_6-31g(d).inp

000726608.b3lyp_6-31g(d).qchem.inp (generated)

000726608.b3lyp_6-31g(d).gjf (generated)

000726608.b3lyp_6-31g(d).firefly.inp (generated)

000726608.b3lyp_6-31g(d).smash.inp (generated)

000726608.b3lyp_6-31g(d).nwchem.inp (generated) 000726608.b3lyp_6-31g(d).log.xz 000726608.td-b3lyp_6-31g+(d).inp 000726608.td-b3lyp_6-31g+(d).log.xz

000726608.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726608.td-b3lyp_6-31+g(d).gjf (generated)

000726608.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726608.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726608.mol 000726608.PUBCHEM 000726608.mol (via Jmol)
000726627.b3lyp_6-31g(d).inp

000726627.b3lyp_6-31g(d).qchem.inp (generated)

000726627.b3lyp_6-31g(d).gjf (generated)

000726627.b3lyp_6-31g(d).firefly.inp (generated)

000726627.b3lyp_6-31g(d).smash.inp (generated)

000726627.b3lyp_6-31g(d).nwchem.inp (generated) 000726627.b3lyp_6-31g(d).log.xz 000726627.td-b3lyp_6-31g+(d).inp 000726627.td-b3lyp_6-31g+(d).log.xz

000726627.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726627.td-b3lyp_6-31+g(d).gjf (generated)

000726627.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726627.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726627.mol 000726627.PUBCHEM 000726627.mol (via Jmol)
000726630.b3lyp_6-31g(d).inp

000726630.b3lyp_6-31g(d).qchem.inp (generated)

000726630.b3lyp_6-31g(d).gjf (generated)

000726630.b3lyp_6-31g(d).firefly.inp (generated)

000726630.b3lyp_6-31g(d).smash.inp (generated)

000726630.b3lyp_6-31g(d).nwchem.inp (generated) 000726630.b3lyp_6-31g(d).log.xz 000726630.td-b3lyp_6-31g+(d).inp 000726630.td-b3lyp_6-31g+(d).log.xz

000726630.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726630.td-b3lyp_6-31+g(d).gjf (generated)

000726630.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726630.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726630.mol 000726630.PUBCHEM 000726630.mol (via Jmol)
000726633.b3lyp_6-31g(d).inp

000726633.b3lyp_6-31g(d).qchem.inp (generated)

000726633.b3lyp_6-31g(d).gjf (generated)

000726633.b3lyp_6-31g(d).firefly.inp (generated)

000726633.b3lyp_6-31g(d).smash.inp (generated)

000726633.b3lyp_6-31g(d).nwchem.inp (generated) 000726633.b3lyp_6-31g(d).log.xz 000726633.td-b3lyp_6-31g+(d).inp 000726633.td-b3lyp_6-31g+(d).log.xz

000726633.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726633.td-b3lyp_6-31+g(d).gjf (generated)

000726633.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726633.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726633.mol 000726633.PUBCHEM 000726633.mol (via Jmol)
000726636.b3lyp_6-31g(d).inp

000726636.b3lyp_6-31g(d).qchem.inp (generated)

000726636.b3lyp_6-31g(d).gjf (generated)

000726636.b3lyp_6-31g(d).firefly.inp (generated)

000726636.b3lyp_6-31g(d).smash.inp (generated)

000726636.b3lyp_6-31g(d).nwchem.inp (generated) 000726636.b3lyp_6-31g(d).log.xz 000726636.td-b3lyp_6-31g+(d).inp 000726636.td-b3lyp_6-31g+(d).log.xz

000726636.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726636.td-b3lyp_6-31+g(d).gjf (generated)

000726636.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726636.mol 000726636.PUBCHEM 000726636.mol (via Jmol)
000726649.b3lyp_6-31g(d).inp

000726649.b3lyp_6-31g(d).qchem.inp (generated)

000726649.b3lyp_6-31g(d).gjf (generated)

000726649.b3lyp_6-31g(d).firefly.inp (generated)

000726649.b3lyp_6-31g(d).smash.inp (generated)

000726649.b3lyp_6-31g(d).nwchem.inp (generated) 000726649.b3lyp_6-31g(d).log.xz 000726649.td-b3lyp_6-31g+(d).inp 000726649.td-b3lyp_6-31g+(d).log.xz

000726649.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726649.td-b3lyp_6-31+g(d).gjf (generated)

000726649.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726649.mol 000726649.PUBCHEM 000726649.mol (via Jmol)
000726653.b3lyp_6-31g(d).inp

000726653.b3lyp_6-31g(d).qchem.inp (generated)

000726653.b3lyp_6-31g(d).gjf (generated)

000726653.b3lyp_6-31g(d).firefly.inp (generated)

000726653.b3lyp_6-31g(d).smash.inp (generated)

000726653.b3lyp_6-31g(d).nwchem.inp (generated) 000726653.b3lyp_6-31g(d).log.xz 000726653.td-b3lyp_6-31g+(d).inp 000726653.td-b3lyp_6-31g+(d).log.xz

000726653.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726653.td-b3lyp_6-31+g(d).gjf (generated)

000726653.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726653.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726653.mol 000726653.PUBCHEM 000726653.mol (via Jmol)
000726655.b3lyp_6-31g(d).inp

000726655.b3lyp_6-31g(d).qchem.inp (generated)

000726655.b3lyp_6-31g(d).gjf (generated)

000726655.b3lyp_6-31g(d).firefly.inp (generated)

000726655.b3lyp_6-31g(d).smash.inp (generated)

000726655.b3lyp_6-31g(d).nwchem.inp (generated) 000726655.b3lyp_6-31g(d).log.xz 000726655.td-b3lyp_6-31g+(d).inp 000726655.td-b3lyp_6-31g+(d).log.xz

000726655.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726655.td-b3lyp_6-31+g(d).gjf (generated)

000726655.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726655.mol 000726655.PUBCHEM 000726655.mol (via Jmol)
000726659.b3lyp_6-31g(d).inp

000726659.b3lyp_6-31g(d).qchem.inp (generated)

000726659.b3lyp_6-31g(d).gjf (generated)

000726659.b3lyp_6-31g(d).firefly.inp (generated)

000726659.b3lyp_6-31g(d).smash.inp (generated)

000726659.b3lyp_6-31g(d).nwchem.inp (generated) 000726659.b3lyp_6-31g(d).log.xz 000726659.td-b3lyp_6-31g+(d).inp 000726659.td-b3lyp_6-31g+(d).log.xz

000726659.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726659.td-b3lyp_6-31+g(d).gjf (generated)

000726659.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726659.mol 000726659.PUBCHEM 000726659.mol (via Jmol)
000726670.b3lyp_6-31g(d).inp

000726670.b3lyp_6-31g(d).qchem.inp (generated)

000726670.b3lyp_6-31g(d).gjf (generated)

000726670.b3lyp_6-31g(d).firefly.inp (generated)

000726670.b3lyp_6-31g(d).smash.inp (generated)

000726670.b3lyp_6-31g(d).nwchem.inp (generated) 000726670.b3lyp_6-31g(d).log.xz 000726670.td-b3lyp_6-31g+(d).inp 000726670.td-b3lyp_6-31g+(d).log.xz

000726670.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726670.td-b3lyp_6-31+g(d).gjf (generated)

000726670.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726670.mol 000726670.PUBCHEM 000726670.mol (via Jmol)
000726673.b3lyp_6-31g(d).inp

000726673.b3lyp_6-31g(d).qchem.inp (generated)

000726673.b3lyp_6-31g(d).gjf (generated)

000726673.b3lyp_6-31g(d).firefly.inp (generated)

000726673.b3lyp_6-31g(d).smash.inp (generated)

000726673.b3lyp_6-31g(d).nwchem.inp (generated) 000726673.b3lyp_6-31g(d).log.xz 000726673.td-b3lyp_6-31g+(d).inp 000726673.td-b3lyp_6-31g+(d).log.xz

000726673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726673.td-b3lyp_6-31+g(d).gjf (generated)

000726673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726673.mol 000726673.PUBCHEM 000726673.mol (via Jmol)
000726674.b3lyp_6-31g(d).inp

000726674.b3lyp_6-31g(d).qchem.inp (generated)

000726674.b3lyp_6-31g(d).gjf (generated)

000726674.b3lyp_6-31g(d).firefly.inp (generated)

000726674.b3lyp_6-31g(d).smash.inp (generated)

000726674.b3lyp_6-31g(d).nwchem.inp (generated) 000726674.b3lyp_6-31g(d).log.xz 000726674.td-b3lyp_6-31g+(d).inp 000726674.td-b3lyp_6-31g+(d).log.xz

000726674.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726674.td-b3lyp_6-31+g(d).gjf (generated)

000726674.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726674.mol 000726674.PUBCHEM 000726674.mol (via Jmol)
000726676.b3lyp_6-31g(d).inp

000726676.b3lyp_6-31g(d).qchem.inp (generated)

000726676.b3lyp_6-31g(d).gjf (generated)

000726676.b3lyp_6-31g(d).firefly.inp (generated)

000726676.b3lyp_6-31g(d).smash.inp (generated)

000726676.b3lyp_6-31g(d).nwchem.inp (generated) 000726676.b3lyp_6-31g(d).log.xz 000726676.td-b3lyp_6-31g+(d).inp 000726676.td-b3lyp_6-31g+(d).log.xz

000726676.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726676.td-b3lyp_6-31+g(d).gjf (generated)

000726676.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726676.mol 000726676.PUBCHEM 000726676.mol (via Jmol)
000726678.b3lyp_6-31g(d).inp

000726678.b3lyp_6-31g(d).qchem.inp (generated)

000726678.b3lyp_6-31g(d).gjf (generated)

000726678.b3lyp_6-31g(d).firefly.inp (generated)

000726678.b3lyp_6-31g(d).smash.inp (generated)

000726678.b3lyp_6-31g(d).nwchem.inp (generated) 000726678.b3lyp_6-31g(d).log.xz 000726678.td-b3lyp_6-31g+(d).inp 000726678.td-b3lyp_6-31g+(d).log.xz

000726678.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726678.td-b3lyp_6-31+g(d).gjf (generated)

000726678.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726678.mol 000726678.PUBCHEM 000726678.mol (via Jmol)
000726680.b3lyp_6-31g(d).inp

000726680.b3lyp_6-31g(d).qchem.inp (generated)

000726680.b3lyp_6-31g(d).gjf (generated)

000726680.b3lyp_6-31g(d).firefly.inp (generated)

000726680.b3lyp_6-31g(d).smash.inp (generated)

000726680.b3lyp_6-31g(d).nwchem.inp (generated) 000726680.b3lyp_6-31g(d).log.xz 000726680.td-b3lyp_6-31g+(d).inp 000726680.td-b3lyp_6-31g+(d).log.xz

000726680.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726680.td-b3lyp_6-31+g(d).gjf (generated)

000726680.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726680.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726680.mol 000726680.PUBCHEM 000726680.mol (via Jmol)
000726693.b3lyp_6-31g(d).inp

000726693.b3lyp_6-31g(d).qchem.inp (generated)

000726693.b3lyp_6-31g(d).gjf (generated)

000726693.b3lyp_6-31g(d).firefly.inp (generated)

000726693.b3lyp_6-31g(d).smash.inp (generated)

000726693.b3lyp_6-31g(d).nwchem.inp (generated) 000726693.b3lyp_6-31g(d).log.xz 000726693.mol 000726693.PUBCHEM 000726693.mol (via Jmol)
000726694.b3lyp_6-31g(d).inp

000726694.b3lyp_6-31g(d).qchem.inp (generated)

000726694.b3lyp_6-31g(d).gjf (generated)

000726694.b3lyp_6-31g(d).firefly.inp (generated)

000726694.b3lyp_6-31g(d).smash.inp (generated)

000726694.b3lyp_6-31g(d).nwchem.inp (generated) 000726694.b3lyp_6-31g(d).log.xz 000726694.td-b3lyp_6-31g+(d).inp 000726694.td-b3lyp_6-31g+(d).log.xz

000726694.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726694.td-b3lyp_6-31+g(d).gjf (generated)

000726694.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726694.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726694.mol 000726694.PUBCHEM 000726694.mol (via Jmol)
000726711.b3lyp_6-31g(d).inp

000726711.b3lyp_6-31g(d).qchem.inp (generated)

000726711.b3lyp_6-31g(d).gjf (generated)

000726711.b3lyp_6-31g(d).firefly.inp (generated)

000726711.b3lyp_6-31g(d).smash.inp (generated)

000726711.b3lyp_6-31g(d).nwchem.inp (generated) 000726711.b3lyp_6-31g(d).log.xz 000726711.td-b3lyp_6-31g+(d).inp 000726711.td-b3lyp_6-31g+(d).log.xz

000726711.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726711.td-b3lyp_6-31+g(d).gjf (generated)

000726711.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726711.mol 000726711.PUBCHEM 000726711.mol (via Jmol)
000726735.b3lyp_6-31g(d).inp

000726735.b3lyp_6-31g(d).qchem.inp (generated)

000726735.b3lyp_6-31g(d).gjf (generated)

000726735.b3lyp_6-31g(d).firefly.inp (generated)

000726735.b3lyp_6-31g(d).smash.inp (generated)

000726735.b3lyp_6-31g(d).nwchem.inp (generated) 000726735.b3lyp_6-31g(d).log.xz 000726735.td-b3lyp_6-31g+(d).inp 000726735.td-b3lyp_6-31g+(d).log.xz

000726735.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726735.td-b3lyp_6-31+g(d).gjf (generated)

000726735.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726735.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726735.mol 000726735.PUBCHEM 000726735.mol (via Jmol)
000726748.b3lyp_6-31g(d).inp

000726748.b3lyp_6-31g(d).qchem.inp (generated)

000726748.b3lyp_6-31g(d).gjf (generated)

000726748.b3lyp_6-31g(d).firefly.inp (generated)

000726748.b3lyp_6-31g(d).smash.inp (generated)

000726748.b3lyp_6-31g(d).nwchem.inp (generated) 000726748.b3lyp_6-31g(d).log.xz 000726748.td-b3lyp_6-31g+(d).inp 000726748.td-b3lyp_6-31g+(d).log.xz

000726748.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726748.td-b3lyp_6-31+g(d).gjf (generated)

000726748.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726748.mol 000726748.PUBCHEM 000726748.mol (via Jmol)
000726797.b3lyp_6-31g(d).inp

000726797.b3lyp_6-31g(d).qchem.inp (generated)

000726797.b3lyp_6-31g(d).gjf (generated)

000726797.b3lyp_6-31g(d).firefly.inp (generated)

000726797.b3lyp_6-31g(d).smash.inp (generated)

000726797.b3lyp_6-31g(d).nwchem.inp (generated) 000726797.b3lyp_6-31g(d).log.xz 000726797.mol 000726797.PUBCHEM 000726797.mol (via Jmol)
000726798.b3lyp_6-31g(d).inp

000726798.b3lyp_6-31g(d).qchem.inp (generated)

000726798.b3lyp_6-31g(d).gjf (generated)

000726798.b3lyp_6-31g(d).firefly.inp (generated)

000726798.b3lyp_6-31g(d).smash.inp (generated)

000726798.b3lyp_6-31g(d).nwchem.inp (generated) 000726798.b3lyp_6-31g(d).log.xz 000726798.td-b3lyp_6-31g+(d).inp 000726798.td-b3lyp_6-31g+(d).log.xz

000726798.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726798.td-b3lyp_6-31+g(d).gjf (generated)

000726798.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726798.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726798.mol 000726798.PUBCHEM 000726798.mol (via Jmol)
000726804.b3lyp_6-31g(d).inp

000726804.b3lyp_6-31g(d).qchem.inp (generated)

000726804.b3lyp_6-31g(d).gjf (generated)

000726804.b3lyp_6-31g(d).firefly.inp (generated)

000726804.b3lyp_6-31g(d).smash.inp (generated)

000726804.b3lyp_6-31g(d).nwchem.inp (generated) 000726804.b3lyp_6-31g(d).log.xz 000726804.td-b3lyp_6-31g+(d).inp 000726804.td-b3lyp_6-31g+(d).log.xz

000726804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726804.td-b3lyp_6-31+g(d).gjf (generated)

000726804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726804.mol 000726804.PUBCHEM 000726804.mol (via Jmol)
000726805.b3lyp_6-31g(d).inp

000726805.b3lyp_6-31g(d).qchem.inp (generated)

000726805.b3lyp_6-31g(d).gjf (generated)

000726805.b3lyp_6-31g(d).firefly.inp (generated)

000726805.b3lyp_6-31g(d).smash.inp (generated)

000726805.b3lyp_6-31g(d).nwchem.inp (generated) 000726805.b3lyp_6-31g(d).log.xz 000726805.td-b3lyp_6-31g+(d).inp 000726805.td-b3lyp_6-31g+(d).log.xz

000726805.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726805.td-b3lyp_6-31+g(d).gjf (generated)

000726805.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726805.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726805.mol 000726805.PUBCHEM 000726805.mol (via Jmol)
000726806.b3lyp_6-31g(d).inp

000726806.b3lyp_6-31g(d).qchem.inp (generated)

000726806.b3lyp_6-31g(d).gjf (generated)

000726806.b3lyp_6-31g(d).firefly.inp (generated)

000726806.b3lyp_6-31g(d).smash.inp (generated)

000726806.b3lyp_6-31g(d).nwchem.inp (generated) 000726806.b3lyp_6-31g(d).log.xz 000726806.td-b3lyp_6-31g+(d).inp 000726806.td-b3lyp_6-31g+(d).log.xz

000726806.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726806.td-b3lyp_6-31+g(d).gjf (generated)

000726806.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726806.mol 000726806.PUBCHEM 000726806.mol (via Jmol)
000726807.b3lyp_6-31g(d).inp

000726807.b3lyp_6-31g(d).qchem.inp (generated)

000726807.b3lyp_6-31g(d).gjf (generated)

000726807.b3lyp_6-31g(d).firefly.inp (generated)

000726807.b3lyp_6-31g(d).smash.inp (generated)

000726807.b3lyp_6-31g(d).nwchem.inp (generated) 000726807.b3lyp_6-31g(d).log.xz 000726807.td-b3lyp_6-31g+(d).inp 000726807.td-b3lyp_6-31g+(d).log.xz

000726807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726807.td-b3lyp_6-31+g(d).gjf (generated)

000726807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726807.mol 000726807.PUBCHEM 000726807.mol (via Jmol)
000726808.b3lyp_6-31g(d).inp

000726808.b3lyp_6-31g(d).qchem.inp (generated)

000726808.b3lyp_6-31g(d).gjf (generated)

000726808.b3lyp_6-31g(d).firefly.inp (generated)

000726808.b3lyp_6-31g(d).smash.inp (generated)

000726808.b3lyp_6-31g(d).nwchem.inp (generated) 000726808.b3lyp_6-31g(d).log.xz 000726808.td-b3lyp_6-31g+(d).inp 000726808.td-b3lyp_6-31g+(d).log.xz

000726808.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726808.td-b3lyp_6-31+g(d).gjf (generated)

000726808.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726808.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726808.mol 000726808.PUBCHEM 000726808.mol (via Jmol)
000726809.b3lyp_6-31g(d).inp

000726809.b3lyp_6-31g(d).qchem.inp (generated)

000726809.b3lyp_6-31g(d).gjf (generated)

000726809.b3lyp_6-31g(d).firefly.inp (generated)

000726809.b3lyp_6-31g(d).smash.inp (generated)

000726809.b3lyp_6-31g(d).nwchem.inp (generated) 000726809.b3lyp_6-31g(d).log.xz 000726809.td-b3lyp_6-31g+(d).inp 000726809.td-b3lyp_6-31g+(d).log.xz

000726809.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726809.td-b3lyp_6-31+g(d).gjf (generated)

000726809.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726809.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726809.mol 000726809.PUBCHEM 000726809.mol (via Jmol)
000726810.b3lyp_6-31g(d).inp

000726810.b3lyp_6-31g(d).qchem.inp (generated)

000726810.b3lyp_6-31g(d).gjf (generated)

000726810.b3lyp_6-31g(d).firefly.inp (generated)

000726810.b3lyp_6-31g(d).smash.inp (generated)

000726810.b3lyp_6-31g(d).nwchem.inp (generated) 000726810.b3lyp_6-31g(d).log.xz 000726810.td-b3lyp_6-31g+(d).inp 000726810.td-b3lyp_6-31g+(d).log.xz

000726810.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726810.td-b3lyp_6-31+g(d).gjf (generated)

000726810.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726810.mol 000726810.PUBCHEM 000726810.mol (via Jmol)
000726812.b3lyp_6-31g(d).inp

000726812.b3lyp_6-31g(d).qchem.inp (generated)

000726812.b3lyp_6-31g(d).gjf (generated)

000726812.b3lyp_6-31g(d).firefly.inp (generated)

000726812.b3lyp_6-31g(d).smash.inp (generated)

000726812.b3lyp_6-31g(d).nwchem.inp (generated) 000726812.b3lyp_6-31g(d).log.xz 000726812.td-b3lyp_6-31g+(d).inp 000726812.td-b3lyp_6-31g+(d).log.xz

000726812.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726812.td-b3lyp_6-31+g(d).gjf (generated)

000726812.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726812.mol 000726812.PUBCHEM 000726812.mol (via Jmol)
000726820.b3lyp_6-31g(d).inp

000726820.b3lyp_6-31g(d).qchem.inp (generated)

000726820.b3lyp_6-31g(d).gjf (generated)

000726820.b3lyp_6-31g(d).firefly.inp (generated)

000726820.b3lyp_6-31g(d).smash.inp (generated)

000726820.b3lyp_6-31g(d).nwchem.inp (generated) 000726820.b3lyp_6-31g(d).log.xz 000726820.td-b3lyp_6-31g+(d).inp 000726820.td-b3lyp_6-31g+(d).log.xz

000726820.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726820.td-b3lyp_6-31+g(d).gjf (generated)

000726820.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726820.mol 000726820.PUBCHEM 000726820.mol (via Jmol)
000726821.b3lyp_6-31g(d).inp

000726821.b3lyp_6-31g(d).qchem.inp (generated)

000726821.b3lyp_6-31g(d).gjf (generated)

000726821.b3lyp_6-31g(d).firefly.inp (generated)

000726821.b3lyp_6-31g(d).smash.inp (generated)

000726821.b3lyp_6-31g(d).nwchem.inp (generated) 000726821.b3lyp_6-31g(d).log.xz 000726821.td-b3lyp_6-31g+(d).inp 000726821.td-b3lyp_6-31g+(d).log.xz

000726821.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726821.td-b3lyp_6-31+g(d).gjf (generated)

000726821.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726821.mol 000726821.PUBCHEM 000726821.mol (via Jmol)
000726833.b3lyp_6-31g(d).inp

000726833.b3lyp_6-31g(d).qchem.inp (generated)

000726833.b3lyp_6-31g(d).gjf (generated)

000726833.b3lyp_6-31g(d).firefly.inp (generated)

000726833.b3lyp_6-31g(d).smash.inp (generated)

000726833.b3lyp_6-31g(d).nwchem.inp (generated) 000726833.b3lyp_6-31g(d).log.xz 000726833.td-b3lyp_6-31g+(d).inp 000726833.td-b3lyp_6-31g+(d).log.xz

000726833.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726833.td-b3lyp_6-31+g(d).gjf (generated)

000726833.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726833.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726833.mol 000726833.PUBCHEM 000726833.mol (via Jmol)
000726835.b3lyp_6-31g(d).inp

000726835.b3lyp_6-31g(d).qchem.inp (generated)

000726835.b3lyp_6-31g(d).gjf (generated)

000726835.b3lyp_6-31g(d).firefly.inp (generated)

000726835.b3lyp_6-31g(d).smash.inp (generated)

000726835.b3lyp_6-31g(d).nwchem.inp (generated) 000726835.b3lyp_6-31g(d).log.xz 000726835.td-b3lyp_6-31g+(d).inp 000726835.td-b3lyp_6-31g+(d).log.xz

000726835.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726835.td-b3lyp_6-31+g(d).gjf (generated)

000726835.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726835.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726835.mol 000726835.PUBCHEM 000726835.mol (via Jmol)
000726845.b3lyp_6-31g(d).inp

000726845.b3lyp_6-31g(d).qchem.inp (generated)

000726845.b3lyp_6-31g(d).gjf (generated)

000726845.b3lyp_6-31g(d).firefly.inp (generated)

000726845.b3lyp_6-31g(d).smash.inp (generated)

000726845.b3lyp_6-31g(d).nwchem.inp (generated) 000726845.b3lyp_6-31g(d).log.xz 000726845.mol 000726845.PUBCHEM 000726845.mol (via Jmol)
000726854.b3lyp_6-31g(d).inp

000726854.b3lyp_6-31g(d).qchem.inp (generated)

000726854.b3lyp_6-31g(d).gjf (generated)

000726854.b3lyp_6-31g(d).firefly.inp (generated)

000726854.b3lyp_6-31g(d).smash.inp (generated)

000726854.b3lyp_6-31g(d).nwchem.inp (generated) 000726854.b3lyp_6-31g(d).log.xz 000726854.td-b3lyp_6-31g+(d).inp 000726854.td-b3lyp_6-31g+(d).log.xz

000726854.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726854.td-b3lyp_6-31+g(d).gjf (generated)

000726854.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726854.mol 000726854.PUBCHEM 000726854.mol (via Jmol)
000726856.b3lyp_6-31g(d).inp

000726856.b3lyp_6-31g(d).qchem.inp (generated)

000726856.b3lyp_6-31g(d).gjf (generated)

000726856.b3lyp_6-31g(d).firefly.inp (generated)

000726856.b3lyp_6-31g(d).smash.inp (generated)

000726856.b3lyp_6-31g(d).nwchem.inp (generated) 000726856.b3lyp_6-31g(d).log.xz 000726856.td-b3lyp_6-31g+(d).inp 000726856.td-b3lyp_6-31g+(d).log.xz

000726856.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726856.td-b3lyp_6-31+g(d).gjf (generated)

000726856.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726856.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726856.mol 000726856.PUBCHEM 000726856.mol (via Jmol)
000726857.b3lyp_6-31g(d).inp

000726857.b3lyp_6-31g(d).qchem.inp (generated)

000726857.b3lyp_6-31g(d).gjf (generated)

000726857.b3lyp_6-31g(d).firefly.inp (generated)

000726857.b3lyp_6-31g(d).smash.inp (generated)

000726857.b3lyp_6-31g(d).nwchem.inp (generated) 000726857.b3lyp_6-31g(d).log.xz 000726857.td-b3lyp_6-31g+(d).inp 000726857.td-b3lyp_6-31g+(d).log.xz

000726857.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726857.td-b3lyp_6-31+g(d).gjf (generated)

000726857.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726857.mol 000726857.PUBCHEM 000726857.mol (via Jmol)
000726858.b3lyp_6-31g(d).inp

000726858.b3lyp_6-31g(d).qchem.inp (generated)

000726858.b3lyp_6-31g(d).gjf (generated)

000726858.b3lyp_6-31g(d).firefly.inp (generated)

000726858.b3lyp_6-31g(d).smash.inp (generated)

000726858.b3lyp_6-31g(d).nwchem.inp (generated) 000726858.b3lyp_6-31g(d).log.xz 000726858.td-b3lyp_6-31g+(d).inp 000726858.td-b3lyp_6-31g+(d).log.xz

000726858.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726858.td-b3lyp_6-31+g(d).gjf (generated)

000726858.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726858.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726858.mol 000726858.PUBCHEM 000726858.mol (via Jmol)
000726870.b3lyp_6-31g(d).inp

000726870.b3lyp_6-31g(d).qchem.inp (generated)

000726870.b3lyp_6-31g(d).gjf (generated)

000726870.b3lyp_6-31g(d).firefly.inp (generated)

000726870.b3lyp_6-31g(d).smash.inp (generated)

000726870.b3lyp_6-31g(d).nwchem.inp (generated) 000726870.b3lyp_6-31g(d).log.xz 000726870.td-b3lyp_6-31g+(d).inp 000726870.td-b3lyp_6-31g+(d).log.xz

000726870.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726870.td-b3lyp_6-31+g(d).gjf (generated)

000726870.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726870.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726870.mol 000726870.PUBCHEM 000726870.mol (via Jmol)
000726884.b3lyp_6-31g(d).inp

000726884.b3lyp_6-31g(d).qchem.inp (generated)

000726884.b3lyp_6-31g(d).gjf (generated)

000726884.b3lyp_6-31g(d).firefly.inp (generated)

000726884.b3lyp_6-31g(d).smash.inp (generated)

000726884.b3lyp_6-31g(d).nwchem.inp (generated) 000726884.b3lyp_6-31g(d).log.xz 000726884.td-b3lyp_6-31g+(d).inp 000726884.td-b3lyp_6-31g+(d).log.xz

000726884.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726884.td-b3lyp_6-31+g(d).gjf (generated)

000726884.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726884.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726884.mol 000726884.PUBCHEM 000726884.mol (via Jmol)
000726895.b3lyp_6-31g(d).inp

000726895.b3lyp_6-31g(d).qchem.inp (generated)

000726895.b3lyp_6-31g(d).gjf (generated)

000726895.b3lyp_6-31g(d).firefly.inp (generated)

000726895.b3lyp_6-31g(d).smash.inp (generated)

000726895.b3lyp_6-31g(d).nwchem.inp (generated) 000726895.b3lyp_6-31g(d).log.xz 000726895.td-b3lyp_6-31g+(d).inp 000726895.td-b3lyp_6-31g+(d).log.xz

000726895.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726895.td-b3lyp_6-31+g(d).gjf (generated)

000726895.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726895.mol 000726895.PUBCHEM 000726895.mol (via Jmol)
000726902.b3lyp_6-31g(d).inp

000726902.b3lyp_6-31g(d).qchem.inp (generated)

000726902.b3lyp_6-31g(d).gjf (generated)

000726902.b3lyp_6-31g(d).firefly.inp (generated)

000726902.b3lyp_6-31g(d).smash.inp (generated)

000726902.b3lyp_6-31g(d).nwchem.inp (generated) 000726902.b3lyp_6-31g(d).log.xz 000726902.td-b3lyp_6-31g+(d).inp 000726902.td-b3lyp_6-31g+(d).log.xz

000726902.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726902.td-b3lyp_6-31+g(d).gjf (generated)

000726902.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726902.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726902.mol 000726902.PUBCHEM 000726902.mol (via Jmol)
000726904.b3lyp_6-31g(d).inp

000726904.b3lyp_6-31g(d).qchem.inp (generated)

000726904.b3lyp_6-31g(d).gjf (generated)

000726904.b3lyp_6-31g(d).firefly.inp (generated)

000726904.b3lyp_6-31g(d).smash.inp (generated)

000726904.b3lyp_6-31g(d).nwchem.inp (generated) 000726904.b3lyp_6-31g(d).log.xz 000726904.td-b3lyp_6-31g+(d).inp 000726904.td-b3lyp_6-31g+(d).log.xz

000726904.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726904.td-b3lyp_6-31+g(d).gjf (generated)

000726904.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726904.mol 000726904.PUBCHEM 000726904.mol (via Jmol)
000726912.b3lyp_6-31g(d).inp

000726912.b3lyp_6-31g(d).qchem.inp (generated)

000726912.b3lyp_6-31g(d).gjf (generated)

000726912.b3lyp_6-31g(d).firefly.inp (generated)

000726912.b3lyp_6-31g(d).smash.inp (generated)

000726912.b3lyp_6-31g(d).nwchem.inp (generated) 000726912.b3lyp_6-31g(d).log.xz 000726912.td-b3lyp_6-31g+(d).inp 000726912.td-b3lyp_6-31g+(d).log.xz

000726912.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726912.td-b3lyp_6-31+g(d).gjf (generated)

000726912.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726912.mol 000726912.PUBCHEM 000726912.mol (via Jmol)
000726930.b3lyp_6-31g(d).inp

000726930.b3lyp_6-31g(d).qchem.inp (generated)

000726930.b3lyp_6-31g(d).gjf (generated)

000726930.b3lyp_6-31g(d).firefly.inp (generated)

000726930.b3lyp_6-31g(d).smash.inp (generated)

000726930.b3lyp_6-31g(d).nwchem.inp (generated) 000726930.b3lyp_6-31g(d).log.xz 000726930.td-b3lyp_6-31g+(d).inp 000726930.td-b3lyp_6-31g+(d).log.xz

000726930.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726930.td-b3lyp_6-31+g(d).gjf (generated)

000726930.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726930.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726930.mol 000726930.PUBCHEM 000726930.mol (via Jmol)
000726938.b3lyp_6-31g(d).inp

000726938.b3lyp_6-31g(d).qchem.inp (generated)

000726938.b3lyp_6-31g(d).gjf (generated)

000726938.b3lyp_6-31g(d).firefly.inp (generated)

000726938.b3lyp_6-31g(d).smash.inp (generated)

000726938.b3lyp_6-31g(d).nwchem.inp (generated) 000726938.b3lyp_6-31g(d).log.xz 000726938.td-b3lyp_6-31g+(d).inp 000726938.td-b3lyp_6-31g+(d).log.xz

000726938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726938.td-b3lyp_6-31+g(d).gjf (generated)

000726938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726938.mol 000726938.PUBCHEM 000726938.mol (via Jmol)
000726944.b3lyp_6-31g(d).inp

000726944.b3lyp_6-31g(d).qchem.inp (generated)

000726944.b3lyp_6-31g(d).gjf (generated)

000726944.b3lyp_6-31g(d).firefly.inp (generated)

000726944.b3lyp_6-31g(d).smash.inp (generated)

000726944.b3lyp_6-31g(d).nwchem.inp (generated) 000726944.b3lyp_6-31g(d).log.xz 000726944.td-b3lyp_6-31g+(d).inp 000726944.td-b3lyp_6-31g+(d).log.xz

000726944.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726944.td-b3lyp_6-31+g(d).gjf (generated)

000726944.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726944.mol 000726944.PUBCHEM 000726944.mol (via Jmol)
000726947.b3lyp_6-31g(d).inp

000726947.b3lyp_6-31g(d).qchem.inp (generated)

000726947.b3lyp_6-31g(d).gjf (generated)

000726947.b3lyp_6-31g(d).firefly.inp (generated)

000726947.b3lyp_6-31g(d).smash.inp (generated)

000726947.b3lyp_6-31g(d).nwchem.inp (generated) 000726947.b3lyp_6-31g(d).log.xz 000726947.td-b3lyp_6-31g+(d).inp 000726947.td-b3lyp_6-31g+(d).log.xz

000726947.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726947.td-b3lyp_6-31+g(d).gjf (generated)

000726947.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726947.mol 000726947.PUBCHEM 000726947.mol (via Jmol)
000726995.b3lyp_6-31g(d).inp

000726995.b3lyp_6-31g(d).qchem.inp (generated)

000726995.b3lyp_6-31g(d).gjf (generated)

000726995.b3lyp_6-31g(d).firefly.inp (generated)

000726995.b3lyp_6-31g(d).smash.inp (generated)

000726995.b3lyp_6-31g(d).nwchem.inp (generated) 000726995.b3lyp_6-31g(d).log.xz 000726995.td-b3lyp_6-31g+(d).inp 000726995.td-b3lyp_6-31g+(d).log.xz

000726995.td-b3lyp_6-31+g(d).qchem.inp (generated)

000726995.td-b3lyp_6-31+g(d).gjf (generated)

000726995.td-b3lyp_6-31+g(d).firefly.inp (generated)

000726995.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000726995.mol 000726995.PUBCHEM 000726995.mol (via Jmol)
000727001.b3lyp_6-31g(d).inp

000727001.b3lyp_6-31g(d).qchem.inp (generated)

000727001.b3lyp_6-31g(d).gjf (generated)

000727001.b3lyp_6-31g(d).firefly.inp (generated)

000727001.b3lyp_6-31g(d).smash.inp (generated)

000727001.b3lyp_6-31g(d).nwchem.inp (generated) 000727001.b3lyp_6-31g(d).log.xz 000727001.td-b3lyp_6-31g+(d).inp 000727001.td-b3lyp_6-31g+(d).log.xz

000727001.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727001.td-b3lyp_6-31+g(d).gjf (generated)

000727001.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727001.mol 000727001.PUBCHEM 000727001.mol (via Jmol)
000727014.b3lyp_6-31g(d).inp

000727014.b3lyp_6-31g(d).qchem.inp (generated)

000727014.b3lyp_6-31g(d).gjf (generated)

000727014.b3lyp_6-31g(d).firefly.inp (generated)

000727014.b3lyp_6-31g(d).smash.inp (generated)

000727014.b3lyp_6-31g(d).nwchem.inp (generated) 000727014.b3lyp_6-31g(d).log.xz 000727014.td-b3lyp_6-31g+(d).inp 000727014.td-b3lyp_6-31g+(d).log.xz

000727014.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727014.td-b3lyp_6-31+g(d).gjf (generated)

000727014.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727014.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727014.mol 000727014.PUBCHEM 000727014.mol (via Jmol)
000727023.b3lyp_6-31g(d).inp

000727023.b3lyp_6-31g(d).qchem.inp (generated)

000727023.b3lyp_6-31g(d).gjf (generated)

000727023.b3lyp_6-31g(d).firefly.inp (generated)

000727023.b3lyp_6-31g(d).smash.inp (generated)

000727023.b3lyp_6-31g(d).nwchem.inp (generated) 000727023.b3lyp_6-31g(d).log.xz 000727023.td-b3lyp_6-31g+(d).inp 000727023.td-b3lyp_6-31g+(d).log.xz

000727023.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727023.td-b3lyp_6-31+g(d).gjf (generated)

000727023.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727023.mol 000727023.PUBCHEM 000727023.mol (via Jmol)
000727025.b3lyp_6-31g(d).inp

000727025.b3lyp_6-31g(d).qchem.inp (generated)

000727025.b3lyp_6-31g(d).gjf (generated)

000727025.b3lyp_6-31g(d).firefly.inp (generated)

000727025.b3lyp_6-31g(d).smash.inp (generated)

000727025.b3lyp_6-31g(d).nwchem.inp (generated) 000727025.b3lyp_6-31g(d).log.xz 000727025.td-b3lyp_6-31g+(d).inp 000727025.td-b3lyp_6-31g+(d).log.xz

000727025.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727025.td-b3lyp_6-31+g(d).gjf (generated)

000727025.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727025.mol 000727025.PUBCHEM 000727025.mol (via Jmol)
000727029.b3lyp_6-31g(d).inp

000727029.b3lyp_6-31g(d).qchem.inp (generated)

000727029.b3lyp_6-31g(d).gjf (generated)

000727029.b3lyp_6-31g(d).firefly.inp (generated)

000727029.b3lyp_6-31g(d).smash.inp (generated)

000727029.b3lyp_6-31g(d).nwchem.inp (generated) 000727029.b3lyp_6-31g(d).log.xz 000727029.td-b3lyp_6-31g+(d).inp 000727029.td-b3lyp_6-31g+(d).log.xz

000727029.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727029.td-b3lyp_6-31+g(d).gjf (generated)

000727029.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727029.mol 000727029.PUBCHEM 000727029.mol (via Jmol)
000727076.b3lyp_6-31g(d).inp

000727076.b3lyp_6-31g(d).qchem.inp (generated)

000727076.b3lyp_6-31g(d).gjf (generated)

000727076.b3lyp_6-31g(d).firefly.inp (generated)

000727076.b3lyp_6-31g(d).smash.inp (generated)

000727076.b3lyp_6-31g(d).nwchem.inp (generated) 000727076.b3lyp_6-31g(d).log.xz 000727076.mol 000727076.PUBCHEM 000727076.mol (via Jmol)
000727077.b3lyp_6-31g(d).inp

000727077.b3lyp_6-31g(d).qchem.inp (generated)

000727077.b3lyp_6-31g(d).gjf (generated)

000727077.b3lyp_6-31g(d).firefly.inp (generated)

000727077.b3lyp_6-31g(d).smash.inp (generated)

000727077.b3lyp_6-31g(d).nwchem.inp (generated) 000727077.b3lyp_6-31g(d).log.xz 000727077.mol 000727077.PUBCHEM 000727077.mol (via Jmol)
000727089.b3lyp_6-31g(d).inp

000727089.b3lyp_6-31g(d).qchem.inp (generated)

000727089.b3lyp_6-31g(d).gjf (generated)

000727089.b3lyp_6-31g(d).firefly.inp (generated)

000727089.b3lyp_6-31g(d).smash.inp (generated)

000727089.b3lyp_6-31g(d).nwchem.inp (generated) 000727089.b3lyp_6-31g(d).log.xz 000727089.td-b3lyp_6-31g+(d).inp 000727089.td-b3lyp_6-31g+(d).log.xz

000727089.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727089.td-b3lyp_6-31+g(d).gjf (generated)

000727089.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727089.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727089.mol 000727089.PUBCHEM 000727089.mol (via Jmol)
000727117.b3lyp_6-31g(d).inp

000727117.b3lyp_6-31g(d).qchem.inp (generated)

000727117.b3lyp_6-31g(d).gjf (generated)

000727117.b3lyp_6-31g(d).firefly.inp (generated)

000727117.b3lyp_6-31g(d).smash.inp (generated)

000727117.b3lyp_6-31g(d).nwchem.inp (generated) 000727117.b3lyp_6-31g(d).log.xz 000727117.td-b3lyp_6-31g+(d).inp 000727117.td-b3lyp_6-31g+(d).log.xz

000727117.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727117.td-b3lyp_6-31+g(d).gjf (generated)

000727117.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727117.mol 000727117.PUBCHEM 000727117.mol (via Jmol)
000727132.b3lyp_6-31g(d).inp

000727132.b3lyp_6-31g(d).qchem.inp (generated)

000727132.b3lyp_6-31g(d).gjf (generated)

000727132.b3lyp_6-31g(d).firefly.inp (generated)

000727132.b3lyp_6-31g(d).smash.inp (generated)

000727132.b3lyp_6-31g(d).nwchem.inp (generated) 000727132.b3lyp_6-31g(d).log.xz 000727132.td-b3lyp_6-31g+(d).inp 000727132.td-b3lyp_6-31g+(d).log.xz

000727132.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727132.td-b3lyp_6-31+g(d).gjf (generated)

000727132.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727132.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727132.mol 000727132.PUBCHEM 000727132.mol (via Jmol)
000727146.b3lyp_6-31g(d).inp

000727146.b3lyp_6-31g(d).qchem.inp (generated)

000727146.b3lyp_6-31g(d).gjf (generated)

000727146.b3lyp_6-31g(d).firefly.inp (generated)

000727146.b3lyp_6-31g(d).smash.inp (generated)

000727146.b3lyp_6-31g(d).nwchem.inp (generated) 000727146.b3lyp_6-31g(d).log.xz 000727146.mol 000727146.PUBCHEM 000727146.mol (via Jmol)
000727147.b3lyp_6-31g(d).inp

000727147.b3lyp_6-31g(d).qchem.inp (generated)

000727147.b3lyp_6-31g(d).gjf (generated)

000727147.b3lyp_6-31g(d).firefly.inp (generated)

000727147.b3lyp_6-31g(d).smash.inp (generated)

000727147.b3lyp_6-31g(d).nwchem.inp (generated) 000727147.b3lyp_6-31g(d).log.xz 000727147.mol 000727147.PUBCHEM 000727147.mol (via Jmol)
000727200.b3lyp_6-31g(d).inp

000727200.b3lyp_6-31g(d).qchem.inp (generated)

000727200.b3lyp_6-31g(d).gjf (generated)

000727200.b3lyp_6-31g(d).firefly.inp (generated)

000727200.b3lyp_6-31g(d).smash.inp (generated)

000727200.b3lyp_6-31g(d).nwchem.inp (generated) 000727200.b3lyp_6-31g(d).log.xz 000727200.td-b3lyp_6-31g+(d).inp 000727200.td-b3lyp_6-31g+(d).log.xz

000727200.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727200.td-b3lyp_6-31+g(d).gjf (generated)

000727200.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727200.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727200.mol 000727200.PUBCHEM 000727200.mol (via Jmol)
000727203.b3lyp_6-31g(d).inp

000727203.b3lyp_6-31g(d).qchem.inp (generated)

000727203.b3lyp_6-31g(d).gjf (generated)

000727203.b3lyp_6-31g(d).firefly.inp (generated)

000727203.b3lyp_6-31g(d).smash.inp (generated)

000727203.b3lyp_6-31g(d).nwchem.inp (generated) 000727203.b3lyp_6-31g(d).log.xz 000727203.td-b3lyp_6-31g+(d).inp 000727203.td-b3lyp_6-31g+(d).log.xz

000727203.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727203.td-b3lyp_6-31+g(d).gjf (generated)

000727203.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727203.mol 000727203.PUBCHEM 000727203.mol (via Jmol)
000727211.b3lyp_6-31g(d).inp

000727211.b3lyp_6-31g(d).qchem.inp (generated)

000727211.b3lyp_6-31g(d).gjf (generated)

000727211.b3lyp_6-31g(d).firefly.inp (generated)

000727211.b3lyp_6-31g(d).smash.inp (generated)

000727211.b3lyp_6-31g(d).nwchem.inp (generated) 000727211.b3lyp_6-31g(d).log.xz 000727211.td-b3lyp_6-31g+(d).inp 000727211.td-b3lyp_6-31g+(d).log.xz

000727211.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727211.td-b3lyp_6-31+g(d).gjf (generated)

000727211.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727211.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727211.mol 000727211.PUBCHEM 000727211.mol (via Jmol)
000727213.b3lyp_6-31g(d).inp

000727213.b3lyp_6-31g(d).qchem.inp (generated)

000727213.b3lyp_6-31g(d).gjf (generated)

000727213.b3lyp_6-31g(d).firefly.inp (generated)

000727213.b3lyp_6-31g(d).smash.inp (generated)

000727213.b3lyp_6-31g(d).nwchem.inp (generated) 000727213.b3lyp_6-31g(d).log.xz 000727213.mol 000727213.PUBCHEM 000727213.mol (via Jmol)
000727221.b3lyp_6-31g(d).inp

000727221.b3lyp_6-31g(d).qchem.inp (generated)

000727221.b3lyp_6-31g(d).gjf (generated)

000727221.b3lyp_6-31g(d).firefly.inp (generated)

000727221.b3lyp_6-31g(d).smash.inp (generated)

000727221.b3lyp_6-31g(d).nwchem.inp (generated) 000727221.b3lyp_6-31g(d).log.xz 000727221.td-b3lyp_6-31g+(d).inp 000727221.td-b3lyp_6-31g+(d).log.xz

000727221.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727221.td-b3lyp_6-31+g(d).gjf (generated)

000727221.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727221.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727221.mol 000727221.PUBCHEM 000727221.mol (via Jmol)
000727223.b3lyp_6-31g(d).inp

000727223.b3lyp_6-31g(d).qchem.inp (generated)

000727223.b3lyp_6-31g(d).gjf (generated)

000727223.b3lyp_6-31g(d).firefly.inp (generated)

000727223.b3lyp_6-31g(d).smash.inp (generated)

000727223.b3lyp_6-31g(d).nwchem.inp (generated) 000727223.b3lyp_6-31g(d).log.xz 000727223.td-b3lyp_6-31g+(d).inp 000727223.td-b3lyp_6-31g+(d).log.xz

000727223.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727223.td-b3lyp_6-31+g(d).gjf (generated)

000727223.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727223.mol 000727223.PUBCHEM 000727223.mol (via Jmol)
000727224.b3lyp_6-31g(d).inp

000727224.b3lyp_6-31g(d).qchem.inp (generated)

000727224.b3lyp_6-31g(d).gjf (generated)

000727224.b3lyp_6-31g(d).firefly.inp (generated)

000727224.b3lyp_6-31g(d).smash.inp (generated)

000727224.b3lyp_6-31g(d).nwchem.inp (generated) 000727224.b3lyp_6-31g(d).log.xz 000727224.td-b3lyp_6-31g+(d).inp 000727224.td-b3lyp_6-31g+(d).log.xz

000727224.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727224.td-b3lyp_6-31+g(d).gjf (generated)

000727224.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727224.mol 000727224.PUBCHEM 000727224.mol (via Jmol)
000727225.b3lyp_6-31g(d).inp

000727225.b3lyp_6-31g(d).qchem.inp (generated)

000727225.b3lyp_6-31g(d).gjf (generated)

000727225.b3lyp_6-31g(d).firefly.inp (generated)

000727225.b3lyp_6-31g(d).smash.inp (generated)

000727225.b3lyp_6-31g(d).nwchem.inp (generated) 000727225.b3lyp_6-31g(d).log.xz 000727225.mol 000727225.PUBCHEM 000727225.mol (via Jmol)
000727228.b3lyp_6-31g(d).inp

000727228.b3lyp_6-31g(d).qchem.inp (generated)

000727228.b3lyp_6-31g(d).gjf (generated)

000727228.b3lyp_6-31g(d).firefly.inp (generated)

000727228.b3lyp_6-31g(d).smash.inp (generated)

000727228.b3lyp_6-31g(d).nwchem.inp (generated) 000727228.b3lyp_6-31g(d).log.xz 000727228.td-b3lyp_6-31g+(d).inp 000727228.td-b3lyp_6-31g+(d).log.xz

000727228.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727228.td-b3lyp_6-31+g(d).gjf (generated)

000727228.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727228.mol 000727228.PUBCHEM 000727228.mol (via Jmol)
000727229.b3lyp_6-31g(d).inp

000727229.b3lyp_6-31g(d).qchem.inp (generated)

000727229.b3lyp_6-31g(d).gjf (generated)

000727229.b3lyp_6-31g(d).firefly.inp (generated)

000727229.b3lyp_6-31g(d).smash.inp (generated)

000727229.b3lyp_6-31g(d).nwchem.inp (generated) 000727229.b3lyp_6-31g(d).log.xz 000727229.mol 000727229.PUBCHEM 000727229.mol (via Jmol)
000727235.b3lyp_6-31g(d).inp

000727235.b3lyp_6-31g(d).qchem.inp (generated)

000727235.b3lyp_6-31g(d).gjf (generated)

000727235.b3lyp_6-31g(d).firefly.inp (generated)

000727235.b3lyp_6-31g(d).smash.inp (generated)

000727235.b3lyp_6-31g(d).nwchem.inp (generated) 000727235.b3lyp_6-31g(d).log.xz 000727235.mol 000727235.PUBCHEM 000727235.mol (via Jmol)
000727236.b3lyp_6-31g(d).inp

000727236.b3lyp_6-31g(d).qchem.inp (generated)

000727236.b3lyp_6-31g(d).gjf (generated)

000727236.b3lyp_6-31g(d).firefly.inp (generated)

000727236.b3lyp_6-31g(d).smash.inp (generated)

000727236.b3lyp_6-31g(d).nwchem.inp (generated) 000727236.b3lyp_6-31g(d).log.xz 000727236.td-b3lyp_6-31g+(d).inp 000727236.td-b3lyp_6-31g+(d).log.xz

000727236.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727236.td-b3lyp_6-31+g(d).gjf (generated)

000727236.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727236.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727236.mol 000727236.PUBCHEM 000727236.mol (via Jmol)
000727237.b3lyp_6-31g(d).inp

000727237.b3lyp_6-31g(d).qchem.inp (generated)

000727237.b3lyp_6-31g(d).gjf (generated)

000727237.b3lyp_6-31g(d).firefly.inp (generated)

000727237.b3lyp_6-31g(d).smash.inp (generated)

000727237.b3lyp_6-31g(d).nwchem.inp (generated) 000727237.b3lyp_6-31g(d).log.xz 000727237.td-b3lyp_6-31g+(d).inp 000727237.td-b3lyp_6-31g+(d).log.xz

000727237.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727237.td-b3lyp_6-31+g(d).gjf (generated)

000727237.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727237.mol 000727237.PUBCHEM 000727237.mol (via Jmol)
000727239.b3lyp_6-31g(d).inp

000727239.b3lyp_6-31g(d).qchem.inp (generated)

000727239.b3lyp_6-31g(d).gjf (generated)

000727239.b3lyp_6-31g(d).firefly.inp (generated)

000727239.b3lyp_6-31g(d).smash.inp (generated)

000727239.b3lyp_6-31g(d).nwchem.inp (generated) 000727239.b3lyp_6-31g(d).log.xz 000727239.td-b3lyp_6-31g+(d).inp 000727239.td-b3lyp_6-31g+(d).log.xz

000727239.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727239.td-b3lyp_6-31+g(d).gjf (generated)

000727239.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727239.mol 000727239.PUBCHEM 000727239.mol (via Jmol)
000727240.b3lyp_6-31g(d).inp

000727240.b3lyp_6-31g(d).qchem.inp (generated)

000727240.b3lyp_6-31g(d).gjf (generated)

000727240.b3lyp_6-31g(d).firefly.inp (generated)

000727240.b3lyp_6-31g(d).smash.inp (generated)

000727240.b3lyp_6-31g(d).nwchem.inp (generated) 000727240.b3lyp_6-31g(d).log.xz 000727240.td-b3lyp_6-31g+(d).inp 000727240.td-b3lyp_6-31g+(d).log.xz

000727240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727240.td-b3lyp_6-31+g(d).gjf (generated)

000727240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727240.mol 000727240.PUBCHEM 000727240.mol (via Jmol)
000727243.b3lyp_6-31g(d).inp

000727243.b3lyp_6-31g(d).qchem.inp (generated)

000727243.b3lyp_6-31g(d).gjf (generated)

000727243.b3lyp_6-31g(d).firefly.inp (generated)

000727243.b3lyp_6-31g(d).smash.inp (generated)

000727243.b3lyp_6-31g(d).nwchem.inp (generated) 000727243.b3lyp_6-31g(d).log.xz 000727243.td-b3lyp_6-31g+(d).inp 000727243.td-b3lyp_6-31g+(d).log.xz

000727243.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727243.td-b3lyp_6-31+g(d).gjf (generated)

000727243.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727243.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727243.mol 000727243.PUBCHEM 000727243.mol (via Jmol)
000727245.b3lyp_6-31g(d).inp

000727245.b3lyp_6-31g(d).qchem.inp (generated)

000727245.b3lyp_6-31g(d).gjf (generated)

000727245.b3lyp_6-31g(d).firefly.inp (generated)

000727245.b3lyp_6-31g(d).smash.inp (generated)

000727245.b3lyp_6-31g(d).nwchem.inp (generated) 000727245.b3lyp_6-31g(d).log.xz 000727245.td-b3lyp_6-31g+(d).inp 000727245.td-b3lyp_6-31g+(d).log.xz

000727245.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727245.td-b3lyp_6-31+g(d).gjf (generated)

000727245.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727245.mol 000727245.PUBCHEM 000727245.mol (via Jmol)
000727247.b3lyp_6-31g(d).inp

000727247.b3lyp_6-31g(d).qchem.inp (generated)

000727247.b3lyp_6-31g(d).gjf (generated)

000727247.b3lyp_6-31g(d).firefly.inp (generated)

000727247.b3lyp_6-31g(d).smash.inp (generated)

000727247.b3lyp_6-31g(d).nwchem.inp (generated) 000727247.b3lyp_6-31g(d).log.xz 000727247.td-b3lyp_6-31g+(d).inp 000727247.td-b3lyp_6-31g+(d).log.xz

000727247.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727247.td-b3lyp_6-31+g(d).gjf (generated)

000727247.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727247.mol 000727247.PUBCHEM 000727247.mol (via Jmol)
000727250.b3lyp_6-31g(d).inp

000727250.b3lyp_6-31g(d).qchem.inp (generated)

000727250.b3lyp_6-31g(d).gjf (generated)

000727250.b3lyp_6-31g(d).firefly.inp (generated)

000727250.b3lyp_6-31g(d).smash.inp (generated)

000727250.b3lyp_6-31g(d).nwchem.inp (generated) 000727250.b3lyp_6-31g(d).log.xz 000727250.td-b3lyp_6-31g+(d).inp 000727250.td-b3lyp_6-31g+(d).log.xz

000727250.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727250.td-b3lyp_6-31+g(d).gjf (generated)

000727250.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727250.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727250.mol 000727250.PUBCHEM 000727250.mol (via Jmol)
000727261.b3lyp_6-31g(d).inp

000727261.b3lyp_6-31g(d).qchem.inp (generated)

000727261.b3lyp_6-31g(d).gjf (generated)

000727261.b3lyp_6-31g(d).firefly.inp (generated)

000727261.b3lyp_6-31g(d).smash.inp (generated)

000727261.b3lyp_6-31g(d).nwchem.inp (generated) 000727261.b3lyp_6-31g(d).log.xz 000727261.mol 000727261.PUBCHEM 000727261.mol (via Jmol)
000727265.b3lyp_6-31g(d).inp

000727265.b3lyp_6-31g(d).qchem.inp (generated)

000727265.b3lyp_6-31g(d).gjf (generated)

000727265.b3lyp_6-31g(d).firefly.inp (generated)

000727265.b3lyp_6-31g(d).smash.inp (generated)

000727265.b3lyp_6-31g(d).nwchem.inp (generated) 000727265.b3lyp_6-31g(d).log.xz 000727265.mol 000727265.PUBCHEM 000727265.mol (via Jmol)
000727267.b3lyp_6-31g(d).inp

000727267.b3lyp_6-31g(d).qchem.inp (generated)

000727267.b3lyp_6-31g(d).gjf (generated)

000727267.b3lyp_6-31g(d).firefly.inp (generated)

000727267.b3lyp_6-31g(d).smash.inp (generated)

000727267.b3lyp_6-31g(d).nwchem.inp (generated) 000727267.b3lyp_6-31g(d).log.xz 000727267.mol 000727267.PUBCHEM 000727267.mol (via Jmol)
000727295.b3lyp_6-31g(d).inp

000727295.b3lyp_6-31g(d).qchem.inp (generated)

000727295.b3lyp_6-31g(d).gjf (generated)

000727295.b3lyp_6-31g(d).firefly.inp (generated)

000727295.b3lyp_6-31g(d).smash.inp (generated)

000727295.b3lyp_6-31g(d).nwchem.inp (generated) 000727295.b3lyp_6-31g(d).log.xz 000727295.td-b3lyp_6-31g+(d).inp 000727295.td-b3lyp_6-31g+(d).log.xz

000727295.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727295.td-b3lyp_6-31+g(d).gjf (generated)

000727295.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727295.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727295.mol 000727295.PUBCHEM 000727295.mol (via Jmol)
000727371.b3lyp_6-31g(d).inp

000727371.b3lyp_6-31g(d).qchem.inp (generated)

000727371.b3lyp_6-31g(d).gjf (generated)

000727371.b3lyp_6-31g(d).firefly.inp (generated)

000727371.b3lyp_6-31g(d).smash.inp (generated)

000727371.b3lyp_6-31g(d).nwchem.inp (generated) 000727371.b3lyp_6-31g(d).log.xz 000727371.td-b3lyp_6-31g+(d).inp 000727371.td-b3lyp_6-31g+(d).log.xz

000727371.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727371.td-b3lyp_6-31+g(d).gjf (generated)

000727371.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727371.mol 000727371.PUBCHEM 000727371.mol (via Jmol)
000727382.b3lyp_6-31g(d).inp

000727382.b3lyp_6-31g(d).qchem.inp (generated)

000727382.b3lyp_6-31g(d).gjf (generated)

000727382.b3lyp_6-31g(d).firefly.inp (generated)

000727382.b3lyp_6-31g(d).smash.inp (generated)

000727382.b3lyp_6-31g(d).nwchem.inp (generated) 000727382.b3lyp_6-31g(d).log.xz 000727382.td-b3lyp_6-31g+(d).inp 000727382.td-b3lyp_6-31g+(d).log.xz

000727382.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727382.td-b3lyp_6-31+g(d).gjf (generated)

000727382.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727382.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727382.mol 000727382.PUBCHEM 000727382.mol (via Jmol)
000727435.b3lyp_6-31g(d).inp

000727435.b3lyp_6-31g(d).qchem.inp (generated)

000727435.b3lyp_6-31g(d).gjf (generated)

000727435.b3lyp_6-31g(d).firefly.inp (generated)

000727435.b3lyp_6-31g(d).smash.inp (generated)

000727435.b3lyp_6-31g(d).nwchem.inp (generated) 000727435.b3lyp_6-31g(d).log.xz 000727435.td-b3lyp_6-31g+(d).inp 000727435.td-b3lyp_6-31g+(d).log.xz

000727435.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727435.td-b3lyp_6-31+g(d).gjf (generated)

000727435.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727435.mol 000727435.PUBCHEM 000727435.mol (via Jmol)
000727514.b3lyp_6-31g(d).inp

000727514.b3lyp_6-31g(d).qchem.inp (generated)

000727514.b3lyp_6-31g(d).gjf (generated)

000727514.b3lyp_6-31g(d).firefly.inp (generated)

000727514.b3lyp_6-31g(d).smash.inp (generated)

000727514.b3lyp_6-31g(d).nwchem.inp (generated) 000727514.b3lyp_6-31g(d).log.xz 000727514.td-b3lyp_6-31g+(d).inp 000727514.td-b3lyp_6-31g+(d).log.xz

000727514.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727514.td-b3lyp_6-31+g(d).gjf (generated)

000727514.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727514.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727514.mol 000727514.PUBCHEM 000727514.mol (via Jmol)
000727560.b3lyp_6-31g(d).inp

000727560.b3lyp_6-31g(d).qchem.inp (generated)

000727560.b3lyp_6-31g(d).gjf (generated)

000727560.b3lyp_6-31g(d).firefly.inp (generated)

000727560.b3lyp_6-31g(d).smash.inp (generated)

000727560.b3lyp_6-31g(d).nwchem.inp (generated) 000727560.b3lyp_6-31g(d).log.xz 000727560.td-b3lyp_6-31g+(d).inp 000727560.td-b3lyp_6-31g+(d).log.xz

000727560.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727560.td-b3lyp_6-31+g(d).gjf (generated)

000727560.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727560.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727560.mol 000727560.PUBCHEM 000727560.mol (via Jmol)
000727563.b3lyp_6-31g(d).inp

000727563.b3lyp_6-31g(d).qchem.inp (generated)

000727563.b3lyp_6-31g(d).gjf (generated)

000727563.b3lyp_6-31g(d).firefly.inp (generated)

000727563.b3lyp_6-31g(d).smash.inp (generated)

000727563.b3lyp_6-31g(d).nwchem.inp (generated) 000727563.b3lyp_6-31g(d).log.xz 000727563.td-b3lyp_6-31g+(d).inp 000727563.td-b3lyp_6-31g+(d).log.xz

000727563.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727563.td-b3lyp_6-31+g(d).gjf (generated)

000727563.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727563.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727563.mol 000727563.PUBCHEM 000727563.mol (via Jmol)
000727570.b3lyp_6-31g(d).inp

000727570.b3lyp_6-31g(d).qchem.inp (generated)

000727570.b3lyp_6-31g(d).gjf (generated)

000727570.b3lyp_6-31g(d).firefly.inp (generated)

000727570.b3lyp_6-31g(d).smash.inp (generated)

000727570.b3lyp_6-31g(d).nwchem.inp (generated) 000727570.b3lyp_6-31g(d).log.xz 000727570.mol 000727570.PUBCHEM 000727570.mol (via Jmol)
000727580.b3lyp_6-31g(d).inp

000727580.b3lyp_6-31g(d).qchem.inp (generated)

000727580.b3lyp_6-31g(d).gjf (generated)

000727580.b3lyp_6-31g(d).firefly.inp (generated)

000727580.b3lyp_6-31g(d).smash.inp (generated)

000727580.b3lyp_6-31g(d).nwchem.inp (generated) 000727580.b3lyp_6-31g(d).log.xz 000727580.mol 000727580.PUBCHEM 000727580.mol (via Jmol)
000727654.b3lyp_6-31g(d).inp

000727654.b3lyp_6-31g(d).qchem.inp (generated)

000727654.b3lyp_6-31g(d).gjf (generated)

000727654.b3lyp_6-31g(d).firefly.inp (generated)

000727654.b3lyp_6-31g(d).smash.inp (generated)

000727654.b3lyp_6-31g(d).nwchem.inp (generated) 000727654.b3lyp_6-31g(d).log.xz 000727654.td-b3lyp_6-31g+(d).inp 000727654.td-b3lyp_6-31g+(d).log.xz

000727654.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727654.td-b3lyp_6-31+g(d).gjf (generated)

000727654.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727654.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727654.mol 000727654.PUBCHEM 000727654.mol (via Jmol)
000727660.b3lyp_6-31g(d).inp

000727660.b3lyp_6-31g(d).qchem.inp (generated)

000727660.b3lyp_6-31g(d).gjf (generated)

000727660.b3lyp_6-31g(d).firefly.inp (generated)

000727660.b3lyp_6-31g(d).smash.inp (generated)

000727660.b3lyp_6-31g(d).nwchem.inp (generated) 000727660.b3lyp_6-31g(d).log.xz 000727660.mol 000727660.PUBCHEM 000727660.mol (via Jmol)
000727713.b3lyp_6-31g(d).inp

000727713.b3lyp_6-31g(d).qchem.inp (generated)

000727713.b3lyp_6-31g(d).gjf (generated)

000727713.b3lyp_6-31g(d).firefly.inp (generated)

000727713.b3lyp_6-31g(d).smash.inp (generated)

000727713.b3lyp_6-31g(d).nwchem.inp (generated) 000727713.b3lyp_6-31g(d).log.xz 000727713.td-b3lyp_6-31g+(d).inp 000727713.td-b3lyp_6-31g+(d).log.xz

000727713.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727713.td-b3lyp_6-31+g(d).gjf (generated)

000727713.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727713.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727713.mol 000727713.PUBCHEM 000727713.mol (via Jmol)
000727724.b3lyp_6-31g(d).inp

000727724.b3lyp_6-31g(d).qchem.inp (generated)

000727724.b3lyp_6-31g(d).gjf (generated)

000727724.b3lyp_6-31g(d).firefly.inp (generated)

000727724.b3lyp_6-31g(d).smash.inp (generated)

000727724.b3lyp_6-31g(d).nwchem.inp (generated) 000727724.b3lyp_6-31g(d).log.xz 000727724.mol 000727724.PUBCHEM 000727724.mol (via Jmol)
000727728.b3lyp_6-31g(d).inp

000727728.b3lyp_6-31g(d).qchem.inp (generated)

000727728.b3lyp_6-31g(d).gjf (generated)

000727728.b3lyp_6-31g(d).firefly.inp (generated)

000727728.b3lyp_6-31g(d).smash.inp (generated)

000727728.b3lyp_6-31g(d).nwchem.inp (generated) 000727728.b3lyp_6-31g(d).log.xz 000727728.td-b3lyp_6-31g+(d).inp 000727728.td-b3lyp_6-31g+(d).log.xz

000727728.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727728.td-b3lyp_6-31+g(d).gjf (generated)

000727728.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727728.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727728.mol 000727728.PUBCHEM 000727728.mol (via Jmol)
000727729.b3lyp_6-31g(d).inp

000727729.b3lyp_6-31g(d).qchem.inp (generated)

000727729.b3lyp_6-31g(d).gjf (generated)

000727729.b3lyp_6-31g(d).firefly.inp (generated)

000727729.b3lyp_6-31g(d).smash.inp (generated)

000727729.b3lyp_6-31g(d).nwchem.inp (generated) 000727729.b3lyp_6-31g(d).log.xz 000727729.td-b3lyp_6-31g+(d).inp 000727729.td-b3lyp_6-31g+(d).log.xz

000727729.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727729.td-b3lyp_6-31+g(d).gjf (generated)

000727729.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727729.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727729.mol 000727729.PUBCHEM 000727729.mol (via Jmol)
000727730.b3lyp_6-31g(d).inp

000727730.b3lyp_6-31g(d).qchem.inp (generated)

000727730.b3lyp_6-31g(d).gjf (generated)

000727730.b3lyp_6-31g(d).firefly.inp (generated)

000727730.b3lyp_6-31g(d).smash.inp (generated)

000727730.b3lyp_6-31g(d).nwchem.inp (generated) 000727730.b3lyp_6-31g(d).log.xz 000727730.td-b3lyp_6-31g+(d).inp 000727730.td-b3lyp_6-31g+(d).log.xz

000727730.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727730.td-b3lyp_6-31+g(d).gjf (generated)

000727730.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727730.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727730.mol 000727730.PUBCHEM 000727730.mol (via Jmol)
000727731.b3lyp_6-31g(d).inp

000727731.b3lyp_6-31g(d).qchem.inp (generated)

000727731.b3lyp_6-31g(d).gjf (generated)

000727731.b3lyp_6-31g(d).firefly.inp (generated)

000727731.b3lyp_6-31g(d).smash.inp (generated)

000727731.b3lyp_6-31g(d).nwchem.inp (generated) 000727731.b3lyp_6-31g(d).log.xz 000727731.td-b3lyp_6-31g+(d).inp 000727731.td-b3lyp_6-31g+(d).log.xz

000727731.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727731.td-b3lyp_6-31+g(d).gjf (generated)

000727731.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727731.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727731.mol 000727731.PUBCHEM 000727731.mol (via Jmol)
000727732.b3lyp_6-31g(d).inp

000727732.b3lyp_6-31g(d).qchem.inp (generated)

000727732.b3lyp_6-31g(d).gjf (generated)

000727732.b3lyp_6-31g(d).firefly.inp (generated)

000727732.b3lyp_6-31g(d).smash.inp (generated)

000727732.b3lyp_6-31g(d).nwchem.inp (generated) 000727732.b3lyp_6-31g(d).log.xz 000727732.td-b3lyp_6-31g+(d).inp 000727732.td-b3lyp_6-31g+(d).log.xz

000727732.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727732.td-b3lyp_6-31+g(d).gjf (generated)

000727732.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727732.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727732.mol 000727732.PUBCHEM 000727732.mol (via Jmol)
000727738.b3lyp_6-31g(d).inp

000727738.b3lyp_6-31g(d).qchem.inp (generated)

000727738.b3lyp_6-31g(d).gjf (generated)

000727738.b3lyp_6-31g(d).firefly.inp (generated)

000727738.b3lyp_6-31g(d).smash.inp (generated)

000727738.b3lyp_6-31g(d).nwchem.inp (generated) 000727738.b3lyp_6-31g(d).log.xz 000727738.td-b3lyp_6-31g+(d).inp 000727738.td-b3lyp_6-31g+(d).log.xz

000727738.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727738.td-b3lyp_6-31+g(d).gjf (generated)

000727738.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727738.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727738.mol 000727738.PUBCHEM 000727738.mol (via Jmol)
000727745.b3lyp_6-31g(d).inp

000727745.b3lyp_6-31g(d).qchem.inp (generated)

000727745.b3lyp_6-31g(d).gjf (generated)

000727745.b3lyp_6-31g(d).firefly.inp (generated)

000727745.b3lyp_6-31g(d).smash.inp (generated)

000727745.b3lyp_6-31g(d).nwchem.inp (generated) 000727745.b3lyp_6-31g(d).log.xz 000727745.mol 000727745.PUBCHEM 000727745.mol (via Jmol)
000727746.b3lyp_6-31g(d).inp

000727746.b3lyp_6-31g(d).qchem.inp (generated)

000727746.b3lyp_6-31g(d).gjf (generated)

000727746.b3lyp_6-31g(d).firefly.inp (generated)

000727746.b3lyp_6-31g(d).smash.inp (generated)

000727746.b3lyp_6-31g(d).nwchem.inp (generated) 000727746.b3lyp_6-31g(d).log.xz 000727746.td-b3lyp_6-31g+(d).inp 000727746.td-b3lyp_6-31g+(d).log.xz

000727746.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727746.td-b3lyp_6-31+g(d).gjf (generated)

000727746.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727746.mol 000727746.PUBCHEM 000727746.mol (via Jmol)
000727747.b3lyp_6-31g(d).inp

000727747.b3lyp_6-31g(d).qchem.inp (generated)

000727747.b3lyp_6-31g(d).gjf (generated)

000727747.b3lyp_6-31g(d).firefly.inp (generated)

000727747.b3lyp_6-31g(d).smash.inp (generated)

000727747.b3lyp_6-31g(d).nwchem.inp (generated) 000727747.b3lyp_6-31g(d).log.xz 000727747.td-b3lyp_6-31g+(d).inp 000727747.td-b3lyp_6-31g+(d).log.xz

000727747.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727747.td-b3lyp_6-31+g(d).gjf (generated)

000727747.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727747.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727747.mol 000727747.PUBCHEM 000727747.mol (via Jmol)
000727748.b3lyp_6-31g(d).inp

000727748.b3lyp_6-31g(d).qchem.inp (generated)

000727748.b3lyp_6-31g(d).gjf (generated)

000727748.b3lyp_6-31g(d).firefly.inp (generated)

000727748.b3lyp_6-31g(d).smash.inp (generated)

000727748.b3lyp_6-31g(d).nwchem.inp (generated) 000727748.b3lyp_6-31g(d).log.xz 000727748.td-b3lyp_6-31g+(d).inp 000727748.td-b3lyp_6-31g+(d).log.xz

000727748.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727748.td-b3lyp_6-31+g(d).gjf (generated)

000727748.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727748.mol 000727748.PUBCHEM 000727748.mol (via Jmol)
000727749.b3lyp_6-31g(d).inp

000727749.b3lyp_6-31g(d).qchem.inp (generated)

000727749.b3lyp_6-31g(d).gjf (generated)

000727749.b3lyp_6-31g(d).firefly.inp (generated)

000727749.b3lyp_6-31g(d).smash.inp (generated)

000727749.b3lyp_6-31g(d).nwchem.inp (generated) 000727749.b3lyp_6-31g(d).log.xz 000727749.td-b3lyp_6-31g+(d).inp 000727749.td-b3lyp_6-31g+(d).log.xz

000727749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727749.td-b3lyp_6-31+g(d).gjf (generated)

000727749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727749.mol 000727749.PUBCHEM 000727749.mol (via Jmol)
000727752.b3lyp_6-31g(d).inp

000727752.b3lyp_6-31g(d).qchem.inp (generated)

000727752.b3lyp_6-31g(d).gjf (generated)

000727752.b3lyp_6-31g(d).firefly.inp (generated)

000727752.b3lyp_6-31g(d).smash.inp (generated)

000727752.b3lyp_6-31g(d).nwchem.inp (generated) 000727752.b3lyp_6-31g(d).log.xz 000727752.mol 000727752.PUBCHEM 000727752.mol (via Jmol)
000727753.b3lyp_6-31g(d).inp

000727753.b3lyp_6-31g(d).qchem.inp (generated)

000727753.b3lyp_6-31g(d).gjf (generated)

000727753.b3lyp_6-31g(d).firefly.inp (generated)

000727753.b3lyp_6-31g(d).smash.inp (generated)

000727753.b3lyp_6-31g(d).nwchem.inp (generated) 000727753.b3lyp_6-31g(d).log.xz 000727753.mol 000727753.PUBCHEM 000727753.mol (via Jmol)
000727755.b3lyp_6-31g(d).inp

000727755.b3lyp_6-31g(d).qchem.inp (generated)

000727755.b3lyp_6-31g(d).gjf (generated)

000727755.b3lyp_6-31g(d).firefly.inp (generated)

000727755.b3lyp_6-31g(d).smash.inp (generated)

000727755.b3lyp_6-31g(d).nwchem.inp (generated) 000727755.b3lyp_6-31g(d).log.xz 000727755.td-b3lyp_6-31g+(d).inp 000727755.td-b3lyp_6-31g+(d).log.xz

000727755.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727755.td-b3lyp_6-31+g(d).gjf (generated)

000727755.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727755.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727755.mol 000727755.PUBCHEM 000727755.mol (via Jmol)
000727756.b3lyp_6-31g(d).inp

000727756.b3lyp_6-31g(d).qchem.inp (generated)

000727756.b3lyp_6-31g(d).gjf (generated)

000727756.b3lyp_6-31g(d).firefly.inp (generated)

000727756.b3lyp_6-31g(d).smash.inp (generated)

000727756.b3lyp_6-31g(d).nwchem.inp (generated) 000727756.b3lyp_6-31g(d).log.xz 000727756.td-b3lyp_6-31g+(d).inp 000727756.td-b3lyp_6-31g+(d).log.xz

000727756.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727756.td-b3lyp_6-31+g(d).gjf (generated)

000727756.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727756.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727756.mol 000727756.PUBCHEM 000727756.mol (via Jmol)
000727758.b3lyp_6-31g(d).inp

000727758.b3lyp_6-31g(d).qchem.inp (generated)

000727758.b3lyp_6-31g(d).gjf (generated)

000727758.b3lyp_6-31g(d).firefly.inp (generated)

000727758.b3lyp_6-31g(d).smash.inp (generated)

000727758.b3lyp_6-31g(d).nwchem.inp (generated) 000727758.b3lyp_6-31g(d).log.xz 000727758.td-b3lyp_6-31g+(d).inp 000727758.td-b3lyp_6-31g+(d).log.xz

000727758.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727758.td-b3lyp_6-31+g(d).gjf (generated)

000727758.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727758.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727758.mol 000727758.PUBCHEM 000727758.mol (via Jmol)
000727759.b3lyp_6-31g(d).inp

000727759.b3lyp_6-31g(d).qchem.inp (generated)

000727759.b3lyp_6-31g(d).gjf (generated)

000727759.b3lyp_6-31g(d).firefly.inp (generated)

000727759.b3lyp_6-31g(d).smash.inp (generated)

000727759.b3lyp_6-31g(d).nwchem.inp (generated) 000727759.b3lyp_6-31g(d).log.xz 000727759.td-b3lyp_6-31g+(d).inp 000727759.td-b3lyp_6-31g+(d).log.xz

000727759.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727759.td-b3lyp_6-31+g(d).gjf (generated)

000727759.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727759.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727759.mol 000727759.PUBCHEM 000727759.mol (via Jmol)
000727761.b3lyp_6-31g(d).inp

000727761.b3lyp_6-31g(d).qchem.inp (generated)

000727761.b3lyp_6-31g(d).gjf (generated)

000727761.b3lyp_6-31g(d).firefly.inp (generated)

000727761.b3lyp_6-31g(d).smash.inp (generated)

000727761.b3lyp_6-31g(d).nwchem.inp (generated) 000727761.b3lyp_6-31g(d).log.xz 000727761.mol 000727761.PUBCHEM 000727761.mol (via Jmol)
000727762.b3lyp_6-31g(d).inp

000727762.b3lyp_6-31g(d).qchem.inp (generated)

000727762.b3lyp_6-31g(d).gjf (generated)

000727762.b3lyp_6-31g(d).firefly.inp (generated)

000727762.b3lyp_6-31g(d).smash.inp (generated)

000727762.b3lyp_6-31g(d).nwchem.inp (generated) 000727762.b3lyp_6-31g(d).log.xz 000727762.mol 000727762.PUBCHEM 000727762.mol (via Jmol)
000727764.b3lyp_6-31g(d).inp

000727764.b3lyp_6-31g(d).qchem.inp (generated)

000727764.b3lyp_6-31g(d).gjf (generated)

000727764.b3lyp_6-31g(d).firefly.inp (generated)

000727764.b3lyp_6-31g(d).smash.inp (generated)

000727764.b3lyp_6-31g(d).nwchem.inp (generated) 000727764.b3lyp_6-31g(d).log.xz 000727764.mol 000727764.PUBCHEM 000727764.mol (via Jmol)
000727791.b3lyp_6-31g(d).inp

000727791.b3lyp_6-31g(d).qchem.inp (generated)

000727791.b3lyp_6-31g(d).gjf (generated)

000727791.b3lyp_6-31g(d).firefly.inp (generated)

000727791.b3lyp_6-31g(d).smash.inp (generated)

000727791.b3lyp_6-31g(d).nwchem.inp (generated) 000727791.b3lyp_6-31g(d).log.xz 000727791.td-b3lyp_6-31g+(d).inp 000727791.td-b3lyp_6-31g+(d).log.xz

000727791.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727791.td-b3lyp_6-31+g(d).gjf (generated)

000727791.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727791.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727791.mol 000727791.PUBCHEM 000727791.mol (via Jmol)
000727804.b3lyp_6-31g(d).inp

000727804.b3lyp_6-31g(d).qchem.inp (generated)

000727804.b3lyp_6-31g(d).gjf (generated)

000727804.b3lyp_6-31g(d).firefly.inp (generated)

000727804.b3lyp_6-31g(d).smash.inp (generated)

000727804.b3lyp_6-31g(d).nwchem.inp (generated) 000727804.b3lyp_6-31g(d).log.xz 000727804.td-b3lyp_6-31g+(d).inp 000727804.td-b3lyp_6-31g+(d).log.xz

000727804.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727804.td-b3lyp_6-31+g(d).gjf (generated)

000727804.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727804.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727804.mol 000727804.PUBCHEM 000727804.mol (via Jmol)
000727834.b3lyp_6-31g(d).inp

000727834.b3lyp_6-31g(d).qchem.inp (generated)

000727834.b3lyp_6-31g(d).gjf (generated)

000727834.b3lyp_6-31g(d).firefly.inp (generated)

000727834.b3lyp_6-31g(d).smash.inp (generated)

000727834.b3lyp_6-31g(d).nwchem.inp (generated) 000727834.b3lyp_6-31g(d).log.xz 000727834.td-b3lyp_6-31g+(d).inp 000727834.td-b3lyp_6-31g+(d).log.xz

000727834.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727834.td-b3lyp_6-31+g(d).gjf (generated)

000727834.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727834.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727834.mol 000727834.PUBCHEM 000727834.mol (via Jmol)
000727836.b3lyp_6-31g(d).inp

000727836.b3lyp_6-31g(d).qchem.inp (generated)

000727836.b3lyp_6-31g(d).gjf (generated)

000727836.b3lyp_6-31g(d).firefly.inp (generated)

000727836.b3lyp_6-31g(d).smash.inp (generated)

000727836.b3lyp_6-31g(d).nwchem.inp (generated) 000727836.b3lyp_6-31g(d).log.xz 000727836.td-b3lyp_6-31g+(d).inp 000727836.td-b3lyp_6-31g+(d).log.xz

000727836.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727836.td-b3lyp_6-31+g(d).gjf (generated)

000727836.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727836.mol 000727836.PUBCHEM 000727836.mol (via Jmol)
000727844.b3lyp_6-31g(d).inp

000727844.b3lyp_6-31g(d).qchem.inp (generated)

000727844.b3lyp_6-31g(d).gjf (generated)

000727844.b3lyp_6-31g(d).firefly.inp (generated)

000727844.b3lyp_6-31g(d).smash.inp (generated)

000727844.b3lyp_6-31g(d).nwchem.inp (generated) 000727844.b3lyp_6-31g(d).log.xz 000727844.td-b3lyp_6-31g+(d).inp 000727844.td-b3lyp_6-31g+(d).log.xz

000727844.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727844.td-b3lyp_6-31+g(d).gjf (generated)

000727844.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727844.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727844.mol 000727844.PUBCHEM 000727844.mol (via Jmol)
000727847.b3lyp_6-31g(d).inp

000727847.b3lyp_6-31g(d).qchem.inp (generated)

000727847.b3lyp_6-31g(d).gjf (generated)

000727847.b3lyp_6-31g(d).firefly.inp (generated)

000727847.b3lyp_6-31g(d).smash.inp (generated)

000727847.b3lyp_6-31g(d).nwchem.inp (generated) 000727847.b3lyp_6-31g(d).log.xz 000727847.td-b3lyp_6-31g+(d).inp 000727847.td-b3lyp_6-31g+(d).log.xz

000727847.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727847.td-b3lyp_6-31+g(d).gjf (generated)

000727847.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727847.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727847.mol 000727847.PUBCHEM 000727847.mol (via Jmol)
000727848.b3lyp_6-31g(d).inp

000727848.b3lyp_6-31g(d).qchem.inp (generated)

000727848.b3lyp_6-31g(d).gjf (generated)

000727848.b3lyp_6-31g(d).firefly.inp (generated)

000727848.b3lyp_6-31g(d).smash.inp (generated)

000727848.b3lyp_6-31g(d).nwchem.inp (generated) 000727848.b3lyp_6-31g(d).log.xz 000727848.td-b3lyp_6-31g+(d).inp 000727848.td-b3lyp_6-31g+(d).log.xz

000727848.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727848.td-b3lyp_6-31+g(d).gjf (generated)

000727848.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727848.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727848.mol 000727848.PUBCHEM 000727848.mol (via Jmol)
000727868.b3lyp_6-31g(d).inp

000727868.b3lyp_6-31g(d).qchem.inp (generated)

000727868.b3lyp_6-31g(d).gjf (generated)

000727868.b3lyp_6-31g(d).firefly.inp (generated)

000727868.b3lyp_6-31g(d).smash.inp (generated)

000727868.b3lyp_6-31g(d).nwchem.inp (generated) 000727868.b3lyp_6-31g(d).log.xz 000727868.td-b3lyp_6-31g+(d).inp 000727868.td-b3lyp_6-31g+(d).log.xz

000727868.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727868.td-b3lyp_6-31+g(d).gjf (generated)

000727868.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727868.mol 000727868.PUBCHEM 000727868.mol (via Jmol)
000727869.b3lyp_6-31g(d).inp

000727869.b3lyp_6-31g(d).qchem.inp (generated)

000727869.b3lyp_6-31g(d).gjf (generated)

000727869.b3lyp_6-31g(d).firefly.inp (generated)

000727869.b3lyp_6-31g(d).smash.inp (generated)

000727869.b3lyp_6-31g(d).nwchem.inp (generated) 000727869.b3lyp_6-31g(d).log.xz 000727869.td-b3lyp_6-31g+(d).inp 000727869.td-b3lyp_6-31g+(d).log.xz

000727869.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727869.td-b3lyp_6-31+g(d).gjf (generated)

000727869.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727869.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727869.mol 000727869.PUBCHEM 000727869.mol (via Jmol)
000727871.b3lyp_6-31g(d).inp

000727871.b3lyp_6-31g(d).qchem.inp (generated)

000727871.b3lyp_6-31g(d).gjf (generated)

000727871.b3lyp_6-31g(d).firefly.inp (generated)

000727871.b3lyp_6-31g(d).smash.inp (generated)

000727871.b3lyp_6-31g(d).nwchem.inp (generated) 000727871.b3lyp_6-31g(d).log.xz 000727871.td-b3lyp_6-31g+(d).inp 000727871.td-b3lyp_6-31g+(d).log.xz

000727871.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727871.td-b3lyp_6-31+g(d).gjf (generated)

000727871.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727871.mol 000727871.PUBCHEM 000727871.mol (via Jmol)
000727879.b3lyp_6-31g(d).inp

000727879.b3lyp_6-31g(d).qchem.inp (generated)

000727879.b3lyp_6-31g(d).gjf (generated)

000727879.b3lyp_6-31g(d).firefly.inp (generated)

000727879.b3lyp_6-31g(d).smash.inp (generated)

000727879.b3lyp_6-31g(d).nwchem.inp (generated) 000727879.b3lyp_6-31g(d).log.xz 000727879.td-b3lyp_6-31g+(d).inp 000727879.td-b3lyp_6-31g+(d).log.xz

000727879.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727879.td-b3lyp_6-31+g(d).gjf (generated)

000727879.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727879.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727879.mol 000727879.PUBCHEM 000727879.mol (via Jmol)
000727880.b3lyp_6-31g(d).inp

000727880.b3lyp_6-31g(d).qchem.inp (generated)

000727880.b3lyp_6-31g(d).gjf (generated)

000727880.b3lyp_6-31g(d).firefly.inp (generated)

000727880.b3lyp_6-31g(d).smash.inp (generated)

000727880.b3lyp_6-31g(d).nwchem.inp (generated) 000727880.b3lyp_6-31g(d).log.xz 000727880.td-b3lyp_6-31g+(d).inp 000727880.td-b3lyp_6-31g+(d).log.xz

000727880.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727880.td-b3lyp_6-31+g(d).gjf (generated)

000727880.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727880.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727880.mol 000727880.PUBCHEM 000727880.mol (via Jmol)
000727888.b3lyp_6-31g(d).inp

000727888.b3lyp_6-31g(d).qchem.inp (generated)

000727888.b3lyp_6-31g(d).gjf (generated)

000727888.b3lyp_6-31g(d).firefly.inp (generated)

000727888.b3lyp_6-31g(d).smash.inp (generated)

000727888.b3lyp_6-31g(d).nwchem.inp (generated) 000727888.b3lyp_6-31g(d).log.xz 000727888.td-b3lyp_6-31g+(d).inp 000727888.td-b3lyp_6-31g+(d).log.xz

000727888.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727888.td-b3lyp_6-31+g(d).gjf (generated)

000727888.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727888.mol 000727888.PUBCHEM 000727888.mol (via Jmol)
000727889.b3lyp_6-31g(d).inp

000727889.b3lyp_6-31g(d).qchem.inp (generated)

000727889.b3lyp_6-31g(d).gjf (generated)

000727889.b3lyp_6-31g(d).firefly.inp (generated)

000727889.b3lyp_6-31g(d).smash.inp (generated)

000727889.b3lyp_6-31g(d).nwchem.inp (generated) 000727889.b3lyp_6-31g(d).log.xz 000727889.td-b3lyp_6-31g+(d).inp 000727889.td-b3lyp_6-31g+(d).log.xz

000727889.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727889.td-b3lyp_6-31+g(d).gjf (generated)

000727889.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727889.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727889.mol 000727889.PUBCHEM 000727889.mol (via Jmol)
000727938.b3lyp_6-31g(d).inp

000727938.b3lyp_6-31g(d).qchem.inp (generated)

000727938.b3lyp_6-31g(d).gjf (generated)

000727938.b3lyp_6-31g(d).firefly.inp (generated)

000727938.b3lyp_6-31g(d).smash.inp (generated)

000727938.b3lyp_6-31g(d).nwchem.inp (generated) 000727938.b3lyp_6-31g(d).log.xz 000727938.td-b3lyp_6-31g+(d).inp 000727938.td-b3lyp_6-31g+(d).log.xz

000727938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727938.td-b3lyp_6-31+g(d).gjf (generated)

000727938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727938.mol 000727938.PUBCHEM 000727938.mol (via Jmol)
000727958.b3lyp_6-31g(d).inp

000727958.b3lyp_6-31g(d).qchem.inp (generated)

000727958.b3lyp_6-31g(d).gjf (generated)

000727958.b3lyp_6-31g(d).firefly.inp (generated)

000727958.b3lyp_6-31g(d).smash.inp (generated)

000727958.b3lyp_6-31g(d).nwchem.inp (generated) 000727958.b3lyp_6-31g(d).log.xz 000727958.td-b3lyp_6-31g+(d).inp 000727958.td-b3lyp_6-31g+(d).log.xz

000727958.td-b3lyp_6-31+g(d).qchem.inp (generated)

000727958.td-b3lyp_6-31+g(d).gjf (generated)

000727958.td-b3lyp_6-31+g(d).firefly.inp (generated)

000727958.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000727958.mol 000727958.PUBCHEM 000727958.mol (via Jmol)
000728008.b3lyp_6-31g(d).inp

000728008.b3lyp_6-31g(d).qchem.inp (generated)

000728008.b3lyp_6-31g(d).gjf (generated)

000728008.b3lyp_6-31g(d).firefly.inp (generated)

000728008.b3lyp_6-31g(d).smash.inp (generated)

000728008.b3lyp_6-31g(d).nwchem.inp (generated) 000728008.b3lyp_6-31g(d).log.xz 000728008.td-b3lyp_6-31g+(d).inp 000728008.td-b3lyp_6-31g+(d).log.xz

000728008.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728008.td-b3lyp_6-31+g(d).gjf (generated)

000728008.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728008.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728008.mol 000728008.PUBCHEM 000728008.mol (via Jmol)
000728020.b3lyp_6-31g(d).inp

000728020.b3lyp_6-31g(d).qchem.inp (generated)

000728020.b3lyp_6-31g(d).gjf (generated)

000728020.b3lyp_6-31g(d).firefly.inp (generated)

000728020.b3lyp_6-31g(d).smash.inp (generated)

000728020.b3lyp_6-31g(d).nwchem.inp (generated) 000728020.b3lyp_6-31g(d).log.xz 000728020.td-b3lyp_6-31g+(d).inp 000728020.td-b3lyp_6-31g+(d).log.xz

000728020.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728020.td-b3lyp_6-31+g(d).gjf (generated)

000728020.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728020.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728020.mol 000728020.PUBCHEM 000728020.mol (via Jmol)
000728023.b3lyp_6-31g(d).inp

000728023.b3lyp_6-31g(d).qchem.inp (generated)

000728023.b3lyp_6-31g(d).gjf (generated)

000728023.b3lyp_6-31g(d).firefly.inp (generated)

000728023.b3lyp_6-31g(d).smash.inp (generated)

000728023.b3lyp_6-31g(d).nwchem.inp (generated) 000728023.b3lyp_6-31g(d).log.xz 000728023.td-b3lyp_6-31g+(d).inp 000728023.td-b3lyp_6-31g+(d).log.xz

000728023.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728023.td-b3lyp_6-31+g(d).gjf (generated)

000728023.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728023.mol 000728023.PUBCHEM 000728023.mol (via Jmol)
000728025.b3lyp_6-31g(d).inp

000728025.b3lyp_6-31g(d).qchem.inp (generated)

000728025.b3lyp_6-31g(d).gjf (generated)

000728025.b3lyp_6-31g(d).firefly.inp (generated)

000728025.b3lyp_6-31g(d).smash.inp (generated)

000728025.b3lyp_6-31g(d).nwchem.inp (generated) 000728025.b3lyp_6-31g(d).log.xz 000728025.td-b3lyp_6-31g+(d).inp 000728025.td-b3lyp_6-31g+(d).log.xz

000728025.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728025.td-b3lyp_6-31+g(d).gjf (generated)

000728025.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728025.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728025.mol 000728025.PUBCHEM 000728025.mol (via Jmol)
000728027.b3lyp_6-31g(d).inp

000728027.b3lyp_6-31g(d).qchem.inp (generated)

000728027.b3lyp_6-31g(d).gjf (generated)

000728027.b3lyp_6-31g(d).firefly.inp (generated)

000728027.b3lyp_6-31g(d).smash.inp (generated)

000728027.b3lyp_6-31g(d).nwchem.inp (generated) 000728027.b3lyp_6-31g(d).log.xz 000728027.td-b3lyp_6-31g+(d).inp 000728027.td-b3lyp_6-31g+(d).log.xz

000728027.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728027.td-b3lyp_6-31+g(d).gjf (generated)

000728027.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728027.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728027.mol 000728027.PUBCHEM 000728027.mol (via Jmol)
000728032.b3lyp_6-31g(d).inp

000728032.b3lyp_6-31g(d).qchem.inp (generated)

000728032.b3lyp_6-31g(d).gjf (generated)

000728032.b3lyp_6-31g(d).firefly.inp (generated)

000728032.b3lyp_6-31g(d).smash.inp (generated)

000728032.b3lyp_6-31g(d).nwchem.inp (generated) 000728032.b3lyp_6-31g(d).log.xz 000728032.mol 000728032.PUBCHEM 000728032.mol (via Jmol)
000728033.b3lyp_6-31g(d).inp

000728033.b3lyp_6-31g(d).qchem.inp (generated)

000728033.b3lyp_6-31g(d).gjf (generated)

000728033.b3lyp_6-31g(d).firefly.inp (generated)

000728033.b3lyp_6-31g(d).smash.inp (generated)

000728033.b3lyp_6-31g(d).nwchem.inp (generated) 000728033.b3lyp_6-31g(d).log.xz 000728033.mol 000728033.PUBCHEM 000728033.mol (via Jmol)
000728074.b3lyp_6-31g(d).inp

000728074.b3lyp_6-31g(d).qchem.inp (generated)

000728074.b3lyp_6-31g(d).gjf (generated)

000728074.b3lyp_6-31g(d).firefly.inp (generated)

000728074.b3lyp_6-31g(d).smash.inp (generated)

000728074.b3lyp_6-31g(d).nwchem.inp (generated) 000728074.b3lyp_6-31g(d).log.xz 000728074.td-b3lyp_6-31g+(d).inp 000728074.td-b3lyp_6-31g+(d).log.xz

000728074.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728074.td-b3lyp_6-31+g(d).gjf (generated)

000728074.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728074.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728074.mol 000728074.PUBCHEM 000728074.mol (via Jmol)
000728123.b3lyp_6-31g(d).inp

000728123.b3lyp_6-31g(d).qchem.inp (generated)

000728123.b3lyp_6-31g(d).gjf (generated)

000728123.b3lyp_6-31g(d).firefly.inp (generated)

000728123.b3lyp_6-31g(d).smash.inp (generated)

000728123.b3lyp_6-31g(d).nwchem.inp (generated) 000728123.b3lyp_6-31g(d).log.xz 000728123.td-b3lyp_6-31g+(d).inp 000728123.td-b3lyp_6-31g+(d).log.xz

000728123.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728123.td-b3lyp_6-31+g(d).gjf (generated)

000728123.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728123.mol 000728123.PUBCHEM 000728123.mol (via Jmol)
000728140.b3lyp_6-31g(d).inp

000728140.b3lyp_6-31g(d).qchem.inp (generated)

000728140.b3lyp_6-31g(d).gjf (generated)

000728140.b3lyp_6-31g(d).firefly.inp (generated)

000728140.b3lyp_6-31g(d).smash.inp (generated)

000728140.b3lyp_6-31g(d).nwchem.inp (generated) 000728140.b3lyp_6-31g(d).log.xz 000728140.mol 000728140.PUBCHEM 000728140.mol (via Jmol)
000728156.b3lyp_6-31g(d).inp

000728156.b3lyp_6-31g(d).qchem.inp (generated)

000728156.b3lyp_6-31g(d).gjf (generated)

000728156.b3lyp_6-31g(d).firefly.inp (generated)

000728156.b3lyp_6-31g(d).smash.inp (generated)

000728156.b3lyp_6-31g(d).nwchem.inp (generated) 000728156.b3lyp_6-31g(d).log.xz 000728156.td-b3lyp_6-31g+(d).inp 000728156.td-b3lyp_6-31g+(d).log.xz

000728156.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728156.td-b3lyp_6-31+g(d).gjf (generated)

000728156.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728156.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728156.mol 000728156.PUBCHEM 000728156.mol (via Jmol)
000728158.b3lyp_6-31g(d).inp

000728158.b3lyp_6-31g(d).qchem.inp (generated)

000728158.b3lyp_6-31g(d).gjf (generated)

000728158.b3lyp_6-31g(d).firefly.inp (generated)

000728158.b3lyp_6-31g(d).smash.inp (generated)

000728158.b3lyp_6-31g(d).nwchem.inp (generated) 000728158.b3lyp_6-31g(d).log.xz 000728158.td-b3lyp_6-31g+(d).inp 000728158.td-b3lyp_6-31g+(d).log.xz

000728158.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728158.td-b3lyp_6-31+g(d).gjf (generated)

000728158.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728158.mol 000728158.PUBCHEM 000728158.mol (via Jmol)
000728159.b3lyp_6-31g(d).inp

000728159.b3lyp_6-31g(d).qchem.inp (generated)

000728159.b3lyp_6-31g(d).gjf (generated)

000728159.b3lyp_6-31g(d).firefly.inp (generated)

000728159.b3lyp_6-31g(d).smash.inp (generated)

000728159.b3lyp_6-31g(d).nwchem.inp (generated) 000728159.b3lyp_6-31g(d).log.xz 000728159.td-b3lyp_6-31g+(d).inp 000728159.td-b3lyp_6-31g+(d).log.xz

000728159.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728159.td-b3lyp_6-31+g(d).gjf (generated)

000728159.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728159.mol 000728159.PUBCHEM 000728159.mol (via Jmol)
000728161.b3lyp_6-31g(d).inp

000728161.b3lyp_6-31g(d).qchem.inp (generated)

000728161.b3lyp_6-31g(d).gjf (generated)

000728161.b3lyp_6-31g(d).firefly.inp (generated)

000728161.b3lyp_6-31g(d).smash.inp (generated)

000728161.b3lyp_6-31g(d).nwchem.inp (generated) 000728161.b3lyp_6-31g(d).log.xz 000728161.td-b3lyp_6-31g+(d).inp 000728161.td-b3lyp_6-31g+(d).log.xz

000728161.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728161.td-b3lyp_6-31+g(d).gjf (generated)

000728161.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728161.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728161.mol 000728161.PUBCHEM 000728161.mol (via Jmol)
000728162.b3lyp_6-31g(d).inp

000728162.b3lyp_6-31g(d).qchem.inp (generated)

000728162.b3lyp_6-31g(d).gjf (generated)

000728162.b3lyp_6-31g(d).firefly.inp (generated)

000728162.b3lyp_6-31g(d).smash.inp (generated)

000728162.b3lyp_6-31g(d).nwchem.inp (generated) 000728162.b3lyp_6-31g(d).log.xz 000728162.td-b3lyp_6-31g+(d).inp 000728162.td-b3lyp_6-31g+(d).log.xz

000728162.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728162.td-b3lyp_6-31+g(d).gjf (generated)

000728162.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728162.mol 000728162.PUBCHEM 000728162.mol (via Jmol)
000728164.b3lyp_6-31g(d).inp

000728164.b3lyp_6-31g(d).qchem.inp (generated)

000728164.b3lyp_6-31g(d).gjf (generated)

000728164.b3lyp_6-31g(d).firefly.inp (generated)

000728164.b3lyp_6-31g(d).smash.inp (generated)

000728164.b3lyp_6-31g(d).nwchem.inp (generated) 000728164.b3lyp_6-31g(d).log.xz 000728164.td-b3lyp_6-31g+(d).inp 000728164.td-b3lyp_6-31g+(d).log.xz

000728164.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728164.td-b3lyp_6-31+g(d).gjf (generated)

000728164.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728164.mol 000728164.PUBCHEM 000728164.mol (via Jmol)
000728166.b3lyp_6-31g(d).inp

000728166.b3lyp_6-31g(d).qchem.inp (generated)

000728166.b3lyp_6-31g(d).gjf (generated)

000728166.b3lyp_6-31g(d).firefly.inp (generated)

000728166.b3lyp_6-31g(d).smash.inp (generated)

000728166.b3lyp_6-31g(d).nwchem.inp (generated) 000728166.b3lyp_6-31g(d).log.xz 000728166.td-b3lyp_6-31g+(d).inp 000728166.td-b3lyp_6-31g+(d).log.xz

000728166.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728166.td-b3lyp_6-31+g(d).gjf (generated)

000728166.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728166.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728166.mol 000728166.PUBCHEM 000728166.mol (via Jmol)
000728198.b3lyp_6-31g(d).inp

000728198.b3lyp_6-31g(d).qchem.inp (generated)

000728198.b3lyp_6-31g(d).gjf (generated)

000728198.b3lyp_6-31g(d).firefly.inp (generated)

000728198.b3lyp_6-31g(d).smash.inp (generated)

000728198.b3lyp_6-31g(d).nwchem.inp (generated) 000728198.b3lyp_6-31g(d).log.xz 000728198.td-b3lyp_6-31g+(d).inp 000728198.td-b3lyp_6-31g+(d).log.xz

000728198.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728198.td-b3lyp_6-31+g(d).gjf (generated)

000728198.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728198.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728198.mol 000728198.PUBCHEM 000728198.mol (via Jmol)
000728206.b3lyp_6-31g(d).inp

000728206.b3lyp_6-31g(d).qchem.inp (generated)

000728206.b3lyp_6-31g(d).gjf (generated)

000728206.b3lyp_6-31g(d).firefly.inp (generated)

000728206.b3lyp_6-31g(d).smash.inp (generated)

000728206.b3lyp_6-31g(d).nwchem.inp (generated) 000728206.b3lyp_6-31g(d).log.xz 000728206.td-b3lyp_6-31g+(d).inp 000728206.td-b3lyp_6-31g+(d).log.xz

000728206.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728206.td-b3lyp_6-31+g(d).gjf (generated)

000728206.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728206.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728206.mol 000728206.PUBCHEM 000728206.mol (via Jmol)
000728209.b3lyp_6-31g(d).inp

000728209.b3lyp_6-31g(d).qchem.inp (generated)

000728209.b3lyp_6-31g(d).gjf (generated)

000728209.b3lyp_6-31g(d).firefly.inp (generated)

000728209.b3lyp_6-31g(d).smash.inp (generated)

000728209.b3lyp_6-31g(d).nwchem.inp (generated) 000728209.b3lyp_6-31g(d).log.xz 000728209.td-b3lyp_6-31g+(d).inp 000728209.td-b3lyp_6-31g+(d).log.xz

000728209.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728209.td-b3lyp_6-31+g(d).gjf (generated)

000728209.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728209.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728209.mol 000728209.PUBCHEM 000728209.mol (via Jmol)
000728239.b3lyp_6-31g(d).inp

000728239.b3lyp_6-31g(d).qchem.inp (generated)

000728239.b3lyp_6-31g(d).gjf (generated)

000728239.b3lyp_6-31g(d).firefly.inp (generated)

000728239.b3lyp_6-31g(d).smash.inp (generated)

000728239.b3lyp_6-31g(d).nwchem.inp (generated) 000728239.b3lyp_6-31g(d).log.xz 000728239.td-b3lyp_6-31g+(d).inp 000728239.td-b3lyp_6-31g+(d).log.xz

000728239.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728239.td-b3lyp_6-31+g(d).gjf (generated)

000728239.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728239.mol 000728239.PUBCHEM 000728239.mol (via Jmol)
000728244.b3lyp_6-31g(d).inp

000728244.b3lyp_6-31g(d).qchem.inp (generated)

000728244.b3lyp_6-31g(d).gjf (generated)

000728244.b3lyp_6-31g(d).firefly.inp (generated)

000728244.b3lyp_6-31g(d).smash.inp (generated)

000728244.b3lyp_6-31g(d).nwchem.inp (generated) 000728244.b3lyp_6-31g(d).log.xz 000728244.td-b3lyp_6-31g+(d).inp 000728244.td-b3lyp_6-31g+(d).log.xz

000728244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728244.td-b3lyp_6-31+g(d).gjf (generated)

000728244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728244.mol 000728244.PUBCHEM 000728244.mol (via Jmol)
000728246.b3lyp_6-31g(d).inp

000728246.b3lyp_6-31g(d).qchem.inp (generated)

000728246.b3lyp_6-31g(d).gjf (generated)

000728246.b3lyp_6-31g(d).firefly.inp (generated)

000728246.b3lyp_6-31g(d).smash.inp (generated)

000728246.b3lyp_6-31g(d).nwchem.inp (generated) 000728246.b3lyp_6-31g(d).log.xz 000728246.td-b3lyp_6-31g+(d).inp 000728246.td-b3lyp_6-31g+(d).log.xz

000728246.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728246.td-b3lyp_6-31+g(d).gjf (generated)

000728246.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728246.mol 000728246.PUBCHEM 000728246.mol (via Jmol)
000728249.b3lyp_6-31g(d).inp

000728249.b3lyp_6-31g(d).qchem.inp (generated)

000728249.b3lyp_6-31g(d).gjf (generated)

000728249.b3lyp_6-31g(d).firefly.inp (generated)

000728249.b3lyp_6-31g(d).smash.inp (generated)

000728249.b3lyp_6-31g(d).nwchem.inp (generated) 000728249.b3lyp_6-31g(d).log.xz 000728249.td-b3lyp_6-31g+(d).inp 000728249.td-b3lyp_6-31g+(d).log.xz

000728249.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728249.td-b3lyp_6-31+g(d).gjf (generated)

000728249.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728249.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728249.mol 000728249.PUBCHEM 000728249.mol (via Jmol)
000728251.b3lyp_6-31g(d).inp

000728251.b3lyp_6-31g(d).qchem.inp (generated)

000728251.b3lyp_6-31g(d).gjf (generated)

000728251.b3lyp_6-31g(d).firefly.inp (generated)

000728251.b3lyp_6-31g(d).smash.inp (generated)

000728251.b3lyp_6-31g(d).nwchem.inp (generated) 000728251.b3lyp_6-31g(d).log.xz 000728251.td-b3lyp_6-31g+(d).inp 000728251.td-b3lyp_6-31g+(d).log.xz

000728251.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728251.td-b3lyp_6-31+g(d).gjf (generated)

000728251.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728251.mol 000728251.PUBCHEM 000728251.mol (via Jmol)
000728265.b3lyp_6-31g(d).inp

000728265.b3lyp_6-31g(d).qchem.inp (generated)

000728265.b3lyp_6-31g(d).gjf (generated)

000728265.b3lyp_6-31g(d).firefly.inp (generated)

000728265.b3lyp_6-31g(d).smash.inp (generated)

000728265.b3lyp_6-31g(d).nwchem.inp (generated) 000728265.b3lyp_6-31g(d).log.xz 000728265.td-b3lyp_6-31g+(d).inp 000728265.td-b3lyp_6-31g+(d).log.xz

000728265.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728265.td-b3lyp_6-31+g(d).gjf (generated)

000728265.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728265.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728265.mol 000728265.PUBCHEM 000728265.mol (via Jmol)
000728267.b3lyp_6-31g(d).inp

000728267.b3lyp_6-31g(d).qchem.inp (generated)

000728267.b3lyp_6-31g(d).gjf (generated)

000728267.b3lyp_6-31g(d).firefly.inp (generated)

000728267.b3lyp_6-31g(d).smash.inp (generated)

000728267.b3lyp_6-31g(d).nwchem.inp (generated) 000728267.b3lyp_6-31g(d).log.xz 000728267.td-b3lyp_6-31g+(d).inp 000728267.td-b3lyp_6-31g+(d).log.xz

000728267.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728267.td-b3lyp_6-31+g(d).gjf (generated)

000728267.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728267.mol 000728267.PUBCHEM 000728267.mol (via Jmol)
000728274.b3lyp_6-31g(d).inp

000728274.b3lyp_6-31g(d).qchem.inp (generated)

000728274.b3lyp_6-31g(d).gjf (generated)

000728274.b3lyp_6-31g(d).firefly.inp (generated)

000728274.b3lyp_6-31g(d).smash.inp (generated)

000728274.b3lyp_6-31g(d).nwchem.inp (generated) 000728274.b3lyp_6-31g(d).log.xz 000728274.td-b3lyp_6-31g+(d).inp 000728274.td-b3lyp_6-31g+(d).log.xz

000728274.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728274.td-b3lyp_6-31+g(d).gjf (generated)

000728274.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728274.mol 000728274.PUBCHEM 000728274.mol (via Jmol)
000728275.b3lyp_6-31g(d).inp

000728275.b3lyp_6-31g(d).qchem.inp (generated)

000728275.b3lyp_6-31g(d).gjf (generated)

000728275.b3lyp_6-31g(d).firefly.inp (generated)

000728275.b3lyp_6-31g(d).smash.inp (generated)

000728275.b3lyp_6-31g(d).nwchem.inp (generated) 000728275.b3lyp_6-31g(d).log.xz 000728275.td-b3lyp_6-31g+(d).inp 000728275.td-b3lyp_6-31g+(d).log.xz

000728275.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728275.td-b3lyp_6-31+g(d).gjf (generated)

000728275.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728275.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728275.mol 000728275.PUBCHEM 000728275.mol (via Jmol)
000728279.b3lyp_6-31g(d).inp

000728279.b3lyp_6-31g(d).qchem.inp (generated)

000728279.b3lyp_6-31g(d).gjf (generated)

000728279.b3lyp_6-31g(d).firefly.inp (generated)

000728279.b3lyp_6-31g(d).smash.inp (generated)

000728279.b3lyp_6-31g(d).nwchem.inp (generated) 000728279.b3lyp_6-31g(d).log.xz 000728279.td-b3lyp_6-31g+(d).inp 000728279.td-b3lyp_6-31g+(d).log.xz

000728279.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728279.td-b3lyp_6-31+g(d).gjf (generated)

000728279.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728279.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728279.mol 000728279.PUBCHEM 000728279.mol (via Jmol)
000728289.b3lyp_6-31g(d).inp

000728289.b3lyp_6-31g(d).qchem.inp (generated)

000728289.b3lyp_6-31g(d).gjf (generated)

000728289.b3lyp_6-31g(d).firefly.inp (generated)

000728289.b3lyp_6-31g(d).smash.inp (generated)

000728289.b3lyp_6-31g(d).nwchem.inp (generated) 000728289.b3lyp_6-31g(d).log.xz 000728289.td-b3lyp_6-31g+(d).inp 000728289.td-b3lyp_6-31g+(d).log.xz

000728289.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728289.td-b3lyp_6-31+g(d).gjf (generated)

000728289.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728289.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728289.mol 000728289.PUBCHEM 000728289.mol (via Jmol)
000728291.b3lyp_6-31g(d).inp

000728291.b3lyp_6-31g(d).qchem.inp (generated)

000728291.b3lyp_6-31g(d).gjf (generated)

000728291.b3lyp_6-31g(d).firefly.inp (generated)

000728291.b3lyp_6-31g(d).smash.inp (generated)

000728291.b3lyp_6-31g(d).nwchem.inp (generated) 000728291.b3lyp_6-31g(d).log.xz 000728291.td-b3lyp_6-31g+(d).inp 000728291.td-b3lyp_6-31g+(d).log.xz

000728291.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728291.td-b3lyp_6-31+g(d).gjf (generated)

000728291.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728291.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728291.mol 000728291.PUBCHEM 000728291.mol (via Jmol)
000728298.b3lyp_6-31g(d).inp

000728298.b3lyp_6-31g(d).qchem.inp (generated)

000728298.b3lyp_6-31g(d).gjf (generated)

000728298.b3lyp_6-31g(d).firefly.inp (generated)

000728298.b3lyp_6-31g(d).smash.inp (generated)

000728298.b3lyp_6-31g(d).nwchem.inp (generated) 000728298.b3lyp_6-31g(d).log.xz 000728298.td-b3lyp_6-31g+(d).inp 000728298.td-b3lyp_6-31g+(d).log.xz

000728298.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728298.td-b3lyp_6-31+g(d).gjf (generated)

000728298.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728298.mol 000728298.PUBCHEM 000728298.mol (via Jmol)
000728302.b3lyp_6-31g(d).inp

000728302.b3lyp_6-31g(d).qchem.inp (generated)

000728302.b3lyp_6-31g(d).gjf (generated)

000728302.b3lyp_6-31g(d).firefly.inp (generated)

000728302.b3lyp_6-31g(d).smash.inp (generated)

000728302.b3lyp_6-31g(d).nwchem.inp (generated) 000728302.b3lyp_6-31g(d).log.xz 000728302.td-b3lyp_6-31g+(d).inp 000728302.td-b3lyp_6-31g+(d).log.xz

000728302.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728302.td-b3lyp_6-31+g(d).gjf (generated)

000728302.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728302.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728302.mol 000728302.PUBCHEM 000728302.mol (via Jmol)
000728304.b3lyp_6-31g(d).inp

000728304.b3lyp_6-31g(d).qchem.inp (generated)

000728304.b3lyp_6-31g(d).gjf (generated)

000728304.b3lyp_6-31g(d).firefly.inp (generated)

000728304.b3lyp_6-31g(d).smash.inp (generated)

000728304.b3lyp_6-31g(d).nwchem.inp (generated) 000728304.b3lyp_6-31g(d).log.xz 000728304.td-b3lyp_6-31g+(d).inp 000728304.td-b3lyp_6-31g+(d).log.xz

000728304.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728304.td-b3lyp_6-31+g(d).gjf (generated)

000728304.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728304.mol 000728304.PUBCHEM 000728304.mol (via Jmol)
000728308.b3lyp_6-31g(d).inp

000728308.b3lyp_6-31g(d).qchem.inp (generated)

000728308.b3lyp_6-31g(d).gjf (generated)

000728308.b3lyp_6-31g(d).firefly.inp (generated)

000728308.b3lyp_6-31g(d).smash.inp (generated)

000728308.b3lyp_6-31g(d).nwchem.inp (generated) 000728308.b3lyp_6-31g(d).log.xz 000728308.td-b3lyp_6-31g+(d).inp 000728308.td-b3lyp_6-31g+(d).log.xz

000728308.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728308.td-b3lyp_6-31+g(d).gjf (generated)

000728308.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728308.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728308.mol 000728308.PUBCHEM 000728308.mol (via Jmol)
000728316.b3lyp_6-31g(d).inp

000728316.b3lyp_6-31g(d).qchem.inp (generated)

000728316.b3lyp_6-31g(d).gjf (generated)

000728316.b3lyp_6-31g(d).firefly.inp (generated)

000728316.b3lyp_6-31g(d).smash.inp (generated)

000728316.b3lyp_6-31g(d).nwchem.inp (generated) 000728316.b3lyp_6-31g(d).log.xz 000728316.td-b3lyp_6-31g+(d).inp 000728316.td-b3lyp_6-31g+(d).log.xz

000728316.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728316.td-b3lyp_6-31+g(d).gjf (generated)

000728316.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728316.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728316.mol 000728316.PUBCHEM 000728316.mol (via Jmol)
000728318.b3lyp_6-31g(d).inp

000728318.b3lyp_6-31g(d).qchem.inp (generated)

000728318.b3lyp_6-31g(d).gjf (generated)

000728318.b3lyp_6-31g(d).firefly.inp (generated)

000728318.b3lyp_6-31g(d).smash.inp (generated)

000728318.b3lyp_6-31g(d).nwchem.inp (generated) 000728318.b3lyp_6-31g(d).log.xz 000728318.mol 000728318.PUBCHEM 000728318.mol (via Jmol)
000728320.b3lyp_6-31g(d).inp

000728320.b3lyp_6-31g(d).qchem.inp (generated)

000728320.b3lyp_6-31g(d).gjf (generated)

000728320.b3lyp_6-31g(d).firefly.inp (generated)

000728320.b3lyp_6-31g(d).smash.inp (generated)

000728320.b3lyp_6-31g(d).nwchem.inp (generated) 000728320.b3lyp_6-31g(d).log.xz 000728320.td-b3lyp_6-31g+(d).inp 000728320.td-b3lyp_6-31g+(d).log.xz

000728320.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728320.td-b3lyp_6-31+g(d).gjf (generated)

000728320.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728320.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728320.mol 000728320.PUBCHEM 000728320.mol (via Jmol)
000728321.b3lyp_6-31g(d).inp

000728321.b3lyp_6-31g(d).qchem.inp (generated)

000728321.b3lyp_6-31g(d).gjf (generated)

000728321.b3lyp_6-31g(d).firefly.inp (generated)

000728321.b3lyp_6-31g(d).smash.inp (generated)

000728321.b3lyp_6-31g(d).nwchem.inp (generated) 000728321.b3lyp_6-31g(d).log.xz 000728321.td-b3lyp_6-31g+(d).inp 000728321.td-b3lyp_6-31g+(d).log.xz

000728321.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728321.td-b3lyp_6-31+g(d).gjf (generated)

000728321.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728321.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728321.mol 000728321.PUBCHEM 000728321.mol (via Jmol)
000728351.b3lyp_6-31g(d).inp

000728351.b3lyp_6-31g(d).qchem.inp (generated)

000728351.b3lyp_6-31g(d).gjf (generated)

000728351.b3lyp_6-31g(d).firefly.inp (generated)

000728351.b3lyp_6-31g(d).smash.inp (generated)

000728351.b3lyp_6-31g(d).nwchem.inp (generated) 000728351.b3lyp_6-31g(d).log.xz 000728351.td-b3lyp_6-31g+(d).inp 000728351.td-b3lyp_6-31g+(d).log.xz

000728351.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728351.td-b3lyp_6-31+g(d).gjf (generated)

000728351.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728351.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728351.mol 000728351.PUBCHEM 000728351.mol (via Jmol)
000728358.b3lyp_6-31g(d).inp

000728358.b3lyp_6-31g(d).qchem.inp (generated)

000728358.b3lyp_6-31g(d).gjf (generated)

000728358.b3lyp_6-31g(d).firefly.inp (generated)

000728358.b3lyp_6-31g(d).smash.inp (generated)

000728358.b3lyp_6-31g(d).nwchem.inp (generated) 000728358.b3lyp_6-31g(d).log.xz 000728358.mol 000728358.PUBCHEM 000728358.mol (via Jmol)
000728363.b3lyp_6-31g(d).inp

000728363.b3lyp_6-31g(d).qchem.inp (generated)

000728363.b3lyp_6-31g(d).gjf (generated)

000728363.b3lyp_6-31g(d).firefly.inp (generated)

000728363.b3lyp_6-31g(d).smash.inp (generated)

000728363.b3lyp_6-31g(d).nwchem.inp (generated) 000728363.b3lyp_6-31g(d).log.xz 000728363.td-b3lyp_6-31g+(d).inp 000728363.td-b3lyp_6-31g+(d).log.xz

000728363.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728363.td-b3lyp_6-31+g(d).gjf (generated)

000728363.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728363.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728363.mol 000728363.PUBCHEM 000728363.mol (via Jmol)
000728372.b3lyp_6-31g(d).inp

000728372.b3lyp_6-31g(d).qchem.inp (generated)

000728372.b3lyp_6-31g(d).gjf (generated)

000728372.b3lyp_6-31g(d).firefly.inp (generated)

000728372.b3lyp_6-31g(d).smash.inp (generated)

000728372.b3lyp_6-31g(d).nwchem.inp (generated) 000728372.b3lyp_6-31g(d).log.xz 000728372.td-b3lyp_6-31g+(d).inp 000728372.td-b3lyp_6-31g+(d).log.xz

000728372.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728372.td-b3lyp_6-31+g(d).gjf (generated)

000728372.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728372.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728372.mol 000728372.PUBCHEM 000728372.mol (via Jmol)
000728466.b3lyp_6-31g(d).inp

000728466.b3lyp_6-31g(d).qchem.inp (generated)

000728466.b3lyp_6-31g(d).gjf (generated)

000728466.b3lyp_6-31g(d).firefly.inp (generated)

000728466.b3lyp_6-31g(d).smash.inp (generated)

000728466.b3lyp_6-31g(d).nwchem.inp (generated) 000728466.b3lyp_6-31g(d).log.xz 000728466.mol 000728466.PUBCHEM 000728466.mol (via Jmol)
000728499.b3lyp_6-31g(d).inp

000728499.b3lyp_6-31g(d).qchem.inp (generated)

000728499.b3lyp_6-31g(d).gjf (generated)

000728499.b3lyp_6-31g(d).firefly.inp (generated)

000728499.b3lyp_6-31g(d).smash.inp (generated)

000728499.b3lyp_6-31g(d).nwchem.inp (generated) 000728499.b3lyp_6-31g(d).log.xz 000728499.mol 000728499.PUBCHEM 000728499.mol (via Jmol)
000728501.b3lyp_6-31g(d).inp

000728501.b3lyp_6-31g(d).qchem.inp (generated)

000728501.b3lyp_6-31g(d).gjf (generated)

000728501.b3lyp_6-31g(d).firefly.inp (generated)

000728501.b3lyp_6-31g(d).smash.inp (generated)

000728501.b3lyp_6-31g(d).nwchem.inp (generated) 000728501.b3lyp_6-31g(d).log.xz 000728501.mol 000728501.PUBCHEM 000728501.mol (via Jmol)
000728509.b3lyp_6-31g(d).inp

000728509.b3lyp_6-31g(d).qchem.inp (generated)

000728509.b3lyp_6-31g(d).gjf (generated)

000728509.b3lyp_6-31g(d).firefly.inp (generated)

000728509.b3lyp_6-31g(d).smash.inp (generated)

000728509.b3lyp_6-31g(d).nwchem.inp (generated) 000728509.b3lyp_6-31g(d).log.xz 000728509.mol 000728509.PUBCHEM 000728509.mol (via Jmol)
000728521.b3lyp_6-31g(d).inp

000728521.b3lyp_6-31g(d).qchem.inp (generated)

000728521.b3lyp_6-31g(d).gjf (generated)

000728521.b3lyp_6-31g(d).firefly.inp (generated)

000728521.b3lyp_6-31g(d).smash.inp (generated)

000728521.b3lyp_6-31g(d).nwchem.inp (generated) 000728521.b3lyp_6-31g(d).log.xz 000728521.td-b3lyp_6-31g+(d).inp 000728521.td-b3lyp_6-31g+(d).log.xz

000728521.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728521.td-b3lyp_6-31+g(d).gjf (generated)

000728521.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728521.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728521.mol 000728521.PUBCHEM 000728521.mol (via Jmol)
000728526.b3lyp_6-31g(d).inp

000728526.b3lyp_6-31g(d).qchem.inp (generated)

000728526.b3lyp_6-31g(d).gjf (generated)

000728526.b3lyp_6-31g(d).firefly.inp (generated)

000728526.b3lyp_6-31g(d).smash.inp (generated)

000728526.b3lyp_6-31g(d).nwchem.inp (generated) 000728526.b3lyp_6-31g(d).log.xz 000728526.mol 000728526.PUBCHEM 000728526.mol (via Jmol)
000728559.b3lyp_6-31g(d).inp

000728559.b3lyp_6-31g(d).qchem.inp (generated)

000728559.b3lyp_6-31g(d).gjf (generated)

000728559.b3lyp_6-31g(d).firefly.inp (generated)

000728559.b3lyp_6-31g(d).smash.inp (generated)

000728559.b3lyp_6-31g(d).nwchem.inp (generated) 000728559.b3lyp_6-31g(d).log.xz 000728559.mol 000728559.PUBCHEM 000728559.mol (via Jmol)
000728561.b3lyp_6-31g(d).inp

000728561.b3lyp_6-31g(d).qchem.inp (generated)

000728561.b3lyp_6-31g(d).gjf (generated)

000728561.b3lyp_6-31g(d).firefly.inp (generated)

000728561.b3lyp_6-31g(d).smash.inp (generated)

000728561.b3lyp_6-31g(d).nwchem.inp (generated) 000728561.b3lyp_6-31g(d).log.xz 000728561.mol 000728561.PUBCHEM 000728561.mol (via Jmol)
000728562.b3lyp_6-31g(d).inp

000728562.b3lyp_6-31g(d).qchem.inp (generated)

000728562.b3lyp_6-31g(d).gjf (generated)

000728562.b3lyp_6-31g(d).firefly.inp (generated)

000728562.b3lyp_6-31g(d).smash.inp (generated)

000728562.b3lyp_6-31g(d).nwchem.inp (generated) 000728562.b3lyp_6-31g(d).log.xz 000728562.mol 000728562.PUBCHEM 000728562.mol (via Jmol)
000728563.b3lyp_6-31g(d).inp

000728563.b3lyp_6-31g(d).qchem.inp (generated)

000728563.b3lyp_6-31g(d).gjf (generated)

000728563.b3lyp_6-31g(d).firefly.inp (generated)

000728563.b3lyp_6-31g(d).smash.inp (generated)

000728563.b3lyp_6-31g(d).nwchem.inp (generated) 000728563.b3lyp_6-31g(d).log.xz 000728563.mol 000728563.PUBCHEM 000728563.mol (via Jmol)
000728567.b3lyp_6-31g(d).inp

000728567.b3lyp_6-31g(d).qchem.inp (generated)

000728567.b3lyp_6-31g(d).gjf (generated)

000728567.b3lyp_6-31g(d).firefly.inp (generated)

000728567.b3lyp_6-31g(d).smash.inp (generated)

000728567.b3lyp_6-31g(d).nwchem.inp (generated) 000728567.b3lyp_6-31g(d).log.xz 000728567.td-b3lyp_6-31g+(d).inp 000728567.td-b3lyp_6-31g+(d).log.xz

000728567.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728567.td-b3lyp_6-31+g(d).gjf (generated)

000728567.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728567.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728567.mol 000728567.PUBCHEM 000728567.mol (via Jmol)
000728577.b3lyp_6-31g(d).inp

000728577.b3lyp_6-31g(d).qchem.inp (generated)

000728577.b3lyp_6-31g(d).gjf (generated)

000728577.b3lyp_6-31g(d).firefly.inp (generated)

000728577.b3lyp_6-31g(d).smash.inp (generated)

000728577.b3lyp_6-31g(d).nwchem.inp (generated) 000728577.b3lyp_6-31g(d).log.xz 000728577.mol 000728577.PUBCHEM 000728577.mol (via Jmol)
000728578.b3lyp_6-31g(d).inp

000728578.b3lyp_6-31g(d).qchem.inp (generated)

000728578.b3lyp_6-31g(d).gjf (generated)

000728578.b3lyp_6-31g(d).firefly.inp (generated)

000728578.b3lyp_6-31g(d).smash.inp (generated)

000728578.b3lyp_6-31g(d).nwchem.inp (generated) 000728578.b3lyp_6-31g(d).log.xz 000728578.td-b3lyp_6-31g+(d).inp 000728578.td-b3lyp_6-31g+(d).log.xz

000728578.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728578.td-b3lyp_6-31+g(d).gjf (generated)

000728578.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728578.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728578.mol 000728578.PUBCHEM 000728578.mol (via Jmol)
000728587.b3lyp_6-31g(d).inp

000728587.b3lyp_6-31g(d).qchem.inp (generated)

000728587.b3lyp_6-31g(d).gjf (generated)

000728587.b3lyp_6-31g(d).firefly.inp (generated)

000728587.b3lyp_6-31g(d).smash.inp (generated)

000728587.b3lyp_6-31g(d).nwchem.inp (generated) 000728587.b3lyp_6-31g(d).log.xz 000728587.td-b3lyp_6-31g+(d).inp 000728587.td-b3lyp_6-31g+(d).log.xz

000728587.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728587.td-b3lyp_6-31+g(d).gjf (generated)

000728587.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728587.mol 000728587.PUBCHEM 000728587.mol (via Jmol)
000728595.b3lyp_6-31g(d).inp

000728595.b3lyp_6-31g(d).qchem.inp (generated)

000728595.b3lyp_6-31g(d).gjf (generated)

000728595.b3lyp_6-31g(d).firefly.inp (generated)

000728595.b3lyp_6-31g(d).smash.inp (generated)

000728595.b3lyp_6-31g(d).nwchem.inp (generated) 000728595.b3lyp_6-31g(d).log.xz 000728595.td-b3lyp_6-31g+(d).inp 000728595.td-b3lyp_6-31g+(d).log.xz

000728595.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728595.td-b3lyp_6-31+g(d).gjf (generated)

000728595.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728595.mol 000728595.PUBCHEM 000728595.mol (via Jmol)
000728610.b3lyp_6-31g(d).inp

000728610.b3lyp_6-31g(d).qchem.inp (generated)

000728610.b3lyp_6-31g(d).gjf (generated)

000728610.b3lyp_6-31g(d).firefly.inp (generated)

000728610.b3lyp_6-31g(d).smash.inp (generated)

000728610.b3lyp_6-31g(d).nwchem.inp (generated) 000728610.b3lyp_6-31g(d).log.xz 000728610.td-b3lyp_6-31g+(d).inp 000728610.td-b3lyp_6-31g+(d).log.xz

000728610.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728610.td-b3lyp_6-31+g(d).gjf (generated)

000728610.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728610.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728610.mol 000728610.PUBCHEM 000728610.mol (via Jmol)
000728611.b3lyp_6-31g(d).inp

000728611.b3lyp_6-31g(d).qchem.inp (generated)

000728611.b3lyp_6-31g(d).gjf (generated)

000728611.b3lyp_6-31g(d).firefly.inp (generated)

000728611.b3lyp_6-31g(d).smash.inp (generated)

000728611.b3lyp_6-31g(d).nwchem.inp (generated) 000728611.b3lyp_6-31g(d).log.xz 000728611.td-b3lyp_6-31g+(d).inp 000728611.td-b3lyp_6-31g+(d).log.xz

000728611.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728611.td-b3lyp_6-31+g(d).gjf (generated)

000728611.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728611.mol 000728611.PUBCHEM 000728611.mol (via Jmol)
000728613.b3lyp_6-31g(d).inp

000728613.b3lyp_6-31g(d).qchem.inp (generated)

000728613.b3lyp_6-31g(d).gjf (generated)

000728613.b3lyp_6-31g(d).firefly.inp (generated)

000728613.b3lyp_6-31g(d).smash.inp (generated)

000728613.b3lyp_6-31g(d).nwchem.inp (generated) 000728613.b3lyp_6-31g(d).log.xz 000728613.td-b3lyp_6-31g+(d).inp 000728613.td-b3lyp_6-31g+(d).log.xz

000728613.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728613.td-b3lyp_6-31+g(d).gjf (generated)

000728613.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728613.mol 000728613.PUBCHEM 000728613.mol (via Jmol)
000728614.b3lyp_6-31g(d).inp

000728614.b3lyp_6-31g(d).qchem.inp (generated)

000728614.b3lyp_6-31g(d).gjf (generated)

000728614.b3lyp_6-31g(d).firefly.inp (generated)

000728614.b3lyp_6-31g(d).smash.inp (generated)

000728614.b3lyp_6-31g(d).nwchem.inp (generated) 000728614.b3lyp_6-31g(d).log.xz 000728614.td-b3lyp_6-31g+(d).inp 000728614.td-b3lyp_6-31g+(d).log.xz

000728614.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728614.td-b3lyp_6-31+g(d).gjf (generated)

000728614.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728614.mol 000728614.PUBCHEM 000728614.mol (via Jmol)
000728616.b3lyp_6-31g(d).inp

000728616.b3lyp_6-31g(d).qchem.inp (generated)

000728616.b3lyp_6-31g(d).gjf (generated)

000728616.b3lyp_6-31g(d).firefly.inp (generated)

000728616.b3lyp_6-31g(d).smash.inp (generated)

000728616.b3lyp_6-31g(d).nwchem.inp (generated) 000728616.b3lyp_6-31g(d).log.xz 000728616.mol 000728616.PUBCHEM 000728616.mol (via Jmol)
000728617.b3lyp_6-31g(d).inp

000728617.b3lyp_6-31g(d).qchem.inp (generated)

000728617.b3lyp_6-31g(d).gjf (generated)

000728617.b3lyp_6-31g(d).firefly.inp (generated)

000728617.b3lyp_6-31g(d).smash.inp (generated)

000728617.b3lyp_6-31g(d).nwchem.inp (generated) 000728617.b3lyp_6-31g(d).log.xz 000728617.mol 000728617.PUBCHEM 000728617.mol (via Jmol)
000728619.b3lyp_6-31g(d).inp

000728619.b3lyp_6-31g(d).qchem.inp (generated)

000728619.b3lyp_6-31g(d).gjf (generated)

000728619.b3lyp_6-31g(d).firefly.inp (generated)

000728619.b3lyp_6-31g(d).smash.inp (generated)

000728619.b3lyp_6-31g(d).nwchem.inp (generated) 000728619.b3lyp_6-31g(d).log.xz 000728619.mol 000728619.PUBCHEM 000728619.mol (via Jmol)
000728620.b3lyp_6-31g(d).inp

000728620.b3lyp_6-31g(d).qchem.inp (generated)

000728620.b3lyp_6-31g(d).gjf (generated)

000728620.b3lyp_6-31g(d).firefly.inp (generated)

000728620.b3lyp_6-31g(d).smash.inp (generated)

000728620.b3lyp_6-31g(d).nwchem.inp (generated) 000728620.b3lyp_6-31g(d).log.xz 000728620.mol 000728620.PUBCHEM 000728620.mol (via Jmol)
000728628.b3lyp_6-31g(d).inp

000728628.b3lyp_6-31g(d).qchem.inp (generated)

000728628.b3lyp_6-31g(d).gjf (generated)

000728628.b3lyp_6-31g(d).firefly.inp (generated)

000728628.b3lyp_6-31g(d).smash.inp (generated)

000728628.b3lyp_6-31g(d).nwchem.inp (generated) 000728628.b3lyp_6-31g(d).log.xz 000728628.td-b3lyp_6-31g+(d).inp 000728628.td-b3lyp_6-31g+(d).log.xz

000728628.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728628.td-b3lyp_6-31+g(d).gjf (generated)

000728628.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728628.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728628.mol 000728628.PUBCHEM 000728628.mol (via Jmol)
000728634.b3lyp_6-31g(d).inp

000728634.b3lyp_6-31g(d).qchem.inp (generated)

000728634.b3lyp_6-31g(d).gjf (generated)

000728634.b3lyp_6-31g(d).firefly.inp (generated)

000728634.b3lyp_6-31g(d).smash.inp (generated)

000728634.b3lyp_6-31g(d).nwchem.inp (generated) 000728634.b3lyp_6-31g(d).log.xz 000728634.td-b3lyp_6-31g+(d).inp 000728634.td-b3lyp_6-31g+(d).log.xz

000728634.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728634.td-b3lyp_6-31+g(d).gjf (generated)

000728634.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728634.mol 000728634.PUBCHEM 000728634.mol (via Jmol)
000728636.b3lyp_6-31g(d).inp

000728636.b3lyp_6-31g(d).qchem.inp (generated)

000728636.b3lyp_6-31g(d).gjf (generated)

000728636.b3lyp_6-31g(d).firefly.inp (generated)

000728636.b3lyp_6-31g(d).smash.inp (generated)

000728636.b3lyp_6-31g(d).nwchem.inp (generated) 000728636.b3lyp_6-31g(d).log.xz 000728636.td-b3lyp_6-31g+(d).inp 000728636.td-b3lyp_6-31g+(d).log.xz

000728636.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728636.td-b3lyp_6-31+g(d).gjf (generated)

000728636.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728636.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728636.mol 000728636.PUBCHEM 000728636.mol (via Jmol)
000728640.b3lyp_6-31g(d).inp

000728640.b3lyp_6-31g(d).qchem.inp (generated)

000728640.b3lyp_6-31g(d).gjf (generated)

000728640.b3lyp_6-31g(d).firefly.inp (generated)

000728640.b3lyp_6-31g(d).smash.inp (generated)

000728640.b3lyp_6-31g(d).nwchem.inp (generated) 000728640.b3lyp_6-31g(d).log.xz 000728640.td-b3lyp_6-31g+(d).inp 000728640.td-b3lyp_6-31g+(d).log.xz

000728640.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728640.td-b3lyp_6-31+g(d).gjf (generated)

000728640.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728640.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728640.mol 000728640.PUBCHEM 000728640.mol (via Jmol)
000728641.b3lyp_6-31g(d).inp

000728641.b3lyp_6-31g(d).qchem.inp (generated)

000728641.b3lyp_6-31g(d).gjf (generated)

000728641.b3lyp_6-31g(d).firefly.inp (generated)

000728641.b3lyp_6-31g(d).smash.inp (generated)

000728641.b3lyp_6-31g(d).nwchem.inp (generated) 000728641.b3lyp_6-31g(d).log.xz 000728641.mol 000728641.PUBCHEM 000728641.mol (via Jmol)
000728644.b3lyp_6-31g(d).inp

000728644.b3lyp_6-31g(d).qchem.inp (generated)

000728644.b3lyp_6-31g(d).gjf (generated)

000728644.b3lyp_6-31g(d).firefly.inp (generated)

000728644.b3lyp_6-31g(d).smash.inp (generated)

000728644.b3lyp_6-31g(d).nwchem.inp (generated) 000728644.b3lyp_6-31g(d).log.xz 000728644.td-b3lyp_6-31g+(d).inp 000728644.td-b3lyp_6-31g+(d).log.xz

000728644.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728644.td-b3lyp_6-31+g(d).gjf (generated)

000728644.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728644.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728644.mol 000728644.PUBCHEM 000728644.mol (via Jmol)
000728650.b3lyp_6-31g(d).inp

000728650.b3lyp_6-31g(d).qchem.inp (generated)

000728650.b3lyp_6-31g(d).gjf (generated)

000728650.b3lyp_6-31g(d).firefly.inp (generated)

000728650.b3lyp_6-31g(d).smash.inp (generated)

000728650.b3lyp_6-31g(d).nwchem.inp (generated) 000728650.b3lyp_6-31g(d).log.xz 000728650.mol 000728650.PUBCHEM 000728650.mol (via Jmol)
000728651.b3lyp_6-31g(d).inp

000728651.b3lyp_6-31g(d).qchem.inp (generated)

000728651.b3lyp_6-31g(d).gjf (generated)

000728651.b3lyp_6-31g(d).firefly.inp (generated)

000728651.b3lyp_6-31g(d).smash.inp (generated)

000728651.b3lyp_6-31g(d).nwchem.inp (generated) 000728651.b3lyp_6-31g(d).log.xz 000728651.td-b3lyp_6-31g+(d).inp 000728651.td-b3lyp_6-31g+(d).log.xz

000728651.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728651.td-b3lyp_6-31+g(d).gjf (generated)

000728651.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728651.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728651.mol 000728651.PUBCHEM 000728651.mol (via Jmol)
000728670.b3lyp_6-31g(d).inp

000728670.b3lyp_6-31g(d).qchem.inp (generated)

000728670.b3lyp_6-31g(d).gjf (generated)

000728670.b3lyp_6-31g(d).firefly.inp (generated)

000728670.b3lyp_6-31g(d).smash.inp (generated)

000728670.b3lyp_6-31g(d).nwchem.inp (generated) 000728670.b3lyp_6-31g(d).log.xz 000728670.td-b3lyp_6-31g+(d).inp 000728670.td-b3lyp_6-31g+(d).log.xz

000728670.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728670.td-b3lyp_6-31+g(d).gjf (generated)

000728670.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728670.mol 000728670.PUBCHEM 000728670.mol (via Jmol)
000728672.b3lyp_6-31g(d).inp

000728672.b3lyp_6-31g(d).qchem.inp (generated)

000728672.b3lyp_6-31g(d).gjf (generated)

000728672.b3lyp_6-31g(d).firefly.inp (generated)

000728672.b3lyp_6-31g(d).smash.inp (generated)

000728672.b3lyp_6-31g(d).nwchem.inp (generated) 000728672.b3lyp_6-31g(d).log.xz 000728672.mol 000728672.PUBCHEM 000728672.mol (via Jmol)
000728673.b3lyp_6-31g(d).inp

000728673.b3lyp_6-31g(d).qchem.inp (generated)

000728673.b3lyp_6-31g(d).gjf (generated)

000728673.b3lyp_6-31g(d).firefly.inp (generated)

000728673.b3lyp_6-31g(d).smash.inp (generated)

000728673.b3lyp_6-31g(d).nwchem.inp (generated) 000728673.b3lyp_6-31g(d).log.xz 000728673.td-b3lyp_6-31g+(d).inp 000728673.td-b3lyp_6-31g+(d).log.xz

000728673.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728673.td-b3lyp_6-31+g(d).gjf (generated)

000728673.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728673.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728673.mol 000728673.PUBCHEM 000728673.mol (via Jmol)
000728676.b3lyp_6-31g(d).inp

000728676.b3lyp_6-31g(d).qchem.inp (generated)

000728676.b3lyp_6-31g(d).gjf (generated)

000728676.b3lyp_6-31g(d).firefly.inp (generated)

000728676.b3lyp_6-31g(d).smash.inp (generated)

000728676.b3lyp_6-31g(d).nwchem.inp (generated) 000728676.b3lyp_6-31g(d).log.xz 000728676.td-b3lyp_6-31g+(d).inp 000728676.td-b3lyp_6-31g+(d).log.xz

000728676.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728676.td-b3lyp_6-31+g(d).gjf (generated)

000728676.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728676.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728676.mol 000728676.PUBCHEM 000728676.mol (via Jmol)
000728678.b3lyp_6-31g(d).inp

000728678.b3lyp_6-31g(d).qchem.inp (generated)

000728678.b3lyp_6-31g(d).gjf (generated)

000728678.b3lyp_6-31g(d).firefly.inp (generated)

000728678.b3lyp_6-31g(d).smash.inp (generated)

000728678.b3lyp_6-31g(d).nwchem.inp (generated) 000728678.b3lyp_6-31g(d).log.xz 000728678.mol 000728678.PUBCHEM 000728678.mol (via Jmol)
000728679.b3lyp_6-31g(d).inp

000728679.b3lyp_6-31g(d).qchem.inp (generated)

000728679.b3lyp_6-31g(d).gjf (generated)

000728679.b3lyp_6-31g(d).firefly.inp (generated)

000728679.b3lyp_6-31g(d).smash.inp (generated)

000728679.b3lyp_6-31g(d).nwchem.inp (generated) 000728679.b3lyp_6-31g(d).log.xz 000728679.td-b3lyp_6-31g+(d).inp 000728679.td-b3lyp_6-31g+(d).log.xz

000728679.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728679.td-b3lyp_6-31+g(d).gjf (generated)

000728679.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728679.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728679.mol 000728679.PUBCHEM 000728679.mol (via Jmol)
000728681.b3lyp_6-31g(d).inp

000728681.b3lyp_6-31g(d).qchem.inp (generated)

000728681.b3lyp_6-31g(d).gjf (generated)

000728681.b3lyp_6-31g(d).firefly.inp (generated)

000728681.b3lyp_6-31g(d).smash.inp (generated)

000728681.b3lyp_6-31g(d).nwchem.inp (generated) 000728681.b3lyp_6-31g(d).log.xz 000728681.td-b3lyp_6-31g+(d).inp 000728681.td-b3lyp_6-31g+(d).log.xz

000728681.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728681.td-b3lyp_6-31+g(d).gjf (generated)

000728681.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728681.mol 000728681.PUBCHEM 000728681.mol (via Jmol)
000728683.b3lyp_6-31g(d).inp

000728683.b3lyp_6-31g(d).qchem.inp (generated)

000728683.b3lyp_6-31g(d).gjf (generated)

000728683.b3lyp_6-31g(d).firefly.inp (generated)

000728683.b3lyp_6-31g(d).smash.inp (generated)

000728683.b3lyp_6-31g(d).nwchem.inp (generated) 000728683.b3lyp_6-31g(d).log.xz 000728683.td-b3lyp_6-31g+(d).inp 000728683.td-b3lyp_6-31g+(d).log.xz

000728683.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728683.td-b3lyp_6-31+g(d).gjf (generated)

000728683.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728683.mol 000728683.PUBCHEM 000728683.mol (via Jmol)
000728690.b3lyp_6-31g(d).inp

000728690.b3lyp_6-31g(d).qchem.inp (generated)

000728690.b3lyp_6-31g(d).gjf (generated)

000728690.b3lyp_6-31g(d).firefly.inp (generated)

000728690.b3lyp_6-31g(d).smash.inp (generated)

000728690.b3lyp_6-31g(d).nwchem.inp (generated) 000728690.b3lyp_6-31g(d).log.xz 000728690.td-b3lyp_6-31g+(d).inp 000728690.td-b3lyp_6-31g+(d).log.xz

000728690.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728690.td-b3lyp_6-31+g(d).gjf (generated)

000728690.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728690.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728690.mol 000728690.PUBCHEM 000728690.mol (via Jmol)
000728702.b3lyp_6-31g(d).inp

000728702.b3lyp_6-31g(d).qchem.inp (generated)

000728702.b3lyp_6-31g(d).gjf (generated)

000728702.b3lyp_6-31g(d).firefly.inp (generated)

000728702.b3lyp_6-31g(d).smash.inp (generated)

000728702.b3lyp_6-31g(d).nwchem.inp (generated) 000728702.b3lyp_6-31g(d).log.xz 000728702.td-b3lyp_6-31g+(d).inp 000728702.td-b3lyp_6-31g+(d).log.xz

000728702.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728702.td-b3lyp_6-31+g(d).gjf (generated)

000728702.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728702.mol 000728702.PUBCHEM 000728702.mol (via Jmol)
000728719.b3lyp_6-31g(d).inp

000728719.b3lyp_6-31g(d).qchem.inp (generated)

000728719.b3lyp_6-31g(d).gjf (generated)

000728719.b3lyp_6-31g(d).firefly.inp (generated)

000728719.b3lyp_6-31g(d).smash.inp (generated)

000728719.b3lyp_6-31g(d).nwchem.inp (generated) 000728719.b3lyp_6-31g(d).log.xz 000728719.td-b3lyp_6-31g+(d).inp 000728719.td-b3lyp_6-31g+(d).log.xz

000728719.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728719.td-b3lyp_6-31+g(d).gjf (generated)

000728719.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728719.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728719.mol 000728719.PUBCHEM 000728719.mol (via Jmol)
000728722.b3lyp_6-31g(d).inp

000728722.b3lyp_6-31g(d).qchem.inp (generated)

000728722.b3lyp_6-31g(d).gjf (generated)

000728722.b3lyp_6-31g(d).firefly.inp (generated)

000728722.b3lyp_6-31g(d).smash.inp (generated)

000728722.b3lyp_6-31g(d).nwchem.inp (generated) 000728722.b3lyp_6-31g(d).log.xz 000728722.td-b3lyp_6-31g+(d).inp 000728722.td-b3lyp_6-31g+(d).log.xz

000728722.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728722.td-b3lyp_6-31+g(d).gjf (generated)

000728722.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728722.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728722.mol 000728722.PUBCHEM 000728722.mol (via Jmol)
000728746.b3lyp_6-31g(d).inp

000728746.b3lyp_6-31g(d).qchem.inp (generated)

000728746.b3lyp_6-31g(d).gjf (generated)

000728746.b3lyp_6-31g(d).firefly.inp (generated)

000728746.b3lyp_6-31g(d).smash.inp (generated)

000728746.b3lyp_6-31g(d).nwchem.inp (generated) 000728746.b3lyp_6-31g(d).log.xz 000728746.td-b3lyp_6-31g+(d).inp 000728746.td-b3lyp_6-31g+(d).log.xz

000728746.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728746.td-b3lyp_6-31+g(d).gjf (generated)

000728746.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728746.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728746.mol 000728746.PUBCHEM 000728746.mol (via Jmol)
000728749.b3lyp_6-31g(d).inp

000728749.b3lyp_6-31g(d).qchem.inp (generated)

000728749.b3lyp_6-31g(d).gjf (generated)

000728749.b3lyp_6-31g(d).firefly.inp (generated)

000728749.b3lyp_6-31g(d).smash.inp (generated)

000728749.b3lyp_6-31g(d).nwchem.inp (generated) 000728749.b3lyp_6-31g(d).log.xz 000728749.td-b3lyp_6-31g+(d).inp 000728749.td-b3lyp_6-31g+(d).log.xz

000728749.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728749.td-b3lyp_6-31+g(d).gjf (generated)

000728749.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728749.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728749.mol 000728749.PUBCHEM 000728749.mol (via Jmol)
000728750.b3lyp_6-31g(d).inp

000728750.b3lyp_6-31g(d).qchem.inp (generated)

000728750.b3lyp_6-31g(d).gjf (generated)

000728750.b3lyp_6-31g(d).firefly.inp (generated)

000728750.b3lyp_6-31g(d).smash.inp (generated)

000728750.b3lyp_6-31g(d).nwchem.inp (generated) 000728750.b3lyp_6-31g(d).log.xz 000728750.td-b3lyp_6-31g+(d).inp 000728750.td-b3lyp_6-31g+(d).log.xz

000728750.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728750.td-b3lyp_6-31+g(d).gjf (generated)

000728750.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728750.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728750.mol 000728750.PUBCHEM 000728750.mol (via Jmol)
000728757.b3lyp_6-31g(d).inp

000728757.b3lyp_6-31g(d).qchem.inp (generated)

000728757.b3lyp_6-31g(d).gjf (generated)

000728757.b3lyp_6-31g(d).firefly.inp (generated)

000728757.b3lyp_6-31g(d).smash.inp (generated)

000728757.b3lyp_6-31g(d).nwchem.inp (generated) 000728757.b3lyp_6-31g(d).log.xz 000728757.mol 000728757.PUBCHEM 000728757.mol (via Jmol)
000728775.b3lyp_6-31g(d).inp

000728775.b3lyp_6-31g(d).qchem.inp (generated)

000728775.b3lyp_6-31g(d).gjf (generated)

000728775.b3lyp_6-31g(d).firefly.inp (generated)

000728775.b3lyp_6-31g(d).smash.inp (generated)

000728775.b3lyp_6-31g(d).nwchem.inp (generated) 000728775.b3lyp_6-31g(d).log.xz 000728775.td-b3lyp_6-31g+(d).inp 000728775.td-b3lyp_6-31g+(d).log.xz

000728775.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728775.td-b3lyp_6-31+g(d).gjf (generated)

000728775.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728775.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728775.mol 000728775.PUBCHEM 000728775.mol (via Jmol)
000728795.b3lyp_6-31g(d).inp

000728795.b3lyp_6-31g(d).qchem.inp (generated)

000728795.b3lyp_6-31g(d).gjf (generated)

000728795.b3lyp_6-31g(d).firefly.inp (generated)

000728795.b3lyp_6-31g(d).smash.inp (generated)

000728795.b3lyp_6-31g(d).nwchem.inp (generated) 000728795.b3lyp_6-31g(d).log.xz 000728795.td-b3lyp_6-31g+(d).inp 000728795.td-b3lyp_6-31g+(d).log.xz

000728795.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728795.td-b3lyp_6-31+g(d).gjf (generated)

000728795.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728795.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728795.mol 000728795.PUBCHEM 000728795.mol (via Jmol)
000728796.b3lyp_6-31g(d).inp

000728796.b3lyp_6-31g(d).qchem.inp (generated)

000728796.b3lyp_6-31g(d).gjf (generated)

000728796.b3lyp_6-31g(d).firefly.inp (generated)

000728796.b3lyp_6-31g(d).smash.inp (generated)

000728796.b3lyp_6-31g(d).nwchem.inp (generated) 000728796.b3lyp_6-31g(d).log.xz 000728796.td-b3lyp_6-31g+(d).inp 000728796.td-b3lyp_6-31g+(d).log.xz

000728796.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728796.td-b3lyp_6-31+g(d).gjf (generated)

000728796.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728796.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728796.mol 000728796.PUBCHEM 000728796.mol (via Jmol)
000728806.b3lyp_6-31g(d).inp

000728806.b3lyp_6-31g(d).qchem.inp (generated)

000728806.b3lyp_6-31g(d).gjf (generated)

000728806.b3lyp_6-31g(d).firefly.inp (generated)

000728806.b3lyp_6-31g(d).smash.inp (generated)

000728806.b3lyp_6-31g(d).nwchem.inp (generated) 000728806.b3lyp_6-31g(d).log.xz 000728806.td-b3lyp_6-31g+(d).inp 000728806.td-b3lyp_6-31g+(d).log.xz

000728806.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728806.td-b3lyp_6-31+g(d).gjf (generated)

000728806.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728806.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728806.mol 000728806.PUBCHEM 000728806.mol (via Jmol)
000728807.b3lyp_6-31g(d).inp

000728807.b3lyp_6-31g(d).qchem.inp (generated)

000728807.b3lyp_6-31g(d).gjf (generated)

000728807.b3lyp_6-31g(d).firefly.inp (generated)

000728807.b3lyp_6-31g(d).smash.inp (generated)

000728807.b3lyp_6-31g(d).nwchem.inp (generated) 000728807.b3lyp_6-31g(d).log.xz 000728807.td-b3lyp_6-31g+(d).inp 000728807.td-b3lyp_6-31g+(d).log.xz

000728807.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728807.td-b3lyp_6-31+g(d).gjf (generated)

000728807.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728807.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728807.mol 000728807.PUBCHEM 000728807.mol (via Jmol)
000728818.b3lyp_6-31g(d).inp

000728818.b3lyp_6-31g(d).qchem.inp (generated)

000728818.b3lyp_6-31g(d).gjf (generated)

000728818.b3lyp_6-31g(d).firefly.inp (generated)

000728818.b3lyp_6-31g(d).smash.inp (generated)

000728818.b3lyp_6-31g(d).nwchem.inp (generated) 000728818.b3lyp_6-31g(d).log.xz 000728818.td-b3lyp_6-31g+(d).inp 000728818.td-b3lyp_6-31g+(d).log.xz

000728818.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728818.td-b3lyp_6-31+g(d).gjf (generated)

000728818.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728818.mol 000728818.PUBCHEM 000728818.mol (via Jmol)
000728837.b3lyp_6-31g(d).inp

000728837.b3lyp_6-31g(d).qchem.inp (generated)

000728837.b3lyp_6-31g(d).gjf (generated)

000728837.b3lyp_6-31g(d).firefly.inp (generated)

000728837.b3lyp_6-31g(d).smash.inp (generated)

000728837.b3lyp_6-31g(d).nwchem.inp (generated) 000728837.b3lyp_6-31g(d).log.xz 000728837.mol 000728837.PUBCHEM 000728837.mol (via Jmol)
000728838.b3lyp_6-31g(d).inp

000728838.b3lyp_6-31g(d).qchem.inp (generated)

000728838.b3lyp_6-31g(d).gjf (generated)

000728838.b3lyp_6-31g(d).firefly.inp (generated)

000728838.b3lyp_6-31g(d).smash.inp (generated)

000728838.b3lyp_6-31g(d).nwchem.inp (generated) 000728838.b3lyp_6-31g(d).log.xz 000728838.td-b3lyp_6-31g+(d).inp 000728838.td-b3lyp_6-31g+(d).log.xz

000728838.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728838.td-b3lyp_6-31+g(d).gjf (generated)

000728838.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728838.mol 000728838.PUBCHEM 000728838.mol (via Jmol)
000728853.b3lyp_6-31g(d).inp

000728853.b3lyp_6-31g(d).qchem.inp (generated)

000728853.b3lyp_6-31g(d).gjf (generated)

000728853.b3lyp_6-31g(d).firefly.inp (generated)

000728853.b3lyp_6-31g(d).smash.inp (generated)

000728853.b3lyp_6-31g(d).nwchem.inp (generated) 000728853.b3lyp_6-31g(d).log.xz 000728853.td-b3lyp_6-31g+(d).inp 000728853.td-b3lyp_6-31g+(d).log.xz

000728853.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728853.td-b3lyp_6-31+g(d).gjf (generated)

000728853.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728853.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728853.mol 000728853.PUBCHEM 000728853.mol (via Jmol)
000728865.b3lyp_6-31g(d).inp

000728865.b3lyp_6-31g(d).qchem.inp (generated)

000728865.b3lyp_6-31g(d).gjf (generated)

000728865.b3lyp_6-31g(d).firefly.inp (generated)

000728865.b3lyp_6-31g(d).smash.inp (generated)

000728865.b3lyp_6-31g(d).nwchem.inp (generated) 000728865.b3lyp_6-31g(d).log.xz 000728865.td-b3lyp_6-31g+(d).inp 000728865.td-b3lyp_6-31g+(d).log.xz

000728865.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728865.td-b3lyp_6-31+g(d).gjf (generated)

000728865.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728865.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728865.mol 000728865.PUBCHEM 000728865.mol (via Jmol)
000728881.b3lyp_6-31g(d).inp

000728881.b3lyp_6-31g(d).qchem.inp (generated)

000728881.b3lyp_6-31g(d).gjf (generated)

000728881.b3lyp_6-31g(d).firefly.inp (generated)

000728881.b3lyp_6-31g(d).smash.inp (generated)

000728881.b3lyp_6-31g(d).nwchem.inp (generated) 000728881.b3lyp_6-31g(d).log.xz 000728881.mol 000728881.PUBCHEM 000728881.mol (via Jmol)
000728883.b3lyp_6-31g(d).inp

000728883.b3lyp_6-31g(d).qchem.inp (generated)

000728883.b3lyp_6-31g(d).gjf (generated)

000728883.b3lyp_6-31g(d).firefly.inp (generated)

000728883.b3lyp_6-31g(d).smash.inp (generated)

000728883.b3lyp_6-31g(d).nwchem.inp (generated) 000728883.b3lyp_6-31g(d).log.xz 000728883.td-b3lyp_6-31g+(d).inp 000728883.td-b3lyp_6-31g+(d).log.xz

000728883.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728883.td-b3lyp_6-31+g(d).gjf (generated)

000728883.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728883.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728883.mol 000728883.PUBCHEM 000728883.mol (via Jmol)
000728910.b3lyp_6-31g(d).inp

000728910.b3lyp_6-31g(d).qchem.inp (generated)

000728910.b3lyp_6-31g(d).gjf (generated)

000728910.b3lyp_6-31g(d).firefly.inp (generated)

000728910.b3lyp_6-31g(d).smash.inp (generated)

000728910.b3lyp_6-31g(d).nwchem.inp (generated) 000728910.b3lyp_6-31g(d).log.xz 000728910.td-b3lyp_6-31g+(d).inp 000728910.td-b3lyp_6-31g+(d).log.xz

000728910.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728910.td-b3lyp_6-31+g(d).gjf (generated)

000728910.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728910.mol 000728910.PUBCHEM 000728910.mol (via Jmol)
000728912.b3lyp_6-31g(d).inp

000728912.b3lyp_6-31g(d).qchem.inp (generated)

000728912.b3lyp_6-31g(d).gjf (generated)

000728912.b3lyp_6-31g(d).firefly.inp (generated)

000728912.b3lyp_6-31g(d).smash.inp (generated)

000728912.b3lyp_6-31g(d).nwchem.inp (generated) 000728912.b3lyp_6-31g(d).log.xz 000728912.td-b3lyp_6-31g+(d).inp 000728912.td-b3lyp_6-31g+(d).log.xz

000728912.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728912.td-b3lyp_6-31+g(d).gjf (generated)

000728912.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728912.mol 000728912.PUBCHEM 000728912.mol (via Jmol)
000728928.b3lyp_6-31g(d).inp

000728928.b3lyp_6-31g(d).qchem.inp (generated)

000728928.b3lyp_6-31g(d).gjf (generated)

000728928.b3lyp_6-31g(d).firefly.inp (generated)

000728928.b3lyp_6-31g(d).smash.inp (generated)

000728928.b3lyp_6-31g(d).nwchem.inp (generated) 000728928.b3lyp_6-31g(d).log.xz 000728928.td-b3lyp_6-31g+(d).inp 000728928.td-b3lyp_6-31g+(d).log.xz

000728928.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728928.td-b3lyp_6-31+g(d).gjf (generated)

000728928.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728928.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728928.mol 000728928.PUBCHEM 000728928.mol (via Jmol)
000728937.b3lyp_6-31g(d).inp

000728937.b3lyp_6-31g(d).qchem.inp (generated)

000728937.b3lyp_6-31g(d).gjf (generated)

000728937.b3lyp_6-31g(d).firefly.inp (generated)

000728937.b3lyp_6-31g(d).smash.inp (generated)

000728937.b3lyp_6-31g(d).nwchem.inp (generated) 000728937.b3lyp_6-31g(d).log.xz 000728937.td-b3lyp_6-31g+(d).inp 000728937.td-b3lyp_6-31g+(d).log.xz

000728937.td-b3lyp_6-31+g(d).qchem.inp (generated)

000728937.td-b3lyp_6-31+g(d).gjf (generated)

000728937.td-b3lyp_6-31+g(d).firefly.inp (generated)

000728937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000728937.mol 000728937.PUBCHEM 000728937.mol (via Jmol)
000729050.b3lyp_6-31g(d).inp

000729050.b3lyp_6-31g(d).qchem.inp (generated)

000729050.b3lyp_6-31g(d).gjf (generated)

000729050.b3lyp_6-31g(d).firefly.inp (generated)

000729050.b3lyp_6-31g(d).smash.inp (generated)

000729050.b3lyp_6-31g(d).nwchem.inp (generated) 000729050.b3lyp_6-31g(d).log.xz 000729050.mol 000729050.PUBCHEM 000729050.mol (via Jmol)
000729057.b3lyp_6-31g(d).inp

000729057.b3lyp_6-31g(d).qchem.inp (generated)

000729057.b3lyp_6-31g(d).gjf (generated)

000729057.b3lyp_6-31g(d).firefly.inp (generated)

000729057.b3lyp_6-31g(d).smash.inp (generated)

000729057.b3lyp_6-31g(d).nwchem.inp (generated) 000729057.b3lyp_6-31g(d).log.xz 000729057.td-b3lyp_6-31g+(d).inp 000729057.td-b3lyp_6-31g+(d).log.xz

000729057.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729057.td-b3lyp_6-31+g(d).gjf (generated)

000729057.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729057.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729057.mol 000729057.PUBCHEM 000729057.mol (via Jmol)
000729062.b3lyp_6-31g(d).inp

000729062.b3lyp_6-31g(d).qchem.inp (generated)

000729062.b3lyp_6-31g(d).gjf (generated)

000729062.b3lyp_6-31g(d).firefly.inp (generated)

000729062.b3lyp_6-31g(d).smash.inp (generated)

000729062.b3lyp_6-31g(d).nwchem.inp (generated) 000729062.b3lyp_6-31g(d).log.xz 000729062.td-b3lyp_6-31g+(d).inp 000729062.td-b3lyp_6-31g+(d).log.xz

000729062.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729062.td-b3lyp_6-31+g(d).gjf (generated)

000729062.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729062.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729062.mol 000729062.PUBCHEM 000729062.mol (via Jmol)
000729064.b3lyp_6-31g(d).inp

000729064.b3lyp_6-31g(d).qchem.inp (generated)

000729064.b3lyp_6-31g(d).gjf (generated)

000729064.b3lyp_6-31g(d).firefly.inp (generated)

000729064.b3lyp_6-31g(d).smash.inp (generated)

000729064.b3lyp_6-31g(d).nwchem.inp (generated) 000729064.b3lyp_6-31g(d).log.xz 000729064.td-b3lyp_6-31g+(d).inp 000729064.td-b3lyp_6-31g+(d).log.xz

000729064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729064.td-b3lyp_6-31+g(d).gjf (generated)

000729064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729064.mol 000729064.PUBCHEM 000729064.mol (via Jmol)
000729120.b3lyp_6-31g(d).inp

000729120.b3lyp_6-31g(d).qchem.inp (generated)

000729120.b3lyp_6-31g(d).gjf (generated)

000729120.b3lyp_6-31g(d).firefly.inp (generated)

000729120.b3lyp_6-31g(d).smash.inp (generated)

000729120.b3lyp_6-31g(d).nwchem.inp (generated) 000729120.b3lyp_6-31g(d).log.xz 000729120.td-b3lyp_6-31g+(d).inp 000729120.td-b3lyp_6-31g+(d).log.xz

000729120.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729120.td-b3lyp_6-31+g(d).gjf (generated)

000729120.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729120.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729120.mol 000729120.PUBCHEM 000729120.mol (via Jmol)
000729135.b3lyp_6-31g(d).inp

000729135.b3lyp_6-31g(d).qchem.inp (generated)

000729135.b3lyp_6-31g(d).gjf (generated)

000729135.b3lyp_6-31g(d).firefly.inp (generated)

000729135.b3lyp_6-31g(d).smash.inp (generated)

000729135.b3lyp_6-31g(d).nwchem.inp (generated) 000729135.b3lyp_6-31g(d).log.xz 000729135.td-b3lyp_6-31g+(d).inp 000729135.td-b3lyp_6-31g+(d).log.xz

000729135.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729135.td-b3lyp_6-31+g(d).gjf (generated)

000729135.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729135.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729135.mol 000729135.PUBCHEM 000729135.mol (via Jmol)
000729174.b3lyp_6-31g(d).inp

000729174.b3lyp_6-31g(d).qchem.inp (generated)

000729174.b3lyp_6-31g(d).gjf (generated)

000729174.b3lyp_6-31g(d).firefly.inp (generated)

000729174.b3lyp_6-31g(d).smash.inp (generated)

000729174.b3lyp_6-31g(d).nwchem.inp (generated) 000729174.b3lyp_6-31g(d).log.xz 000729174.td-b3lyp_6-31g+(d).inp 000729174.td-b3lyp_6-31g+(d).log.xz

000729174.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729174.td-b3lyp_6-31+g(d).gjf (generated)

000729174.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729174.mol 000729174.PUBCHEM 000729174.mol (via Jmol)
000729175.b3lyp_6-31g(d).inp

000729175.b3lyp_6-31g(d).qchem.inp (generated)

000729175.b3lyp_6-31g(d).gjf (generated)

000729175.b3lyp_6-31g(d).firefly.inp (generated)

000729175.b3lyp_6-31g(d).smash.inp (generated)

000729175.b3lyp_6-31g(d).nwchem.inp (generated) 000729175.b3lyp_6-31g(d).log.xz 000729175.td-b3lyp_6-31g+(d).inp 000729175.td-b3lyp_6-31g+(d).log.xz

000729175.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729175.td-b3lyp_6-31+g(d).gjf (generated)

000729175.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729175.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729175.mol 000729175.PUBCHEM 000729175.mol (via Jmol)
000729188.b3lyp_6-31g(d).inp

000729188.b3lyp_6-31g(d).qchem.inp (generated)

000729188.b3lyp_6-31g(d).gjf (generated)

000729188.b3lyp_6-31g(d).firefly.inp (generated)

000729188.b3lyp_6-31g(d).smash.inp (generated)

000729188.b3lyp_6-31g(d).nwchem.inp (generated) 000729188.b3lyp_6-31g(d).log.xz 000729188.td-b3lyp_6-31g+(d).inp 000729188.td-b3lyp_6-31g+(d).log.xz

000729188.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729188.td-b3lyp_6-31+g(d).gjf (generated)

000729188.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729188.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729188.mol 000729188.PUBCHEM 000729188.mol (via Jmol)
000729216.b3lyp_6-31g(d).inp

000729216.b3lyp_6-31g(d).qchem.inp (generated)

000729216.b3lyp_6-31g(d).gjf (generated)

000729216.b3lyp_6-31g(d).firefly.inp (generated)

000729216.b3lyp_6-31g(d).smash.inp (generated)

000729216.b3lyp_6-31g(d).nwchem.inp (generated) 000729216.b3lyp_6-31g(d).log.xz 000729216.td-b3lyp_6-31g+(d).inp 000729216.td-b3lyp_6-31g+(d).log.xz

000729216.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729216.td-b3lyp_6-31+g(d).gjf (generated)

000729216.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729216.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729216.mol 000729216.PUBCHEM 000729216.mol (via Jmol)
000729227.b3lyp_6-31g(d).inp

000729227.b3lyp_6-31g(d).qchem.inp (generated)

000729227.b3lyp_6-31g(d).gjf (generated)

000729227.b3lyp_6-31g(d).firefly.inp (generated)

000729227.b3lyp_6-31g(d).smash.inp (generated)

000729227.b3lyp_6-31g(d).nwchem.inp (generated) 000729227.b3lyp_6-31g(d).log.xz 000729227.td-b3lyp_6-31g+(d).inp 000729227.td-b3lyp_6-31g+(d).log.xz

000729227.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729227.td-b3lyp_6-31+g(d).gjf (generated)

000729227.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729227.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729227.mol 000729227.PUBCHEM 000729227.mol (via Jmol)
000729228.b3lyp_6-31g(d).inp

000729228.b3lyp_6-31g(d).qchem.inp (generated)

000729228.b3lyp_6-31g(d).gjf (generated)

000729228.b3lyp_6-31g(d).firefly.inp (generated)

000729228.b3lyp_6-31g(d).smash.inp (generated)

000729228.b3lyp_6-31g(d).nwchem.inp (generated) 000729228.b3lyp_6-31g(d).log.xz 000729228.td-b3lyp_6-31g+(d).inp 000729228.td-b3lyp_6-31g+(d).log.xz

000729228.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729228.td-b3lyp_6-31+g(d).gjf (generated)

000729228.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729228.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729228.mol 000729228.PUBCHEM 000729228.mol (via Jmol)
000729237.b3lyp_6-31g(d).inp

000729237.b3lyp_6-31g(d).qchem.inp (generated)

000729237.b3lyp_6-31g(d).gjf (generated)

000729237.b3lyp_6-31g(d).firefly.inp (generated)

000729237.b3lyp_6-31g(d).smash.inp (generated)

000729237.b3lyp_6-31g(d).nwchem.inp (generated) 000729237.b3lyp_6-31g(d).log.xz 000729237.td-b3lyp_6-31g+(d).inp 000729237.td-b3lyp_6-31g+(d).log.xz

000729237.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729237.td-b3lyp_6-31+g(d).gjf (generated)

000729237.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729237.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729237.mol 000729237.PUBCHEM 000729237.mol (via Jmol)
000729240.b3lyp_6-31g(d).inp

000729240.b3lyp_6-31g(d).qchem.inp (generated)

000729240.b3lyp_6-31g(d).gjf (generated)

000729240.b3lyp_6-31g(d).firefly.inp (generated)

000729240.b3lyp_6-31g(d).smash.inp (generated)

000729240.b3lyp_6-31g(d).nwchem.inp (generated) 000729240.b3lyp_6-31g(d).log.xz 000729240.td-b3lyp_6-31g+(d).inp 000729240.td-b3lyp_6-31g+(d).log.xz

000729240.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729240.td-b3lyp_6-31+g(d).gjf (generated)

000729240.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729240.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729240.mol 000729240.PUBCHEM 000729240.mol (via Jmol)
000729241.b3lyp_6-31g(d).inp

000729241.b3lyp_6-31g(d).qchem.inp (generated)

000729241.b3lyp_6-31g(d).gjf (generated)

000729241.b3lyp_6-31g(d).firefly.inp (generated)

000729241.b3lyp_6-31g(d).smash.inp (generated)

000729241.b3lyp_6-31g(d).nwchem.inp (generated) 000729241.b3lyp_6-31g(d).log.xz 000729241.td-b3lyp_6-31g+(d).inp 000729241.td-b3lyp_6-31g+(d).log.xz

000729241.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729241.td-b3lyp_6-31+g(d).gjf (generated)

000729241.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729241.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729241.mol 000729241.PUBCHEM 000729241.mol (via Jmol)
000729244.b3lyp_6-31g(d).inp

000729244.b3lyp_6-31g(d).qchem.inp (generated)

000729244.b3lyp_6-31g(d).gjf (generated)

000729244.b3lyp_6-31g(d).firefly.inp (generated)

000729244.b3lyp_6-31g(d).smash.inp (generated)

000729244.b3lyp_6-31g(d).nwchem.inp (generated) 000729244.b3lyp_6-31g(d).log.xz 000729244.mol 000729244.PUBCHEM 000729244.mol (via Jmol)
000729245.b3lyp_6-31g(d).inp

000729245.b3lyp_6-31g(d).qchem.inp (generated)

000729245.b3lyp_6-31g(d).gjf (generated)

000729245.b3lyp_6-31g(d).firefly.inp (generated)

000729245.b3lyp_6-31g(d).smash.inp (generated)

000729245.b3lyp_6-31g(d).nwchem.inp (generated) 000729245.b3lyp_6-31g(d).log.xz 000729245.mol 000729245.PUBCHEM 000729245.mol (via Jmol)
000729246.b3lyp_6-31g(d).inp

000729246.b3lyp_6-31g(d).qchem.inp (generated)

000729246.b3lyp_6-31g(d).gjf (generated)

000729246.b3lyp_6-31g(d).firefly.inp (generated)

000729246.b3lyp_6-31g(d).smash.inp (generated)

000729246.b3lyp_6-31g(d).nwchem.inp (generated) 000729246.b3lyp_6-31g(d).log.xz 000729246.td-b3lyp_6-31g+(d).inp 000729246.td-b3lyp_6-31g+(d).log.xz

000729246.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729246.td-b3lyp_6-31+g(d).gjf (generated)

000729246.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729246.mol 000729246.PUBCHEM 000729246.mol (via Jmol)
000729251.b3lyp_6-31g(d).inp

000729251.b3lyp_6-31g(d).qchem.inp (generated)

000729251.b3lyp_6-31g(d).gjf (generated)

000729251.b3lyp_6-31g(d).firefly.inp (generated)

000729251.b3lyp_6-31g(d).smash.inp (generated)

000729251.b3lyp_6-31g(d).nwchem.inp (generated) 000729251.b3lyp_6-31g(d).log.xz 000729251.td-b3lyp_6-31g+(d).inp 000729251.td-b3lyp_6-31g+(d).log.xz

000729251.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729251.td-b3lyp_6-31+g(d).gjf (generated)

000729251.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729251.mol 000729251.PUBCHEM 000729251.mol (via Jmol)
000729263.b3lyp_6-31g(d).inp

000729263.b3lyp_6-31g(d).qchem.inp (generated)

000729263.b3lyp_6-31g(d).gjf (generated)

000729263.b3lyp_6-31g(d).firefly.inp (generated)

000729263.b3lyp_6-31g(d).smash.inp (generated)

000729263.b3lyp_6-31g(d).nwchem.inp (generated) 000729263.b3lyp_6-31g(d).log.xz 000729263.td-b3lyp_6-31g+(d).inp 000729263.td-b3lyp_6-31g+(d).log.xz

000729263.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729263.td-b3lyp_6-31+g(d).gjf (generated)

000729263.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729263.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729263.mol 000729263.PUBCHEM 000729263.mol (via Jmol)
000729264.b3lyp_6-31g(d).inp

000729264.b3lyp_6-31g(d).qchem.inp (generated)

000729264.b3lyp_6-31g(d).gjf (generated)

000729264.b3lyp_6-31g(d).firefly.inp (generated)

000729264.b3lyp_6-31g(d).smash.inp (generated)

000729264.b3lyp_6-31g(d).nwchem.inp (generated) 000729264.b3lyp_6-31g(d).log.xz 000729264.td-b3lyp_6-31g+(d).inp 000729264.td-b3lyp_6-31g+(d).log.xz

000729264.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729264.td-b3lyp_6-31+g(d).gjf (generated)

000729264.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729264.mol 000729264.PUBCHEM 000729264.mol (via Jmol)
000729266.b3lyp_6-31g(d).inp

000729266.b3lyp_6-31g(d).qchem.inp (generated)

000729266.b3lyp_6-31g(d).gjf (generated)

000729266.b3lyp_6-31g(d).firefly.inp (generated)

000729266.b3lyp_6-31g(d).smash.inp (generated)

000729266.b3lyp_6-31g(d).nwchem.inp (generated) 000729266.b3lyp_6-31g(d).log.xz 000729266.td-b3lyp_6-31g+(d).inp 000729266.td-b3lyp_6-31g+(d).log.xz

000729266.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729266.td-b3lyp_6-31+g(d).gjf (generated)

000729266.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729266.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729266.mol 000729266.PUBCHEM 000729266.mol (via Jmol)
000729267.b3lyp_6-31g(d).inp

000729267.b3lyp_6-31g(d).qchem.inp (generated)

000729267.b3lyp_6-31g(d).gjf (generated)

000729267.b3lyp_6-31g(d).firefly.inp (generated)

000729267.b3lyp_6-31g(d).smash.inp (generated)

000729267.b3lyp_6-31g(d).nwchem.inp (generated) 000729267.b3lyp_6-31g(d).log.xz 000729267.td-b3lyp_6-31g+(d).inp 000729267.td-b3lyp_6-31g+(d).log.xz

000729267.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729267.td-b3lyp_6-31+g(d).gjf (generated)

000729267.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729267.mol 000729267.PUBCHEM 000729267.mol (via Jmol)
000729273.b3lyp_6-31g(d).inp

000729273.b3lyp_6-31g(d).qchem.inp (generated)

000729273.b3lyp_6-31g(d).gjf (generated)

000729273.b3lyp_6-31g(d).firefly.inp (generated)

000729273.b3lyp_6-31g(d).smash.inp (generated)

000729273.b3lyp_6-31g(d).nwchem.inp (generated) 000729273.b3lyp_6-31g(d).log.xz 000729273.td-b3lyp_6-31g+(d).inp 000729273.td-b3lyp_6-31g+(d).log.xz

000729273.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729273.td-b3lyp_6-31+g(d).gjf (generated)

000729273.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729273.mol 000729273.PUBCHEM 000729273.mol (via Jmol)
000729283.b3lyp_6-31g(d).inp

000729283.b3lyp_6-31g(d).qchem.inp (generated)

000729283.b3lyp_6-31g(d).gjf (generated)

000729283.b3lyp_6-31g(d).firefly.inp (generated)

000729283.b3lyp_6-31g(d).smash.inp (generated)

000729283.b3lyp_6-31g(d).nwchem.inp (generated) 000729283.b3lyp_6-31g(d).log.xz 000729283.td-b3lyp_6-31g+(d).inp 000729283.td-b3lyp_6-31g+(d).log.xz

000729283.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729283.td-b3lyp_6-31+g(d).gjf (generated)

000729283.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729283.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729283.mol 000729283.PUBCHEM 000729283.mol (via Jmol)
000729284.b3lyp_6-31g(d).inp

000729284.b3lyp_6-31g(d).qchem.inp (generated)

000729284.b3lyp_6-31g(d).gjf (generated)

000729284.b3lyp_6-31g(d).firefly.inp (generated)

000729284.b3lyp_6-31g(d).smash.inp (generated)

000729284.b3lyp_6-31g(d).nwchem.inp (generated) 000729284.b3lyp_6-31g(d).log.xz 000729284.td-b3lyp_6-31g+(d).inp 000729284.td-b3lyp_6-31g+(d).log.xz

000729284.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729284.td-b3lyp_6-31+g(d).gjf (generated)

000729284.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729284.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729284.mol 000729284.PUBCHEM 000729284.mol (via Jmol)
000729306.b3lyp_6-31g(d).inp

000729306.b3lyp_6-31g(d).qchem.inp (generated)

000729306.b3lyp_6-31g(d).gjf (generated)

000729306.b3lyp_6-31g(d).firefly.inp (generated)

000729306.b3lyp_6-31g(d).smash.inp (generated)

000729306.b3lyp_6-31g(d).nwchem.inp (generated) 000729306.b3lyp_6-31g(d).log.xz 000729306.mol 000729306.PUBCHEM 000729306.mol (via Jmol)
000729313.b3lyp_6-31g(d).inp

000729313.b3lyp_6-31g(d).qchem.inp (generated)

000729313.b3lyp_6-31g(d).gjf (generated)

000729313.b3lyp_6-31g(d).firefly.inp (generated)

000729313.b3lyp_6-31g(d).smash.inp (generated)

000729313.b3lyp_6-31g(d).nwchem.inp (generated) 000729313.b3lyp_6-31g(d).log.xz 000729313.td-b3lyp_6-31g+(d).inp 000729313.td-b3lyp_6-31g+(d).log.xz

000729313.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729313.td-b3lyp_6-31+g(d).gjf (generated)

000729313.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729313.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729313.mol 000729313.PUBCHEM 000729313.mol (via Jmol)
000729323.b3lyp_6-31g(d).inp

000729323.b3lyp_6-31g(d).qchem.inp (generated)

000729323.b3lyp_6-31g(d).gjf (generated)

000729323.b3lyp_6-31g(d).firefly.inp (generated)

000729323.b3lyp_6-31g(d).smash.inp (generated)

000729323.b3lyp_6-31g(d).nwchem.inp (generated) 000729323.b3lyp_6-31g(d).log.xz 000729323.mol 000729323.PUBCHEM 000729323.mol (via Jmol)
000729324.b3lyp_6-31g(d).inp

000729324.b3lyp_6-31g(d).qchem.inp (generated)

000729324.b3lyp_6-31g(d).gjf (generated)

000729324.b3lyp_6-31g(d).firefly.inp (generated)

000729324.b3lyp_6-31g(d).smash.inp (generated)

000729324.b3lyp_6-31g(d).nwchem.inp (generated) 000729324.b3lyp_6-31g(d).log.xz 000729324.td-b3lyp_6-31g+(d).inp 000729324.td-b3lyp_6-31g+(d).log.xz

000729324.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729324.td-b3lyp_6-31+g(d).gjf (generated)

000729324.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729324.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729324.mol 000729324.PUBCHEM 000729324.mol (via Jmol)
000729329.b3lyp_6-31g(d).inp

000729329.b3lyp_6-31g(d).qchem.inp (generated)

000729329.b3lyp_6-31g(d).gjf (generated)

000729329.b3lyp_6-31g(d).firefly.inp (generated)

000729329.b3lyp_6-31g(d).smash.inp (generated)

000729329.b3lyp_6-31g(d).nwchem.inp (generated) 000729329.b3lyp_6-31g(d).log.xz 000729329.td-b3lyp_6-31g+(d).inp 000729329.td-b3lyp_6-31g+(d).log.xz

000729329.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729329.td-b3lyp_6-31+g(d).gjf (generated)

000729329.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729329.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729329.mol 000729329.PUBCHEM 000729329.mol (via Jmol)
000729334.b3lyp_6-31g(d).inp

000729334.b3lyp_6-31g(d).qchem.inp (generated)

000729334.b3lyp_6-31g(d).gjf (generated)

000729334.b3lyp_6-31g(d).firefly.inp (generated)

000729334.b3lyp_6-31g(d).smash.inp (generated)

000729334.b3lyp_6-31g(d).nwchem.inp (generated) 000729334.b3lyp_6-31g(d).log.xz 000729334.td-b3lyp_6-31g+(d).inp 000729334.td-b3lyp_6-31g+(d).log.xz

000729334.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729334.td-b3lyp_6-31+g(d).gjf (generated)

000729334.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729334.mol 000729334.PUBCHEM 000729334.mol (via Jmol)
000729336.b3lyp_6-31g(d).inp

000729336.b3lyp_6-31g(d).qchem.inp (generated)

000729336.b3lyp_6-31g(d).gjf (generated)

000729336.b3lyp_6-31g(d).firefly.inp (generated)

000729336.b3lyp_6-31g(d).smash.inp (generated)

000729336.b3lyp_6-31g(d).nwchem.inp (generated) 000729336.b3lyp_6-31g(d).log.xz 000729336.td-b3lyp_6-31g+(d).inp 000729336.td-b3lyp_6-31g+(d).log.xz

000729336.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729336.td-b3lyp_6-31+g(d).gjf (generated)

000729336.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729336.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729336.mol 000729336.PUBCHEM 000729336.mol (via Jmol)
000729358.b3lyp_6-31g(d).inp

000729358.b3lyp_6-31g(d).qchem.inp (generated)

000729358.b3lyp_6-31g(d).gjf (generated)

000729358.b3lyp_6-31g(d).firefly.inp (generated)

000729358.b3lyp_6-31g(d).smash.inp (generated)

000729358.b3lyp_6-31g(d).nwchem.inp (generated) 000729358.b3lyp_6-31g(d).log.xz 000729358.mol 000729358.PUBCHEM 000729358.mol (via Jmol)
000729359.b3lyp_6-31g(d).inp

000729359.b3lyp_6-31g(d).qchem.inp (generated)

000729359.b3lyp_6-31g(d).gjf (generated)

000729359.b3lyp_6-31g(d).firefly.inp (generated)

000729359.b3lyp_6-31g(d).smash.inp (generated)

000729359.b3lyp_6-31g(d).nwchem.inp (generated) 000729359.b3lyp_6-31g(d).log.xz 000729359.td-b3lyp_6-31g+(d).inp 000729359.td-b3lyp_6-31g+(d).log.xz

000729359.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729359.td-b3lyp_6-31+g(d).gjf (generated)

000729359.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729359.mol 000729359.PUBCHEM 000729359.mol (via Jmol)
000729360.b3lyp_6-31g(d).inp

000729360.b3lyp_6-31g(d).qchem.inp (generated)

000729360.b3lyp_6-31g(d).gjf (generated)

000729360.b3lyp_6-31g(d).firefly.inp (generated)

000729360.b3lyp_6-31g(d).smash.inp (generated)

000729360.b3lyp_6-31g(d).nwchem.inp (generated) 000729360.b3lyp_6-31g(d).log.xz 000729360.td-b3lyp_6-31g+(d).inp 000729360.td-b3lyp_6-31g+(d).log.xz

000729360.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729360.td-b3lyp_6-31+g(d).gjf (generated)

000729360.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729360.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729360.mol 000729360.PUBCHEM 000729360.mol (via Jmol)
000729377.b3lyp_6-31g(d).inp

000729377.b3lyp_6-31g(d).qchem.inp (generated)

000729377.b3lyp_6-31g(d).gjf (generated)

000729377.b3lyp_6-31g(d).firefly.inp (generated)

000729377.b3lyp_6-31g(d).smash.inp (generated)

000729377.b3lyp_6-31g(d).nwchem.inp (generated) 000729377.b3lyp_6-31g(d).log.xz 000729377.td-b3lyp_6-31g+(d).inp 000729377.td-b3lyp_6-31g+(d).log.xz

000729377.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729377.td-b3lyp_6-31+g(d).gjf (generated)

000729377.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729377.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729377.mol 000729377.PUBCHEM 000729377.mol (via Jmol)
000729410.b3lyp_6-31g(d).inp

000729410.b3lyp_6-31g(d).qchem.inp (generated)

000729410.b3lyp_6-31g(d).gjf (generated)

000729410.b3lyp_6-31g(d).firefly.inp (generated)

000729410.b3lyp_6-31g(d).smash.inp (generated)

000729410.b3lyp_6-31g(d).nwchem.inp (generated) 000729410.b3lyp_6-31g(d).log.xz 000729410.td-b3lyp_6-31g+(d).inp 000729410.td-b3lyp_6-31g+(d).log.xz

000729410.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729410.td-b3lyp_6-31+g(d).gjf (generated)

000729410.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729410.mol 000729410.PUBCHEM 000729410.mol (via Jmol)
000729413.b3lyp_6-31g(d).inp

000729413.b3lyp_6-31g(d).qchem.inp (generated)

000729413.b3lyp_6-31g(d).gjf (generated)

000729413.b3lyp_6-31g(d).firefly.inp (generated)

000729413.b3lyp_6-31g(d).smash.inp (generated)

000729413.b3lyp_6-31g(d).nwchem.inp (generated) 000729413.b3lyp_6-31g(d).log.xz 000729413.td-b3lyp_6-31g+(d).inp 000729413.td-b3lyp_6-31g+(d).log.xz

000729413.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729413.td-b3lyp_6-31+g(d).gjf (generated)

000729413.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729413.mol 000729413.PUBCHEM 000729413.mol (via Jmol)
000729454.b3lyp_6-31g(d).inp

000729454.b3lyp_6-31g(d).qchem.inp (generated)

000729454.b3lyp_6-31g(d).gjf (generated)

000729454.b3lyp_6-31g(d).firefly.inp (generated)

000729454.b3lyp_6-31g(d).smash.inp (generated)

000729454.b3lyp_6-31g(d).nwchem.inp (generated) 000729454.b3lyp_6-31g(d).log.xz 000729454.td-b3lyp_6-31g+(d).inp 000729454.td-b3lyp_6-31g+(d).log.xz

000729454.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729454.td-b3lyp_6-31+g(d).gjf (generated)

000729454.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729454.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729454.mol 000729454.PUBCHEM 000729454.mol (via Jmol)
000729490.b3lyp_6-31g(d).inp

000729490.b3lyp_6-31g(d).qchem.inp (generated)

000729490.b3lyp_6-31g(d).gjf (generated)

000729490.b3lyp_6-31g(d).firefly.inp (generated)

000729490.b3lyp_6-31g(d).smash.inp (generated)

000729490.b3lyp_6-31g(d).nwchem.inp (generated) 000729490.b3lyp_6-31g(d).log.xz 000729490.td-b3lyp_6-31g+(d).inp 000729490.td-b3lyp_6-31g+(d).log.xz

000729490.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729490.td-b3lyp_6-31+g(d).gjf (generated)

000729490.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729490.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729490.mol 000729490.PUBCHEM 000729490.mol (via Jmol)
000729492.b3lyp_6-31g(d).inp

000729492.b3lyp_6-31g(d).qchem.inp (generated)

000729492.b3lyp_6-31g(d).gjf (generated)

000729492.b3lyp_6-31g(d).firefly.inp (generated)

000729492.b3lyp_6-31g(d).smash.inp (generated)

000729492.b3lyp_6-31g(d).nwchem.inp (generated) 000729492.b3lyp_6-31g(d).log.xz 000729492.td-b3lyp_6-31g+(d).inp 000729492.td-b3lyp_6-31g+(d).log.xz

000729492.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729492.td-b3lyp_6-31+g(d).gjf (generated)

000729492.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729492.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729492.mol 000729492.PUBCHEM 000729492.mol (via Jmol)
000729495.b3lyp_6-31g(d).inp

000729495.b3lyp_6-31g(d).qchem.inp (generated)

000729495.b3lyp_6-31g(d).gjf (generated)

000729495.b3lyp_6-31g(d).firefly.inp (generated)

000729495.b3lyp_6-31g(d).smash.inp (generated)

000729495.b3lyp_6-31g(d).nwchem.inp (generated) 000729495.b3lyp_6-31g(d).log.xz 000729495.td-b3lyp_6-31g+(d).inp 000729495.td-b3lyp_6-31g+(d).log.xz

000729495.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729495.td-b3lyp_6-31+g(d).gjf (generated)

000729495.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729495.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729495.mol 000729495.PUBCHEM 000729495.mol (via Jmol)
000729500.b3lyp_6-31g(d).inp

000729500.b3lyp_6-31g(d).qchem.inp (generated)

000729500.b3lyp_6-31g(d).gjf (generated)

000729500.b3lyp_6-31g(d).firefly.inp (generated)

000729500.b3lyp_6-31g(d).smash.inp (generated)

000729500.b3lyp_6-31g(d).nwchem.inp (generated) 000729500.b3lyp_6-31g(d).log.xz 000729500.td-b3lyp_6-31g+(d).inp 000729500.td-b3lyp_6-31g+(d).log.xz

000729500.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729500.td-b3lyp_6-31+g(d).gjf (generated)

000729500.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729500.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729500.mol 000729500.PUBCHEM 000729500.mol (via Jmol)
000729501.b3lyp_6-31g(d).inp

000729501.b3lyp_6-31g(d).qchem.inp (generated)

000729501.b3lyp_6-31g(d).gjf (generated)

000729501.b3lyp_6-31g(d).firefly.inp (generated)

000729501.b3lyp_6-31g(d).smash.inp (generated)

000729501.b3lyp_6-31g(d).nwchem.inp (generated) 000729501.b3lyp_6-31g(d).log.xz 000729501.mol 000729501.PUBCHEM 000729501.mol (via Jmol)
000729512.b3lyp_6-31g(d).inp

000729512.b3lyp_6-31g(d).qchem.inp (generated)

000729512.b3lyp_6-31g(d).gjf (generated)

000729512.b3lyp_6-31g(d).firefly.inp (generated)

000729512.b3lyp_6-31g(d).smash.inp (generated)

000729512.b3lyp_6-31g(d).nwchem.inp (generated) 000729512.b3lyp_6-31g(d).log.xz 000729512.td-b3lyp_6-31g+(d).inp 000729512.td-b3lyp_6-31g+(d).log.xz

000729512.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729512.td-b3lyp_6-31+g(d).gjf (generated)

000729512.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729512.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729512.mol 000729512.PUBCHEM 000729512.mol (via Jmol)
000729534.b3lyp_6-31g(d).inp

000729534.b3lyp_6-31g(d).qchem.inp (generated)

000729534.b3lyp_6-31g(d).gjf (generated)

000729534.b3lyp_6-31g(d).firefly.inp (generated)

000729534.b3lyp_6-31g(d).smash.inp (generated)

000729534.b3lyp_6-31g(d).nwchem.inp (generated) 000729534.b3lyp_6-31g(d).log.xz 000729534.mol 000729534.PUBCHEM 000729534.mol (via Jmol)
000729542.b3lyp_6-31g(d).inp

000729542.b3lyp_6-31g(d).qchem.inp (generated)

000729542.b3lyp_6-31g(d).gjf (generated)

000729542.b3lyp_6-31g(d).firefly.inp (generated)

000729542.b3lyp_6-31g(d).smash.inp (generated)

000729542.b3lyp_6-31g(d).nwchem.inp (generated) 000729542.b3lyp_6-31g(d).log.xz 000729542.td-b3lyp_6-31g+(d).inp 000729542.td-b3lyp_6-31g+(d).log.xz

000729542.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729542.td-b3lyp_6-31+g(d).gjf (generated)

000729542.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729542.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729542.mol 000729542.PUBCHEM 000729542.mol (via Jmol)
000729550.b3lyp_6-31g(d).inp

000729550.b3lyp_6-31g(d).qchem.inp (generated)

000729550.b3lyp_6-31g(d).gjf (generated)

000729550.b3lyp_6-31g(d).firefly.inp (generated)

000729550.b3lyp_6-31g(d).smash.inp (generated)

000729550.b3lyp_6-31g(d).nwchem.inp (generated) 000729550.b3lyp_6-31g(d).log.xz 000729550.td-b3lyp_6-31g+(d).inp 000729550.td-b3lyp_6-31g+(d).log.xz

000729550.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729550.td-b3lyp_6-31+g(d).gjf (generated)

000729550.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729550.mol 000729550.PUBCHEM 000729550.mol (via Jmol)
000729551.b3lyp_6-31g(d).inp

000729551.b3lyp_6-31g(d).qchem.inp (generated)

000729551.b3lyp_6-31g(d).gjf (generated)

000729551.b3lyp_6-31g(d).firefly.inp (generated)

000729551.b3lyp_6-31g(d).smash.inp (generated)

000729551.b3lyp_6-31g(d).nwchem.inp (generated) 000729551.b3lyp_6-31g(d).log.xz 000729551.td-b3lyp_6-31g+(d).inp 000729551.td-b3lyp_6-31g+(d).log.xz

000729551.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729551.td-b3lyp_6-31+g(d).gjf (generated)

000729551.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729551.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729551.mol 000729551.PUBCHEM 000729551.mol (via Jmol)
000729558.b3lyp_6-31g(d).inp

000729558.b3lyp_6-31g(d).qchem.inp (generated)

000729558.b3lyp_6-31g(d).gjf (generated)

000729558.b3lyp_6-31g(d).firefly.inp (generated)

000729558.b3lyp_6-31g(d).smash.inp (generated)

000729558.b3lyp_6-31g(d).nwchem.inp (generated) 000729558.b3lyp_6-31g(d).log.xz 000729558.td-b3lyp_6-31g+(d).inp 000729558.td-b3lyp_6-31g+(d).log.xz

000729558.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729558.td-b3lyp_6-31+g(d).gjf (generated)

000729558.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729558.mol 000729558.PUBCHEM 000729558.mol (via Jmol)
000729566.b3lyp_6-31g(d).inp

000729566.b3lyp_6-31g(d).qchem.inp (generated)

000729566.b3lyp_6-31g(d).gjf (generated)

000729566.b3lyp_6-31g(d).firefly.inp (generated)

000729566.b3lyp_6-31g(d).smash.inp (generated)

000729566.b3lyp_6-31g(d).nwchem.inp (generated) 000729566.b3lyp_6-31g(d).log.xz 000729566.td-b3lyp_6-31g+(d).inp 000729566.td-b3lyp_6-31g+(d).log.xz

000729566.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729566.td-b3lyp_6-31+g(d).gjf (generated)

000729566.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729566.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729566.mol 000729566.PUBCHEM 000729566.mol (via Jmol)
000729578.b3lyp_6-31g(d).inp

000729578.b3lyp_6-31g(d).qchem.inp (generated)

000729578.b3lyp_6-31g(d).gjf (generated)

000729578.b3lyp_6-31g(d).firefly.inp (generated)

000729578.b3lyp_6-31g(d).smash.inp (generated)

000729578.b3lyp_6-31g(d).nwchem.inp (generated) 000729578.b3lyp_6-31g(d).log.xz 000729578.mol 000729578.PUBCHEM 000729578.mol (via Jmol)
000729588.b3lyp_6-31g(d).inp

000729588.b3lyp_6-31g(d).qchem.inp (generated)

000729588.b3lyp_6-31g(d).gjf (generated)

000729588.b3lyp_6-31g(d).firefly.inp (generated)

000729588.b3lyp_6-31g(d).smash.inp (generated)

000729588.b3lyp_6-31g(d).nwchem.inp (generated) 000729588.b3lyp_6-31g(d).log.xz 000729588.td-b3lyp_6-31g+(d).inp 000729588.td-b3lyp_6-31g+(d).log.xz

000729588.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729588.td-b3lyp_6-31+g(d).gjf (generated)

000729588.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729588.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729588.mol 000729588.PUBCHEM 000729588.mol (via Jmol)
000729600.b3lyp_6-31g(d).inp

000729600.b3lyp_6-31g(d).qchem.inp (generated)

000729600.b3lyp_6-31g(d).gjf (generated)

000729600.b3lyp_6-31g(d).firefly.inp (generated)

000729600.b3lyp_6-31g(d).smash.inp (generated)

000729600.b3lyp_6-31g(d).nwchem.inp (generated) 000729600.b3lyp_6-31g(d).log.xz 000729600.td-b3lyp_6-31g+(d).inp 000729600.td-b3lyp_6-31g+(d).log.xz

000729600.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729600.td-b3lyp_6-31+g(d).gjf (generated)

000729600.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729600.mol 000729600.PUBCHEM 000729600.mol (via Jmol)
000729614.b3lyp_6-31g(d).inp

000729614.b3lyp_6-31g(d).qchem.inp (generated)

000729614.b3lyp_6-31g(d).gjf (generated)

000729614.b3lyp_6-31g(d).firefly.inp (generated)

000729614.b3lyp_6-31g(d).smash.inp (generated)

000729614.b3lyp_6-31g(d).nwchem.inp (generated) 000729614.b3lyp_6-31g(d).log.xz 000729614.td-b3lyp_6-31g+(d).inp 000729614.td-b3lyp_6-31g+(d).log.xz

000729614.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729614.td-b3lyp_6-31+g(d).gjf (generated)

000729614.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729614.mol 000729614.PUBCHEM 000729614.mol (via Jmol)
000729616.b3lyp_6-31g(d).inp

000729616.b3lyp_6-31g(d).qchem.inp (generated)

000729616.b3lyp_6-31g(d).gjf (generated)

000729616.b3lyp_6-31g(d).firefly.inp (generated)

000729616.b3lyp_6-31g(d).smash.inp (generated)

000729616.b3lyp_6-31g(d).nwchem.inp (generated) 000729616.b3lyp_6-31g(d).log.xz 000729616.td-b3lyp_6-31g+(d).inp 000729616.td-b3lyp_6-31g+(d).log.xz

000729616.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729616.td-b3lyp_6-31+g(d).gjf (generated)

000729616.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729616.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729616.mol 000729616.PUBCHEM 000729616.mol (via Jmol)
000729621.b3lyp_6-31g(d).inp

000729621.b3lyp_6-31g(d).qchem.inp (generated)

000729621.b3lyp_6-31g(d).gjf (generated)

000729621.b3lyp_6-31g(d).firefly.inp (generated)

000729621.b3lyp_6-31g(d).smash.inp (generated)

000729621.b3lyp_6-31g(d).nwchem.inp (generated) 000729621.b3lyp_6-31g(d).log.xz 000729621.td-b3lyp_6-31g+(d).inp 000729621.td-b3lyp_6-31g+(d).log.xz

000729621.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729621.td-b3lyp_6-31+g(d).gjf (generated)

000729621.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729621.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729621.mol 000729621.PUBCHEM 000729621.mol (via Jmol)
000729628.b3lyp_6-31g(d).inp

000729628.b3lyp_6-31g(d).qchem.inp (generated)

000729628.b3lyp_6-31g(d).gjf (generated)

000729628.b3lyp_6-31g(d).firefly.inp (generated)

000729628.b3lyp_6-31g(d).smash.inp (generated)

000729628.b3lyp_6-31g(d).nwchem.inp (generated) 000729628.b3lyp_6-31g(d).log.xz 000729628.mol 000729628.PUBCHEM 000729628.mol (via Jmol)
000729629.b3lyp_6-31g(d).inp

000729629.b3lyp_6-31g(d).qchem.inp (generated)

000729629.b3lyp_6-31g(d).gjf (generated)

000729629.b3lyp_6-31g(d).firefly.inp (generated)

000729629.b3lyp_6-31g(d).smash.inp (generated)

000729629.b3lyp_6-31g(d).nwchem.inp (generated) 000729629.b3lyp_6-31g(d).log.xz 000729629.mol 000729629.PUBCHEM 000729629.mol (via Jmol)
000729699.b3lyp_6-31g(d).inp

000729699.b3lyp_6-31g(d).qchem.inp (generated)

000729699.b3lyp_6-31g(d).gjf (generated)

000729699.b3lyp_6-31g(d).firefly.inp (generated)

000729699.b3lyp_6-31g(d).smash.inp (generated)

000729699.b3lyp_6-31g(d).nwchem.inp (generated) 000729699.b3lyp_6-31g(d).log.xz 000729699.td-b3lyp_6-31g+(d).inp 000729699.td-b3lyp_6-31g+(d).log.xz

000729699.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729699.td-b3lyp_6-31+g(d).gjf (generated)

000729699.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729699.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729699.mol 000729699.PUBCHEM 000729699.mol (via Jmol)
000729751.b3lyp_6-31g(d).inp

000729751.b3lyp_6-31g(d).qchem.inp (generated)

000729751.b3lyp_6-31g(d).gjf (generated)

000729751.b3lyp_6-31g(d).firefly.inp (generated)

000729751.b3lyp_6-31g(d).smash.inp (generated)

000729751.b3lyp_6-31g(d).nwchem.inp (generated) 000729751.b3lyp_6-31g(d).log.xz 000729751.td-b3lyp_6-31g+(d).inp 000729751.td-b3lyp_6-31g+(d).log.xz

000729751.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729751.td-b3lyp_6-31+g(d).gjf (generated)

000729751.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729751.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729751.mol 000729751.PUBCHEM 000729751.mol (via Jmol)
000729761.b3lyp_6-31g(d).inp

000729761.b3lyp_6-31g(d).qchem.inp (generated)

000729761.b3lyp_6-31g(d).gjf (generated)

000729761.b3lyp_6-31g(d).firefly.inp (generated)

000729761.b3lyp_6-31g(d).smash.inp (generated)

000729761.b3lyp_6-31g(d).nwchem.inp (generated) 000729761.b3lyp_6-31g(d).log.xz 000729761.td-b3lyp_6-31g+(d).inp 000729761.td-b3lyp_6-31g+(d).log.xz

000729761.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729761.td-b3lyp_6-31+g(d).gjf (generated)

000729761.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729761.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729761.mol 000729761.PUBCHEM 000729761.mol (via Jmol)
000729762.b3lyp_6-31g(d).inp

000729762.b3lyp_6-31g(d).qchem.inp (generated)

000729762.b3lyp_6-31g(d).gjf (generated)

000729762.b3lyp_6-31g(d).firefly.inp (generated)

000729762.b3lyp_6-31g(d).smash.inp (generated)

000729762.b3lyp_6-31g(d).nwchem.inp (generated) 000729762.b3lyp_6-31g(d).log.xz 000729762.td-b3lyp_6-31g+(d).inp 000729762.td-b3lyp_6-31g+(d).log.xz

000729762.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729762.td-b3lyp_6-31+g(d).gjf (generated)

000729762.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729762.mol 000729762.PUBCHEM 000729762.mol (via Jmol)
000729785.b3lyp_6-31g(d).inp

000729785.b3lyp_6-31g(d).qchem.inp (generated)

000729785.b3lyp_6-31g(d).gjf (generated)

000729785.b3lyp_6-31g(d).firefly.inp (generated)

000729785.b3lyp_6-31g(d).smash.inp (generated)

000729785.b3lyp_6-31g(d).nwchem.inp (generated) 000729785.b3lyp_6-31g(d).log.xz 000729785.mol 000729785.PUBCHEM 000729785.mol (via Jmol)
000729789.b3lyp_6-31g(d).inp

000729789.b3lyp_6-31g(d).qchem.inp (generated)

000729789.b3lyp_6-31g(d).gjf (generated)

000729789.b3lyp_6-31g(d).firefly.inp (generated)

000729789.b3lyp_6-31g(d).smash.inp (generated)

000729789.b3lyp_6-31g(d).nwchem.inp (generated) 000729789.b3lyp_6-31g(d).log.xz 000729789.td-b3lyp_6-31g+(d).inp 000729789.td-b3lyp_6-31g+(d).log.xz

000729789.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729789.td-b3lyp_6-31+g(d).gjf (generated)

000729789.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729789.mol 000729789.PUBCHEM 000729789.mol (via Jmol)
000729790.b3lyp_6-31g(d).inp

000729790.b3lyp_6-31g(d).qchem.inp (generated)

000729790.b3lyp_6-31g(d).gjf (generated)

000729790.b3lyp_6-31g(d).firefly.inp (generated)

000729790.b3lyp_6-31g(d).smash.inp (generated)

000729790.b3lyp_6-31g(d).nwchem.inp (generated) 000729790.b3lyp_6-31g(d).log.xz 000729790.td-b3lyp_6-31g+(d).inp 000729790.td-b3lyp_6-31g+(d).log.xz

000729790.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729790.td-b3lyp_6-31+g(d).gjf (generated)

000729790.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729790.mol 000729790.PUBCHEM 000729790.mol (via Jmol)
000729801.b3lyp_6-31g(d).inp

000729801.b3lyp_6-31g(d).qchem.inp (generated)

000729801.b3lyp_6-31g(d).gjf (generated)

000729801.b3lyp_6-31g(d).firefly.inp (generated)

000729801.b3lyp_6-31g(d).smash.inp (generated)

000729801.b3lyp_6-31g(d).nwchem.inp (generated) 000729801.b3lyp_6-31g(d).log.xz 000729801.td-b3lyp_6-31g+(d).inp 000729801.td-b3lyp_6-31g+(d).log.xz

000729801.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729801.td-b3lyp_6-31+g(d).gjf (generated)

000729801.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729801.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729801.mol 000729801.PUBCHEM 000729801.mol (via Jmol)
000729802.b3lyp_6-31g(d).inp

000729802.b3lyp_6-31g(d).qchem.inp (generated)

000729802.b3lyp_6-31g(d).gjf (generated)

000729802.b3lyp_6-31g(d).firefly.inp (generated)

000729802.b3lyp_6-31g(d).smash.inp (generated)

000729802.b3lyp_6-31g(d).nwchem.inp (generated) 000729802.b3lyp_6-31g(d).log.xz 000729802.td-b3lyp_6-31g+(d).inp 000729802.td-b3lyp_6-31g+(d).log.xz

000729802.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729802.td-b3lyp_6-31+g(d).gjf (generated)

000729802.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729802.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729802.mol 000729802.PUBCHEM 000729802.mol (via Jmol)
000729838.b3lyp_6-31g(d).inp

000729838.b3lyp_6-31g(d).qchem.inp (generated)

000729838.b3lyp_6-31g(d).gjf (generated)

000729838.b3lyp_6-31g(d).firefly.inp (generated)

000729838.b3lyp_6-31g(d).smash.inp (generated)

000729838.b3lyp_6-31g(d).nwchem.inp (generated) 000729838.b3lyp_6-31g(d).log.xz 000729838.td-b3lyp_6-31g+(d).inp 000729838.td-b3lyp_6-31g+(d).log.xz

000729838.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729838.td-b3lyp_6-31+g(d).gjf (generated)

000729838.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729838.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729838.mol 000729838.PUBCHEM 000729838.mol (via Jmol)
000729857.b3lyp_6-31g(d).inp

000729857.b3lyp_6-31g(d).qchem.inp (generated)

000729857.b3lyp_6-31g(d).gjf (generated)

000729857.b3lyp_6-31g(d).firefly.inp (generated)

000729857.b3lyp_6-31g(d).smash.inp (generated)

000729857.b3lyp_6-31g(d).nwchem.inp (generated) 000729857.b3lyp_6-31g(d).log.xz 000729857.td-b3lyp_6-31g+(d).inp 000729857.td-b3lyp_6-31g+(d).log.xz

000729857.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729857.td-b3lyp_6-31+g(d).gjf (generated)

000729857.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729857.mol 000729857.PUBCHEM 000729857.mol (via Jmol)
000729864.b3lyp_6-31g(d).inp

000729864.b3lyp_6-31g(d).qchem.inp (generated)

000729864.b3lyp_6-31g(d).gjf (generated)

000729864.b3lyp_6-31g(d).firefly.inp (generated)

000729864.b3lyp_6-31g(d).smash.inp (generated)

000729864.b3lyp_6-31g(d).nwchem.inp (generated) 000729864.b3lyp_6-31g(d).log.xz 000729864.td-b3lyp_6-31g+(d).inp 000729864.td-b3lyp_6-31g+(d).log.xz

000729864.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729864.td-b3lyp_6-31+g(d).gjf (generated)

000729864.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729864.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729864.mol 000729864.PUBCHEM 000729864.mol (via Jmol)
000729938.b3lyp_6-31g(d).inp

000729938.b3lyp_6-31g(d).qchem.inp (generated)

000729938.b3lyp_6-31g(d).gjf (generated)

000729938.b3lyp_6-31g(d).firefly.inp (generated)

000729938.b3lyp_6-31g(d).smash.inp (generated)

000729938.b3lyp_6-31g(d).nwchem.inp (generated) 000729938.b3lyp_6-31g(d).log.xz 000729938.td-b3lyp_6-31g+(d).inp 000729938.td-b3lyp_6-31g+(d).log.xz

000729938.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729938.td-b3lyp_6-31+g(d).gjf (generated)

000729938.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729938.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729938.mol 000729938.PUBCHEM 000729938.mol (via Jmol)
000729940.b3lyp_6-31g(d).inp

000729940.b3lyp_6-31g(d).qchem.inp (generated)

000729940.b3lyp_6-31g(d).gjf (generated)

000729940.b3lyp_6-31g(d).firefly.inp (generated)

000729940.b3lyp_6-31g(d).smash.inp (generated)

000729940.b3lyp_6-31g(d).nwchem.inp (generated) 000729940.b3lyp_6-31g(d).log.xz 000729940.td-b3lyp_6-31g+(d).inp 000729940.td-b3lyp_6-31g+(d).log.xz

000729940.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729940.td-b3lyp_6-31+g(d).gjf (generated)

000729940.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729940.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729940.mol 000729940.PUBCHEM 000729940.mol (via Jmol)
000729941.b3lyp_6-31g(d).inp

000729941.b3lyp_6-31g(d).qchem.inp (generated)

000729941.b3lyp_6-31g(d).gjf (generated)

000729941.b3lyp_6-31g(d).firefly.inp (generated)

000729941.b3lyp_6-31g(d).smash.inp (generated)

000729941.b3lyp_6-31g(d).nwchem.inp (generated) 000729941.b3lyp_6-31g(d).log.xz 000729941.mol 000729941.PUBCHEM 000729941.mol (via Jmol)
000729942.b3lyp_6-31g(d).inp

000729942.b3lyp_6-31g(d).qchem.inp (generated)

000729942.b3lyp_6-31g(d).gjf (generated)

000729942.b3lyp_6-31g(d).firefly.inp (generated)

000729942.b3lyp_6-31g(d).smash.inp (generated)

000729942.b3lyp_6-31g(d).nwchem.inp (generated) 000729942.b3lyp_6-31g(d).log.xz 000729942.mol 000729942.PUBCHEM 000729942.mol (via Jmol)
000729943.b3lyp_6-31g(d).inp

000729943.b3lyp_6-31g(d).qchem.inp (generated)

000729943.b3lyp_6-31g(d).gjf (generated)

000729943.b3lyp_6-31g(d).firefly.inp (generated)

000729943.b3lyp_6-31g(d).smash.inp (generated)

000729943.b3lyp_6-31g(d).nwchem.inp (generated) 000729943.b3lyp_6-31g(d).log.xz 000729943.mol 000729943.PUBCHEM 000729943.mol (via Jmol)
000729951.b3lyp_6-31g(d).inp

000729951.b3lyp_6-31g(d).qchem.inp (generated)

000729951.b3lyp_6-31g(d).gjf (generated)

000729951.b3lyp_6-31g(d).firefly.inp (generated)

000729951.b3lyp_6-31g(d).smash.inp (generated)

000729951.b3lyp_6-31g(d).nwchem.inp (generated) 000729951.b3lyp_6-31g(d).log.xz 000729951.mol 000729951.PUBCHEM 000729951.mol (via Jmol)
000729953.b3lyp_6-31g(d).inp

000729953.b3lyp_6-31g(d).qchem.inp (generated)

000729953.b3lyp_6-31g(d).gjf (generated)

000729953.b3lyp_6-31g(d).firefly.inp (generated)

000729953.b3lyp_6-31g(d).smash.inp (generated)

000729953.b3lyp_6-31g(d).nwchem.inp (generated) 000729953.b3lyp_6-31g(d).log.xz 000729953.td-b3lyp_6-31g+(d).inp 000729953.td-b3lyp_6-31g+(d).log.xz

000729953.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729953.td-b3lyp_6-31+g(d).gjf (generated)

000729953.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729953.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729953.mol 000729953.PUBCHEM 000729953.mol (via Jmol)
000729961.b3lyp_6-31g(d).inp

000729961.b3lyp_6-31g(d).qchem.inp (generated)

000729961.b3lyp_6-31g(d).gjf (generated)

000729961.b3lyp_6-31g(d).firefly.inp (generated)

000729961.b3lyp_6-31g(d).smash.inp (generated)

000729961.b3lyp_6-31g(d).nwchem.inp (generated) 000729961.b3lyp_6-31g(d).log.xz 000729961.td-b3lyp_6-31g+(d).inp 000729961.td-b3lyp_6-31g+(d).log.xz

000729961.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729961.td-b3lyp_6-31+g(d).gjf (generated)

000729961.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729961.mol 000729961.PUBCHEM 000729961.mol (via Jmol)
000729965.b3lyp_6-31g(d).inp

000729965.b3lyp_6-31g(d).qchem.inp (generated)

000729965.b3lyp_6-31g(d).gjf (generated)

000729965.b3lyp_6-31g(d).firefly.inp (generated)

000729965.b3lyp_6-31g(d).smash.inp (generated)

000729965.b3lyp_6-31g(d).nwchem.inp (generated) 000729965.b3lyp_6-31g(d).log.xz 000729965.td-b3lyp_6-31g+(d).inp 000729965.td-b3lyp_6-31g+(d).log.xz

000729965.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729965.td-b3lyp_6-31+g(d).gjf (generated)

000729965.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729965.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729965.mol 000729965.PUBCHEM 000729965.mol (via Jmol)
000729975.b3lyp_6-31g(d).inp

000729975.b3lyp_6-31g(d).qchem.inp (generated)

000729975.b3lyp_6-31g(d).gjf (generated)

000729975.b3lyp_6-31g(d).firefly.inp (generated)

000729975.b3lyp_6-31g(d).smash.inp (generated)

000729975.b3lyp_6-31g(d).nwchem.inp (generated) 000729975.b3lyp_6-31g(d).log.xz 000729975.td-b3lyp_6-31g+(d).inp 000729975.td-b3lyp_6-31g+(d).log.xz

000729975.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729975.td-b3lyp_6-31+g(d).gjf (generated)

000729975.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729975.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729975.mol 000729975.PUBCHEM 000729975.mol (via Jmol)
000729976.b3lyp_6-31g(d).inp

000729976.b3lyp_6-31g(d).qchem.inp (generated)

000729976.b3lyp_6-31g(d).gjf (generated)

000729976.b3lyp_6-31g(d).firefly.inp (generated)

000729976.b3lyp_6-31g(d).smash.inp (generated)

000729976.b3lyp_6-31g(d).nwchem.inp (generated) 000729976.b3lyp_6-31g(d).log.xz 000729976.td-b3lyp_6-31g+(d).inp 000729976.td-b3lyp_6-31g+(d).log.xz

000729976.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729976.td-b3lyp_6-31+g(d).gjf (generated)

000729976.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729976.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729976.mol 000729976.PUBCHEM 000729976.mol (via Jmol)
000729980.b3lyp_6-31g(d).inp

000729980.b3lyp_6-31g(d).qchem.inp (generated)

000729980.b3lyp_6-31g(d).gjf (generated)

000729980.b3lyp_6-31g(d).firefly.inp (generated)

000729980.b3lyp_6-31g(d).smash.inp (generated)

000729980.b3lyp_6-31g(d).nwchem.inp (generated) 000729980.b3lyp_6-31g(d).log.xz 000729980.td-b3lyp_6-31g+(d).inp 000729980.td-b3lyp_6-31g+(d).log.xz

000729980.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729980.td-b3lyp_6-31+g(d).gjf (generated)

000729980.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729980.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729980.mol 000729980.PUBCHEM 000729980.mol (via Jmol)
000729986.b3lyp_6-31g(d).inp

000729986.b3lyp_6-31g(d).qchem.inp (generated)

000729986.b3lyp_6-31g(d).gjf (generated)

000729986.b3lyp_6-31g(d).firefly.inp (generated)

000729986.b3lyp_6-31g(d).smash.inp (generated)

000729986.b3lyp_6-31g(d).nwchem.inp (generated) 000729986.b3lyp_6-31g(d).log.xz 000729986.td-b3lyp_6-31g+(d).inp 000729986.td-b3lyp_6-31g+(d).log.xz

000729986.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729986.td-b3lyp_6-31+g(d).gjf (generated)

000729986.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729986.mol 000729986.PUBCHEM 000729986.mol (via Jmol)
000729987.b3lyp_6-31g(d).inp

000729987.b3lyp_6-31g(d).qchem.inp (generated)

000729987.b3lyp_6-31g(d).gjf (generated)

000729987.b3lyp_6-31g(d).firefly.inp (generated)

000729987.b3lyp_6-31g(d).smash.inp (generated)

000729987.b3lyp_6-31g(d).nwchem.inp (generated) 000729987.b3lyp_6-31g(d).log.xz 000729987.td-b3lyp_6-31g+(d).inp 000729987.td-b3lyp_6-31g+(d).log.xz

000729987.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729987.td-b3lyp_6-31+g(d).gjf (generated)

000729987.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729987.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729987.mol 000729987.PUBCHEM 000729987.mol (via Jmol)
000729996.b3lyp_6-31g(d).inp

000729996.b3lyp_6-31g(d).qchem.inp (generated)

000729996.b3lyp_6-31g(d).gjf (generated)

000729996.b3lyp_6-31g(d).firefly.inp (generated)

000729996.b3lyp_6-31g(d).smash.inp (generated)

000729996.b3lyp_6-31g(d).nwchem.inp (generated) 000729996.b3lyp_6-31g(d).log.xz 000729996.mol 000729996.PUBCHEM 000729996.mol (via Jmol)
000729998.b3lyp_6-31g(d).inp

000729998.b3lyp_6-31g(d).qchem.inp (generated)

000729998.b3lyp_6-31g(d).gjf (generated)

000729998.b3lyp_6-31g(d).firefly.inp (generated)

000729998.b3lyp_6-31g(d).smash.inp (generated)

000729998.b3lyp_6-31g(d).nwchem.inp (generated) 000729998.b3lyp_6-31g(d).log.xz 000729998.td-b3lyp_6-31g+(d).inp 000729998.td-b3lyp_6-31g+(d).log.xz

000729998.td-b3lyp_6-31+g(d).qchem.inp (generated)

000729998.td-b3lyp_6-31+g(d).gjf (generated)

000729998.td-b3lyp_6-31+g(d).firefly.inp (generated)

000729998.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000729998.mol 000729998.PUBCHEM 000729998.mol (via Jmol)
000730001.b3lyp_6-31g(d).inp

000730001.b3lyp_6-31g(d).qchem.inp (generated)

000730001.b3lyp_6-31g(d).gjf (generated)

000730001.b3lyp_6-31g(d).firefly.inp (generated)

000730001.b3lyp_6-31g(d).smash.inp (generated)

000730001.b3lyp_6-31g(d).nwchem.inp (generated) 000730001.b3lyp_6-31g(d).log.xz 000730001.td-b3lyp_6-31g+(d).inp 000730001.td-b3lyp_6-31g+(d).log.xz

000730001.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730001.td-b3lyp_6-31+g(d).gjf (generated)

000730001.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730001.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730001.mol 000730001.PUBCHEM 000730001.mol (via Jmol)
000730030.b3lyp_6-31g(d).inp

000730030.b3lyp_6-31g(d).qchem.inp (generated)

000730030.b3lyp_6-31g(d).gjf (generated)

000730030.b3lyp_6-31g(d).firefly.inp (generated)

000730030.b3lyp_6-31g(d).smash.inp (generated)

000730030.b3lyp_6-31g(d).nwchem.inp (generated) 000730030.b3lyp_6-31g(d).log.xz 000730030.td-b3lyp_6-31g+(d).inp 000730030.td-b3lyp_6-31g+(d).log.xz

000730030.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730030.td-b3lyp_6-31+g(d).gjf (generated)

000730030.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730030.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730030.mol 000730030.PUBCHEM 000730030.mol (via Jmol)
000730031.b3lyp_6-31g(d).inp

000730031.b3lyp_6-31g(d).qchem.inp (generated)

000730031.b3lyp_6-31g(d).gjf (generated)

000730031.b3lyp_6-31g(d).firefly.inp (generated)

000730031.b3lyp_6-31g(d).smash.inp (generated)

000730031.b3lyp_6-31g(d).nwchem.inp (generated) 000730031.b3lyp_6-31g(d).log.xz 000730031.mol 000730031.PUBCHEM 000730031.mol (via Jmol)
000730033.b3lyp_6-31g(d).inp

000730033.b3lyp_6-31g(d).qchem.inp (generated)

000730033.b3lyp_6-31g(d).gjf (generated)

000730033.b3lyp_6-31g(d).firefly.inp (generated)

000730033.b3lyp_6-31g(d).smash.inp (generated)

000730033.b3lyp_6-31g(d).nwchem.inp (generated) 000730033.b3lyp_6-31g(d).log.xz 000730033.mol 000730033.PUBCHEM 000730033.mol (via Jmol)
000730034.b3lyp_6-31g(d).inp

000730034.b3lyp_6-31g(d).qchem.inp (generated)

000730034.b3lyp_6-31g(d).gjf (generated)

000730034.b3lyp_6-31g(d).firefly.inp (generated)

000730034.b3lyp_6-31g(d).smash.inp (generated)

000730034.b3lyp_6-31g(d).nwchem.inp (generated) 000730034.b3lyp_6-31g(d).log.xz 000730034.td-b3lyp_6-31g+(d).inp 000730034.td-b3lyp_6-31g+(d).log.xz

000730034.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730034.td-b3lyp_6-31+g(d).gjf (generated)

000730034.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730034.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730034.mol 000730034.PUBCHEM 000730034.mol (via Jmol)
000730041.b3lyp_6-31g(d).inp

000730041.b3lyp_6-31g(d).qchem.inp (generated)

000730041.b3lyp_6-31g(d).gjf (generated)

000730041.b3lyp_6-31g(d).firefly.inp (generated)

000730041.b3lyp_6-31g(d).smash.inp (generated)

000730041.b3lyp_6-31g(d).nwchem.inp (generated) 000730041.b3lyp_6-31g(d).log.xz 000730041.mol 000730041.PUBCHEM 000730041.mol (via Jmol)
000730046.b3lyp_6-31g(d).inp

000730046.b3lyp_6-31g(d).qchem.inp (generated)

000730046.b3lyp_6-31g(d).gjf (generated)

000730046.b3lyp_6-31g(d).firefly.inp (generated)

000730046.b3lyp_6-31g(d).smash.inp (generated)

000730046.b3lyp_6-31g(d).nwchem.inp (generated) 000730046.b3lyp_6-31g(d).log.xz 000730046.td-b3lyp_6-31g+(d).inp 000730046.td-b3lyp_6-31g+(d).log.xz

000730046.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730046.td-b3lyp_6-31+g(d).gjf (generated)

000730046.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730046.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730046.mol 000730046.PUBCHEM 000730046.mol (via Jmol)
000730051.b3lyp_6-31g(d).inp

000730051.b3lyp_6-31g(d).qchem.inp (generated)

000730051.b3lyp_6-31g(d).gjf (generated)

000730051.b3lyp_6-31g(d).firefly.inp (generated)

000730051.b3lyp_6-31g(d).smash.inp (generated)

000730051.b3lyp_6-31g(d).nwchem.inp (generated) 000730051.b3lyp_6-31g(d).log.xz 000730051.td-b3lyp_6-31g+(d).inp 000730051.td-b3lyp_6-31g+(d).log.xz

000730051.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730051.td-b3lyp_6-31+g(d).gjf (generated)

000730051.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730051.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730051.mol 000730051.PUBCHEM 000730051.mol (via Jmol)
000730064.b3lyp_6-31g(d).inp

000730064.b3lyp_6-31g(d).qchem.inp (generated)

000730064.b3lyp_6-31g(d).gjf (generated)

000730064.b3lyp_6-31g(d).firefly.inp (generated)

000730064.b3lyp_6-31g(d).smash.inp (generated)

000730064.b3lyp_6-31g(d).nwchem.inp (generated) 000730064.b3lyp_6-31g(d).log.xz 000730064.td-b3lyp_6-31g+(d).inp 000730064.td-b3lyp_6-31g+(d).log.xz

000730064.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730064.td-b3lyp_6-31+g(d).gjf (generated)

000730064.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730064.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730064.mol 000730064.PUBCHEM 000730064.mol (via Jmol)
000730065.b3lyp_6-31g(d).inp

000730065.b3lyp_6-31g(d).qchem.inp (generated)

000730065.b3lyp_6-31g(d).gjf (generated)

000730065.b3lyp_6-31g(d).firefly.inp (generated)

000730065.b3lyp_6-31g(d).smash.inp (generated)

000730065.b3lyp_6-31g(d).nwchem.inp (generated) 000730065.b3lyp_6-31g(d).log.xz 000730065.td-b3lyp_6-31g+(d).inp 000730065.td-b3lyp_6-31g+(d).log.xz

000730065.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730065.td-b3lyp_6-31+g(d).gjf (generated)

000730065.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730065.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730065.mol 000730065.PUBCHEM 000730065.mol (via Jmol)
000730067.b3lyp_6-31g(d).inp

000730067.b3lyp_6-31g(d).qchem.inp (generated)

000730067.b3lyp_6-31g(d).gjf (generated)

000730067.b3lyp_6-31g(d).firefly.inp (generated)

000730067.b3lyp_6-31g(d).smash.inp (generated)

000730067.b3lyp_6-31g(d).nwchem.inp (generated) 000730067.b3lyp_6-31g(d).log.xz 000730067.mol 000730067.PUBCHEM 000730067.mol (via Jmol)
000730070.b3lyp_6-31g(d).inp

000730070.b3lyp_6-31g(d).qchem.inp (generated)

000730070.b3lyp_6-31g(d).gjf (generated)

000730070.b3lyp_6-31g(d).firefly.inp (generated)

000730070.b3lyp_6-31g(d).smash.inp (generated)

000730070.b3lyp_6-31g(d).nwchem.inp (generated) 000730070.b3lyp_6-31g(d).log.xz 000730070.mol 000730070.PUBCHEM 000730070.mol (via Jmol)
000730084.b3lyp_6-31g(d).inp

000730084.b3lyp_6-31g(d).qchem.inp (generated)

000730084.b3lyp_6-31g(d).gjf (generated)

000730084.b3lyp_6-31g(d).firefly.inp (generated)

000730084.b3lyp_6-31g(d).smash.inp (generated)

000730084.b3lyp_6-31g(d).nwchem.inp (generated) 000730084.b3lyp_6-31g(d).log.xz 000730084.td-b3lyp_6-31g+(d).inp 000730084.td-b3lyp_6-31g+(d).log.xz

000730084.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730084.td-b3lyp_6-31+g(d).gjf (generated)

000730084.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730084.mol 000730084.PUBCHEM 000730084.mol (via Jmol)
000730091.b3lyp_6-31g(d).inp

000730091.b3lyp_6-31g(d).qchem.inp (generated)

000730091.b3lyp_6-31g(d).gjf (generated)

000730091.b3lyp_6-31g(d).firefly.inp (generated)

000730091.b3lyp_6-31g(d).smash.inp (generated)

000730091.b3lyp_6-31g(d).nwchem.inp (generated) 000730091.b3lyp_6-31g(d).log.xz 000730091.td-b3lyp_6-31g+(d).inp 000730091.td-b3lyp_6-31g+(d).log.xz

000730091.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730091.td-b3lyp_6-31+g(d).gjf (generated)

000730091.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730091.mol 000730091.PUBCHEM 000730091.mol (via Jmol)
000730093.b3lyp_6-31g(d).inp

000730093.b3lyp_6-31g(d).qchem.inp (generated)

000730093.b3lyp_6-31g(d).gjf (generated)

000730093.b3lyp_6-31g(d).firefly.inp (generated)

000730093.b3lyp_6-31g(d).smash.inp (generated)

000730093.b3lyp_6-31g(d).nwchem.inp (generated) 000730093.b3lyp_6-31g(d).log.xz 000730093.td-b3lyp_6-31g+(d).inp 000730093.td-b3lyp_6-31g+(d).log.xz

000730093.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730093.td-b3lyp_6-31+g(d).gjf (generated)

000730093.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730093.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730093.mol 000730093.PUBCHEM 000730093.mol (via Jmol)
000730097.b3lyp_6-31g(d).inp

000730097.b3lyp_6-31g(d).qchem.inp (generated)

000730097.b3lyp_6-31g(d).gjf (generated)

000730097.b3lyp_6-31g(d).firefly.inp (generated)

000730097.b3lyp_6-31g(d).smash.inp (generated)

000730097.b3lyp_6-31g(d).nwchem.inp (generated) 000730097.b3lyp_6-31g(d).log.xz 000730097.td-b3lyp_6-31g+(d).inp 000730097.td-b3lyp_6-31g+(d).log.xz

000730097.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730097.td-b3lyp_6-31+g(d).gjf (generated)

000730097.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730097.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730097.mol 000730097.PUBCHEM 000730097.mol (via Jmol)
000730107.b3lyp_6-31g(d).inp

000730107.b3lyp_6-31g(d).qchem.inp (generated)

000730107.b3lyp_6-31g(d).gjf (generated)

000730107.b3lyp_6-31g(d).firefly.inp (generated)

000730107.b3lyp_6-31g(d).smash.inp (generated)

000730107.b3lyp_6-31g(d).nwchem.inp (generated) 000730107.b3lyp_6-31g(d).log.xz 000730107.td-b3lyp_6-31g+(d).inp 000730107.td-b3lyp_6-31g+(d).log.xz

000730107.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730107.td-b3lyp_6-31+g(d).gjf (generated)

000730107.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730107.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730107.mol 000730107.PUBCHEM 000730107.mol (via Jmol)
000730109.b3lyp_6-31g(d).inp

000730109.b3lyp_6-31g(d).qchem.inp (generated)

000730109.b3lyp_6-31g(d).gjf (generated)

000730109.b3lyp_6-31g(d).firefly.inp (generated)

000730109.b3lyp_6-31g(d).smash.inp (generated)

000730109.b3lyp_6-31g(d).nwchem.inp (generated) 000730109.b3lyp_6-31g(d).log.xz 000730109.mol 000730109.PUBCHEM 000730109.mol (via Jmol)
000730117.b3lyp_6-31g(d).inp

000730117.b3lyp_6-31g(d).qchem.inp (generated)

000730117.b3lyp_6-31g(d).gjf (generated)

000730117.b3lyp_6-31g(d).firefly.inp (generated)

000730117.b3lyp_6-31g(d).smash.inp (generated)

000730117.b3lyp_6-31g(d).nwchem.inp (generated) 000730117.b3lyp_6-31g(d).log.xz 000730117.td-b3lyp_6-31g+(d).inp 000730117.td-b3lyp_6-31g+(d).log.xz

000730117.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730117.td-b3lyp_6-31+g(d).gjf (generated)

000730117.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730117.mol 000730117.PUBCHEM 000730117.mol (via Jmol)
000730125.b3lyp_6-31g(d).inp

000730125.b3lyp_6-31g(d).qchem.inp (generated)

000730125.b3lyp_6-31g(d).gjf (generated)

000730125.b3lyp_6-31g(d).firefly.inp (generated)

000730125.b3lyp_6-31g(d).smash.inp (generated)

000730125.b3lyp_6-31g(d).nwchem.inp (generated) 000730125.b3lyp_6-31g(d).log.xz 000730125.td-b3lyp_6-31g+(d).inp 000730125.td-b3lyp_6-31g+(d).log.xz

000730125.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730125.td-b3lyp_6-31+g(d).gjf (generated)

000730125.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730125.mol 000730125.PUBCHEM 000730125.mol (via Jmol)
000730128.b3lyp_6-31g(d).inp

000730128.b3lyp_6-31g(d).qchem.inp (generated)

000730128.b3lyp_6-31g(d).gjf (generated)

000730128.b3lyp_6-31g(d).firefly.inp (generated)

000730128.b3lyp_6-31g(d).smash.inp (generated)

000730128.b3lyp_6-31g(d).nwchem.inp (generated) 000730128.b3lyp_6-31g(d).log.xz 000730128.td-b3lyp_6-31g+(d).inp 000730128.td-b3lyp_6-31g+(d).log.xz

000730128.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730128.td-b3lyp_6-31+g(d).gjf (generated)

000730128.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730128.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730128.mol 000730128.PUBCHEM 000730128.mol (via Jmol)
000730136.b3lyp_6-31g(d).inp

000730136.b3lyp_6-31g(d).qchem.inp (generated)

000730136.b3lyp_6-31g(d).gjf (generated)

000730136.b3lyp_6-31g(d).firefly.inp (generated)

000730136.b3lyp_6-31g(d).smash.inp (generated)

000730136.b3lyp_6-31g(d).nwchem.inp (generated) 000730136.b3lyp_6-31g(d).log.xz 000730136.td-b3lyp_6-31g+(d).inp 000730136.td-b3lyp_6-31g+(d).log.xz

000730136.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730136.td-b3lyp_6-31+g(d).gjf (generated)

000730136.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730136.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730136.mol 000730136.PUBCHEM 000730136.mol (via Jmol)
000730142.b3lyp_6-31g(d).inp

000730142.b3lyp_6-31g(d).qchem.inp (generated)

000730142.b3lyp_6-31g(d).gjf (generated)

000730142.b3lyp_6-31g(d).firefly.inp (generated)

000730142.b3lyp_6-31g(d).smash.inp (generated)

000730142.b3lyp_6-31g(d).nwchem.inp (generated) 000730142.b3lyp_6-31g(d).log.xz 000730142.td-b3lyp_6-31g+(d).inp 000730142.td-b3lyp_6-31g+(d).log.xz

000730142.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730142.td-b3lyp_6-31+g(d).gjf (generated)

000730142.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730142.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730142.mol 000730142.PUBCHEM 000730142.mol (via Jmol)
000730145.b3lyp_6-31g(d).inp

000730145.b3lyp_6-31g(d).qchem.inp (generated)

000730145.b3lyp_6-31g(d).gjf (generated)

000730145.b3lyp_6-31g(d).firefly.inp (generated)

000730145.b3lyp_6-31g(d).smash.inp (generated)

000730145.b3lyp_6-31g(d).nwchem.inp (generated) 000730145.b3lyp_6-31g(d).log.xz 000730145.td-b3lyp_6-31g+(d).inp 000730145.td-b3lyp_6-31g+(d).log.xz

000730145.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730145.td-b3lyp_6-31+g(d).gjf (generated)

000730145.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730145.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730145.mol 000730145.PUBCHEM 000730145.mol (via Jmol)
000730169.b3lyp_6-31g(d).inp

000730169.b3lyp_6-31g(d).qchem.inp (generated)

000730169.b3lyp_6-31g(d).gjf (generated)

000730169.b3lyp_6-31g(d).firefly.inp (generated)

000730169.b3lyp_6-31g(d).smash.inp (generated)

000730169.b3lyp_6-31g(d).nwchem.inp (generated) 000730169.b3lyp_6-31g(d).log.xz 000730169.td-b3lyp_6-31g+(d).inp 000730169.td-b3lyp_6-31g+(d).log.xz

000730169.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730169.td-b3lyp_6-31+g(d).gjf (generated)

000730169.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730169.mol 000730169.PUBCHEM 000730169.mol (via Jmol)
000730193.b3lyp_6-31g(d).inp

000730193.b3lyp_6-31g(d).qchem.inp (generated)

000730193.b3lyp_6-31g(d).gjf (generated)

000730193.b3lyp_6-31g(d).firefly.inp (generated)

000730193.b3lyp_6-31g(d).smash.inp (generated)

000730193.b3lyp_6-31g(d).nwchem.inp (generated) 000730193.b3lyp_6-31g(d).log.xz 000730193.td-b3lyp_6-31g+(d).inp 000730193.td-b3lyp_6-31g+(d).log.xz

000730193.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730193.td-b3lyp_6-31+g(d).gjf (generated)

000730193.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730193.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730193.mol 000730193.PUBCHEM 000730193.mol (via Jmol)
000730195.b3lyp_6-31g(d).inp

000730195.b3lyp_6-31g(d).qchem.inp (generated)

000730195.b3lyp_6-31g(d).gjf (generated)

000730195.b3lyp_6-31g(d).firefly.inp (generated)

000730195.b3lyp_6-31g(d).smash.inp (generated)

000730195.b3lyp_6-31g(d).nwchem.inp (generated) 000730195.b3lyp_6-31g(d).log.xz 000730195.td-b3lyp_6-31g+(d).inp 000730195.td-b3lyp_6-31g+(d).log.xz

000730195.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730195.td-b3lyp_6-31+g(d).gjf (generated)

000730195.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730195.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730195.mol 000730195.PUBCHEM 000730195.mol (via Jmol)
000730201.b3lyp_6-31g(d).inp

000730201.b3lyp_6-31g(d).qchem.inp (generated)

000730201.b3lyp_6-31g(d).gjf (generated)

000730201.b3lyp_6-31g(d).firefly.inp (generated)

000730201.b3lyp_6-31g(d).smash.inp (generated)

000730201.b3lyp_6-31g(d).nwchem.inp (generated) 000730201.b3lyp_6-31g(d).log.xz 000730201.td-b3lyp_6-31g+(d).inp 000730201.td-b3lyp_6-31g+(d).log.xz

000730201.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730201.td-b3lyp_6-31+g(d).gjf (generated)

000730201.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730201.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730201.mol 000730201.PUBCHEM 000730201.mol (via Jmol)
000730204.b3lyp_6-31g(d).inp

000730204.b3lyp_6-31g(d).qchem.inp (generated)

000730204.b3lyp_6-31g(d).gjf (generated)

000730204.b3lyp_6-31g(d).firefly.inp (generated)

000730204.b3lyp_6-31g(d).smash.inp (generated)

000730204.b3lyp_6-31g(d).nwchem.inp (generated) 000730204.b3lyp_6-31g(d).log.xz 000730204.td-b3lyp_6-31g+(d).inp 000730204.td-b3lyp_6-31g+(d).log.xz

000730204.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730204.td-b3lyp_6-31+g(d).gjf (generated)

000730204.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730204.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730204.mol 000730204.PUBCHEM 000730204.mol (via Jmol)
000730207.b3lyp_6-31g(d).inp

000730207.b3lyp_6-31g(d).qchem.inp (generated)

000730207.b3lyp_6-31g(d).gjf (generated)

000730207.b3lyp_6-31g(d).firefly.inp (generated)

000730207.b3lyp_6-31g(d).smash.inp (generated)

000730207.b3lyp_6-31g(d).nwchem.inp (generated) 000730207.b3lyp_6-31g(d).log.xz 000730207.td-b3lyp_6-31g+(d).inp 000730207.td-b3lyp_6-31g+(d).log.xz

000730207.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730207.td-b3lyp_6-31+g(d).gjf (generated)

000730207.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730207.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730207.mol 000730207.PUBCHEM 000730207.mol (via Jmol)
000730210.b3lyp_6-31g(d).inp

000730210.b3lyp_6-31g(d).qchem.inp (generated)

000730210.b3lyp_6-31g(d).gjf (generated)

000730210.b3lyp_6-31g(d).firefly.inp (generated)

000730210.b3lyp_6-31g(d).smash.inp (generated)

000730210.b3lyp_6-31g(d).nwchem.inp (generated) 000730210.b3lyp_6-31g(d).log.xz 000730210.td-b3lyp_6-31g+(d).inp 000730210.td-b3lyp_6-31g+(d).log.xz

000730210.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730210.td-b3lyp_6-31+g(d).gjf (generated)

000730210.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730210.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730210.mol 000730210.PUBCHEM 000730210.mol (via Jmol)
000730211.b3lyp_6-31g(d).inp

000730211.b3lyp_6-31g(d).qchem.inp (generated)

000730211.b3lyp_6-31g(d).gjf (generated)

000730211.b3lyp_6-31g(d).firefly.inp (generated)

000730211.b3lyp_6-31g(d).smash.inp (generated)

000730211.b3lyp_6-31g(d).nwchem.inp (generated) 000730211.b3lyp_6-31g(d).log.xz 000730211.mol 000730211.PUBCHEM 000730211.mol (via Jmol)
000730212.b3lyp_6-31g(d).inp

000730212.b3lyp_6-31g(d).qchem.inp (generated)

000730212.b3lyp_6-31g(d).gjf (generated)

000730212.b3lyp_6-31g(d).firefly.inp (generated)

000730212.b3lyp_6-31g(d).smash.inp (generated)

000730212.b3lyp_6-31g(d).nwchem.inp (generated) 000730212.b3lyp_6-31g(d).log.xz 000730212.mol 000730212.PUBCHEM 000730212.mol (via Jmol)
000730218.b3lyp_6-31g(d).inp

000730218.b3lyp_6-31g(d).qchem.inp (generated)

000730218.b3lyp_6-31g(d).gjf (generated)

000730218.b3lyp_6-31g(d).firefly.inp (generated)

000730218.b3lyp_6-31g(d).smash.inp (generated)

000730218.b3lyp_6-31g(d).nwchem.inp (generated) 000730218.b3lyp_6-31g(d).log.xz 000730218.mol 000730218.PUBCHEM 000730218.mol (via Jmol)
000730220.b3lyp_6-31g(d).inp

000730220.b3lyp_6-31g(d).qchem.inp (generated)

000730220.b3lyp_6-31g(d).gjf (generated)

000730220.b3lyp_6-31g(d).firefly.inp (generated)

000730220.b3lyp_6-31g(d).smash.inp (generated)

000730220.b3lyp_6-31g(d).nwchem.inp (generated) 000730220.b3lyp_6-31g(d).log.xz 000730220.mol 000730220.PUBCHEM 000730220.mol (via Jmol)
000730223.b3lyp_6-31g(d).inp

000730223.b3lyp_6-31g(d).qchem.inp (generated)

000730223.b3lyp_6-31g(d).gjf (generated)

000730223.b3lyp_6-31g(d).firefly.inp (generated)

000730223.b3lyp_6-31g(d).smash.inp (generated)

000730223.b3lyp_6-31g(d).nwchem.inp (generated) 000730223.b3lyp_6-31g(d).log.xz 000730223.td-b3lyp_6-31g+(d).inp 000730223.td-b3lyp_6-31g+(d).log.xz

000730223.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730223.td-b3lyp_6-31+g(d).gjf (generated)

000730223.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730223.mol 000730223.PUBCHEM 000730223.mol (via Jmol)
000730224.b3lyp_6-31g(d).inp

000730224.b3lyp_6-31g(d).qchem.inp (generated)

000730224.b3lyp_6-31g(d).gjf (generated)

000730224.b3lyp_6-31g(d).firefly.inp (generated)

000730224.b3lyp_6-31g(d).smash.inp (generated)

000730224.b3lyp_6-31g(d).nwchem.inp (generated) 000730224.b3lyp_6-31g(d).log.xz 000730224.td-b3lyp_6-31g+(d).inp 000730224.td-b3lyp_6-31g+(d).log.xz

000730224.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730224.td-b3lyp_6-31+g(d).gjf (generated)

000730224.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730224.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730224.mol 000730224.PUBCHEM 000730224.mol (via Jmol)
000730244.b3lyp_6-31g(d).inp

000730244.b3lyp_6-31g(d).qchem.inp (generated)

000730244.b3lyp_6-31g(d).gjf (generated)

000730244.b3lyp_6-31g(d).firefly.inp (generated)

000730244.b3lyp_6-31g(d).smash.inp (generated)

000730244.b3lyp_6-31g(d).nwchem.inp (generated) 000730244.b3lyp_6-31g(d).log.xz 000730244.td-b3lyp_6-31g+(d).inp 000730244.td-b3lyp_6-31g+(d).log.xz

000730244.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730244.td-b3lyp_6-31+g(d).gjf (generated)

000730244.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730244.mol 000730244.PUBCHEM 000730244.mol (via Jmol)
000730246.b3lyp_6-31g(d).inp

000730246.b3lyp_6-31g(d).qchem.inp (generated)

000730246.b3lyp_6-31g(d).gjf (generated)

000730246.b3lyp_6-31g(d).firefly.inp (generated)

000730246.b3lyp_6-31g(d).smash.inp (generated)

000730246.b3lyp_6-31g(d).nwchem.inp (generated) 000730246.b3lyp_6-31g(d).log.xz 000730246.td-b3lyp_6-31g+(d).inp 000730246.td-b3lyp_6-31g+(d).log.xz

000730246.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730246.td-b3lyp_6-31+g(d).gjf (generated)

000730246.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730246.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730246.mol 000730246.PUBCHEM 000730246.mol (via Jmol)
000730248.b3lyp_6-31g(d).inp

000730248.b3lyp_6-31g(d).qchem.inp (generated)

000730248.b3lyp_6-31g(d).gjf (generated)

000730248.b3lyp_6-31g(d).firefly.inp (generated)

000730248.b3lyp_6-31g(d).smash.inp (generated)

000730248.b3lyp_6-31g(d).nwchem.inp (generated) 000730248.b3lyp_6-31g(d).log.xz 000730248.td-b3lyp_6-31g+(d).inp 000730248.td-b3lyp_6-31g+(d).log.xz

000730248.td-b3lyp_6-31+g(d).qchem.inp (generated)

000730248.td-b3lyp_6-31+g(d).gjf (generated)

000730248.td-b3lyp_6-31+g(d).firefly.inp (generated)

000730248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 000730248.mol 000730248.PUBCHEM 000730248.mol (via Jmol)
000730277.b3lyp_6-31g(d).inp

000730277.b3lyp_6-31g(d).qchem.inp (generated)

000730277.b3lyp_6-31g(d).gjf (generated)

000730277.b3lyp_6-31g(d).firefly.inp (generated)

000730277.b3lyp_6-31g(d).smash.inp (generated)

000730277.b3lyp_6-31g(d).nwchem.inp (generated) 000730277.b3lyp_6-31g(d).log.xz 000730277.mol 000730277.PUBCHEM 000730277.mol (via Jmol)
000730290.b3lyp_6-31g(d).inp

000730290.b3lyp_6-31g(d).qchem.inp (generated)

000730290.b3lyp_6-31g(d).gjf (generated)

000730290.b3lyp_6-31g(d).firefly.inp (generated)

000730290.b3lyp_6-31g(d).smash.inp (generated)

000730290.b3lyp_6-31g(d).nwchem.inp (generated) 000730290.b3lyp_6-31g(d).log.xz 000730290.mol 000730290.PUBCHEM 000730290.mol (via Jmol)
000730294.b3lyp_6-31g(d).inp

000730294.b3lyp_6-31g(d).qchem.inp (generated)

000730294.b3lyp_6-31g(d).gjf (generated)

000730294.b3lyp_6-31g(d).firefly.inp (generated)

000730294.b3lyp_6-31g(d).smash.inp (generated)

000730294.b3lyp_6-31g(d).nwchem.inp (generated) 000730294.b3lyp_6-31g(d).log.xz 000730294.mol 000730294.PUBCHEM 000730294.mol (via Jmol)
000730306.b3lyp_6-31g(d).inp

000730306.b3lyp_6-31g(d).qchem.inp (generated)

000730306.b3lyp_6-31g(d).gjf</